data_1h8b_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 1h8b _Structure_validation_residue.Date_analyzed 2016-10-06 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 ' 6' ' ' THR . . . . . 0.529 HG21 ' CZ ' ' A' ' 68' ' ' TYR . 1.6 m . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.099 0.476 . . . . 0.0 110.107 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -70.28 -44.23 68.81 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.074 -1.017 . . . . 0.0 109.476 179.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -62.02 -36.09 80.51 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.471 -0.768 . . . . 0.0 109.906 179.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -60.79 -43.08 98.58 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.33 -0.856 . . . . 0.0 110.097 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 62.0 t -66.06 -42.81 92.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.116 -0.99 . . . . 0.0 109.631 179.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 61.9 mt -61.45 -49.67 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.298 -0.876 . . . . 0.0 109.318 179.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.65 -39.09 92.79 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.377 -0.827 . . . . 0.0 109.228 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.2 m -68.18 -44.18 76.47 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.41 -0.806 . . . . 0.0 109.479 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.556 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 0.6 OUTLIER -65.7 -42.59 91.01 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.307 -0.87 . . . . 0.0 109.497 179.386 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.19 -42.91 70.22 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.343 -0.848 . . . . 0.0 109.416 179.308 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.435 HD11 HG23 ' A' ' 16' ' ' ILE . 17.0 mt -60.55 -44.85 97.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.35 -0.843 . . . . 0.0 109.583 179.509 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.527 ' CD1' ' HB3' ' A' ' 32' ' ' GLU . 2.5 mm? -65.09 -40.67 94.94 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.359 -0.838 . . . . 0.0 109.966 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.478 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -75.51 1.3 14.53 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.298 -0.876 . . . . 0.0 110.311 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.478 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.1 OUTLIER 67.0 69.18 0.4 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.209 -0.932 . . . . 0.0 110.303 179.866 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 47.04 56.21 7.07 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.243 -0.911 . . . . 0.0 110.28 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.516 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 18.5 mttp -134.34 143.49 47.12 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.16 -0.963 . . . . 0.0 110.023 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -73.83 -0.05 8.91 Favored 'Trans proline' 0 C--N 1.304 -1.815 0 O-C-N 124.04 1.547 . . . . 0.0 110.122 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.516 ' CZ ' ' HD3' ' A' ' 21' ' ' LYS . 23.1 p90 -145.94 163.18 35.96 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.237 -0.914 . . . . 0.0 110.22 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.472 HD13 ' HB3' ' A' ' 28' ' ' GLU . 0.3 OUTLIER -127.07 142.14 44.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.301 -0.874 . . . . 0.0 109.735 179.89 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 44.1 mt -88.59 152.26 21.95 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.242 -0.911 . . . . 0.0 110.352 -179.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.26 -44.32 95.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.36 -0.837 . . . . 0.0 110.069 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -60.19 -34.97 74.35 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.365 -0.834 . . . . 0.0 110.242 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.472 ' HB3' HD13 ' A' ' 24' ' ' ILE . 9.0 mm-40 -61.87 -49.59 75.65 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.23 -0.919 . . . . 0.0 109.931 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.442 HD23 HG13 ' A' ' 24' ' ' ILE . 9.1 mt -59.53 -34.17 72.3 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.264 -0.898 . . . . 0.0 109.814 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.17 -42.26 93.86 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.329 -0.857 . . . . 0.0 110.174 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -91.33 -20.36 21.94 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.198 -0.938 . . . . 0.0 110.456 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.527 ' HB3' ' CD1' ' A' ' 17' ' ' LEU . 17.0 mm-40 -98.68 -23.76 15.32 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.08 -1.012 . . . . 0.0 110.409 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.448 HD21 ' HB3' ' A' ' 37' ' ' GLN . 0.3 OUTLIER -128.16 147.72 64.65 Favored Pre-proline 0 N--CA 1.487 1.393 0 O-C-N 121.165 -0.959 . . . . 0.0 110.066 179.962 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.497 ' O ' ' N ' ' A' ' 37' ' ' GLN . 5.9 Cg_exo -43.59 131.03 7.32 Favored 'Trans proline' 0 C--N 1.304 -1.782 0 O-C-N 123.89 1.469 . . . . 0.0 109.679 179.402 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.429 ' C ' ' O ' ' A' ' 34' ' ' PRO . 12.0 Cg_exo -36.8 -42.38 0.77 Allowed 'Trans proline' 0 C--N 1.306 -1.67 0 O-C-N 124.254 1.66 . . . . 0.0 110.619 -179.392 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -65.94 -36.64 83.89 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.352 -0.843 . . . . 0.0 110.857 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.497 ' N ' ' O ' ' A' ' 34' ' ' PRO . 1.8 mp0 -69.09 -44.5 72.35 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.064 -1.023 . . . . 0.0 110.784 -179.262 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.519 ' O ' ' CD1' ' A' ' 42' ' ' ILE . . . -58.66 -47.24 85.14 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.195 -0.94 . . . . 0.0 110.707 -179.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.4 tp60 -60.3 -49.43 77.63 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.227 -0.92 . . . . 0.0 110.995 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 51.6 t80 -61.84 -48.0 82.55 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.009 -1.057 . . . . 0.0 110.436 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.447 ' O ' ' SD ' ' A' ' 45' ' ' MET . 69.8 m -65.35 -49.51 69.08 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.256 -0.902 . . . . 0.0 110.64 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.519 ' CD1' ' O ' ' A' ' 38' ' ' ALA . 18.6 mt -44.45 -24.66 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.12 -0.988 . . . . 0.0 110.535 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -84.15 -41.28 17.22 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.173 -0.955 . . . . 0.0 110.743 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.519 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 1.5 mmt-85 -64.11 -72.62 0.14 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.12 -0.987 . . . . 0.0 110.59 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.468 ' CB ' ' O ' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -48.01 116.9 5.1 Favored Pre-proline 0 N--CA 1.489 1.475 0 O-C-N 121.14 -0.975 . . . . 0.0 110.394 -179.841 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo . . . . . 0 C--N 1.305 -1.728 0 O-C-N 124.14 1.6 . . . . 0.0 110.45 -179.982 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 121.252 0.549 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 25.1 mt -135.88 147.54 48.23 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.197 -0.94 . . . . 0.0 110.147 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.468 ' O ' ' CB ' ' A' ' 45' ' ' MET . 0.7 OUTLIER -103.37 111.83 24.43 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.19 -0.944 . . . . 0.0 110.291 179.916 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.556 ' HB2' ' CD2' ' A' ' 14' ' ' PHE . 8.0 p90 -81.66 -19.81 40.9 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.275 -0.89 . . . . 0.0 109.63 179.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.53 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -61.48 -40.76 95.73 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.415 -0.803 . . . . 0.0 109.853 179.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.53 -36.21 82.13 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.211 -0.931 . . . . 0.0 109.662 179.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.519 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 2.4 t80 -72.07 -34.75 68.95 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.722 -0.611 . . . . 0.0 110.18 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.3 p -60.91 -42.4 97.98 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.331 -0.856 . . . . 0.0 110.38 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 8.5 t -64.14 -36.86 85.43 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.218 -0.926 . . . . 0.0 110.486 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.7 -41.0 84.28 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.211 -0.931 . . . . 0.0 110.473 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.436 HD23 ' O ' ' B' ' 19' ' ' ALA . 0.4 OUTLIER -58.5 -44.07 89.32 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.208 -0.933 . . . . 0.0 110.187 -179.911 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.529 ' CZ ' HG21 ' A' ' 6' ' ' THR . 39.4 m-85 . . . . . 0 N--CA 1.49 1.531 0 O-C-N 121.237 -0.914 . . . . 0.0 110.473 -179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 5.6 tttt . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.194 0.521 . . . . 0.0 110.072 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 14.5 tttt -67.86 -46.71 70.96 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.297 -0.877 . . . . 0.0 110.148 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.1 -41.08 71.18 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.259 -0.901 . . . . 0.0 109.816 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -60.55 -40.3 91.09 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.299 -0.876 . . . . 0.0 109.71 179.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.19 -42.12 99.28 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.425 -0.797 . . . . 0.0 110.028 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.412 ' O ' ' CG2' ' B' ' 17' ' ' VAL . 46.6 t -61.28 -40.59 86.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.212 -0.93 . . . . 0.0 109.703 179.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . 0.457 ' O ' ' HB1' ' B' ' 18' ' ' ALA . . . -58.0 -39.24 77.78 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.259 -0.901 . . . . 0.0 109.499 179.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.7 m -68.82 -47.21 66.63 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.384 -0.822 . . . . 0.0 109.576 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 26.4 t -63.46 -45.54 97.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.316 -0.865 . . . . 0.0 109.595 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.412 ' CG2' ' O ' ' B' ' 13' ' ' VAL . 49.4 t -62.45 -49.68 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.263 -0.898 . . . . 0.0 109.437 179.283 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . 0.457 ' HB1' ' O ' ' B' ' 14' ' ' ALA . . . -56.1 -43.07 77.74 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.363 -0.836 . . . . 0.0 109.924 179.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.436 ' O ' HD23 ' A' ' 67' ' ' LEU . . . -67.18 -36.75 82.45 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.278 -0.888 . . . . 0.0 109.906 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . 0.449 HG12 ' HG3' ' A' ' 37' ' ' GLN . 55.4 t -65.29 -41.43 91.39 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 121.187 -0.946 . . . . 0.0 109.713 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.3 -31.66 72.29 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.349 -0.844 . . . . 0.0 110.129 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.25 -51.23 70.84 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.232 -0.917 . . . . 0.0 110.087 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.26 -34.36 77.83 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.223 -0.923 . . . . 0.0 109.858 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.3 ttt180 . . . . . 0 N--CA 1.492 1.652 0 O-C-N 121.405 -0.809 . . . . 0.0 110.474 -179.811 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.58 ' CG2' ' CE1' ' A' ' 68' ' ' TYR . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 121.28 0.562 . . . . 0.0 110.245 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.33 -47.45 76.48 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.287 -0.883 . . . . 0.0 109.866 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -54.59 -36.34 64.31 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.382 -0.824 . . . . 0.0 109.828 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.415 ' O ' ' OG ' ' A' ' 13' ' ' SER . 4.2 tp60 -61.63 -48.05 82.63 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.322 -0.861 . . . . 0.0 110.151 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 12.6 t -64.3 -43.08 97.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.139 -0.975 . . . . 0.0 109.9 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 30.6 mt -62.0 -48.31 89.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 121.273 -0.892 . . . . 0.0 109.621 179.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.51 -41.01 79.95 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.223 -0.923 . . . . 0.0 109.006 179.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.415 ' OG ' ' O ' ' A' ' 9' ' ' GLN . 3.7 m -68.16 -39.09 82.68 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.431 -0.793 . . . . 0.0 109.371 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.486 ' CG ' ' HB2' ' A' ' 60' ' ' TYR . 2.6 m-85 -68.58 -45.35 72.29 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.386 -0.822 . . . . 0.0 109.73 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 11.3 tpp85 -53.72 -41.18 66.74 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.345 -0.847 . . . . 0.0 109.55 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 42.5 mt -62.37 -44.54 99.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.401 -0.812 . . . . 0.0 109.922 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 56.8 mt -64.84 -41.75 95.48 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.344 -0.848 . . . . 0.0 109.861 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.454 ' O ' ' HE3' ' A' ' 21' ' ' LYS . . . -67.86 -7.88 31.74 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.304 -0.872 . . . . 0.0 110.106 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.8 t 62.43 68.79 0.64 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.268 -0.895 . . . . 0.0 110.302 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 58.36 53.79 6.12 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.245 -0.909 . . . . 0.0 110.189 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.454 ' HE3' ' O ' ' A' ' 18' ' ' ALA . 18.8 mtmt -141.9 143.36 28.23 Favored Pre-proline 0 N--CA 1.489 1.51 0 O-C-N 121.209 -0.932 . . . . 0.0 110.078 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -78.58 5.39 5.59 Favored 'Trans proline' 0 C--N 1.304 -1.787 0 O-C-N 124.078 1.568 . . . . 0.0 109.96 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.475 ' N ' ' CD1' ' A' ' 23' ' ' TYR . 28.9 p90 -145.3 159.83 42.43 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.279 -0.888 . . . . 0.0 109.963 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.541 ' CD1' ' CD2' ' A' ' 29' ' ' LEU . 0.3 OUTLIER -126.71 143.21 40.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.154 -0.966 . . . . 0.0 109.882 179.816 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -100.66 150.64 22.53 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.29 -0.881 . . . . 0.0 110.407 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.0 -33.12 66.83 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.283 -0.886 . . . . 0.0 109.74 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -61.53 -40.07 93.32 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.335 -0.853 . . . . 0.0 109.67 179.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.441 ' HB3' HD13 ' A' ' 24' ' ' ILE . 0.6 OUTLIER -68.56 -48.44 64.27 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.389 -0.819 . . . . 0.0 109.794 179.568 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.541 ' CD2' ' CD1' ' A' ' 24' ' ' ILE . 4.3 mm? -60.78 -34.24 74.2 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.198 -0.939 . . . . 0.0 109.738 179.612 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.0 mmm-85 -68.96 -34.72 75.8 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.36 -0.837 . . . . 0.0 110.109 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.64 -14.6 27.92 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.344 -0.847 . . . . 0.0 110.579 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -106.7 -23.53 12.4 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.078 -1.014 . . . . 0.0 110.693 -179.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.459 HD21 ' CD ' ' A' ' 34' ' ' PRO . 6.4 mt -122.61 164.6 25.6 Favored Pre-proline 0 N--CA 1.488 1.431 0 O-C-N 121.073 -1.017 . . . . 0.0 110.249 -179.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.459 ' CD ' HD21 ' A' ' 33' ' ' LEU . 33.8 Cg_exo -66.11 144.81 76.95 Favored 'Trans proline' 0 C--N 1.305 -1.761 0 O-C-N 124.036 1.545 . . . . 0.0 109.908 179.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.433 ' C ' ' O ' ' A' ' 34' ' ' PRO . 19.4 Cg_endo -40.48 -44.96 4.44 Favored 'Trans proline' 0 C--N 1.304 -1.802 0 O-C-N 124.032 1.543 . . . . 0.0 110.414 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.72 -37.49 86.57 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.244 -0.91 . . . . 0.0 110.729 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.45 ' O ' ' SG ' ' A' ' 41' ' ' CYS . 0.0 OUTLIER -69.26 -45.83 68.76 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.137 -0.977 . . . . 0.0 110.554 -179.579 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.55 -44.21 96.39 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.156 -0.965 . . . . 0.0 110.582 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.9 tp60 -66.1 -46.53 77.3 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.096 -1.003 . . . . 0.0 110.473 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -63.28 -45.99 88.87 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.239 -0.913 . . . . 0.0 110.342 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.45 ' SG ' ' O ' ' A' ' 37' ' ' GLN . 74.9 m -60.93 -44.34 97.34 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.253 -0.904 . . . . 0.0 110.54 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 25.5 mt -53.88 -24.2 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.2 -0.937 . . . . 0.0 110.305 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.9 tttm -81.06 -19.43 43.79 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.127 -0.983 . . . . 0.0 110.227 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.576 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 26.4 mmt180 -92.24 -68.5 0.79 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.277 -0.889 . . . . 0.0 110.304 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.454 ' HE2' ' HA ' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -55.55 109.6 1.73 Allowed Pre-proline 0 N--CA 1.489 1.489 0 O-C-N 121.186 -0.946 . . . . 0.0 110.324 179.907 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.425 ' HD3' ' O ' ' A' ' 44' ' ' ARG . 19.7 Cg_exo . . . . . 0 C--N 1.304 -1.791 0 O-C-N 124.076 1.566 . . . . 0.0 110.217 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 121.26 0.552 . . . . 0.0 110.284 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.1 mt -121.66 160.15 25.05 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.24 -0.912 . . . . 0.0 110.015 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.451 ' O ' ' HB2' ' A' ' 45' ' ' MET . 6.2 t0 -97.6 111.61 23.81 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.252 -0.905 . . . . 0.0 110.349 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.605 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 11.2 p90 -79.6 -23.42 42.69 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.27 -0.894 . . . . 0.0 109.279 179.354 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.605 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -60.01 -42.96 95.41 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.395 -0.816 . . . . 0.0 109.657 179.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.79 -32.83 72.16 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.247 -0.908 . . . . 0.0 109.868 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.576 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 1.3 t80 -71.63 -36.77 70.86 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.687 -0.633 . . . . 0.0 110.372 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.2 m -61.47 -38.89 88.89 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.147 -0.971 . . . . 0.0 110.457 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 44.8 p -68.37 -42.36 79.26 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.205 -0.934 . . . . 0.0 110.418 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -63.65 -38.11 89.87 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.216 -0.928 . . . . 0.0 110.619 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.77 -42.3 88.65 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.146 -0.971 . . . . 0.0 110.529 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.58 ' CE1' ' CG2' ' A' ' 6' ' ' THR . 28.3 m-85 . . . . . 0 N--CA 1.492 1.637 0 O-C-N 121.181 -0.949 . . . . 0.0 110.431 -179.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.281 0.562 . . . . 0.0 110.176 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.95 -48.49 71.16 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.276 -0.89 . . . . 0.0 110.035 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.15 -37.43 66.95 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.28 -0.887 . . . . 0.0 109.883 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -66.23 -40.2 90.09 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.274 -0.891 . . . . 0.0 109.804 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.42 -43.78 98.01 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.259 -0.901 . . . . 0.0 109.649 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 76.6 t -58.78 -40.34 79.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.193 -0.942 . . . . 0.0 109.485 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.06 -38.85 92.82 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.46 -0.775 . . . . 0.0 109.966 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 57.2 m -69.12 -45.53 69.95 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.396 -0.815 . . . . 0.0 110.172 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 70.3 t -62.47 -46.95 95.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.214 -0.928 . . . . 0.0 109.983 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.439 HG21 HD22 ' A' ' 33' ' ' LEU . 77.3 t -60.56 -49.15 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.182 -0.949 . . . . 0.0 110.009 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.5 -39.39 76.38 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.303 -0.873 . . . . 0.0 110.107 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.86 -45.39 78.32 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.309 -0.869 . . . . 0.0 110.116 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 53.3 t -61.85 -41.68 91.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.306 -0.871 . . . . 0.0 110.132 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.07 -38.51 91.48 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.299 -0.875 . . . . 0.0 110.169 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -55.83 -41.35 74.14 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.193 -0.942 . . . . 0.0 110.295 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.5 -42.53 95.76 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.214 -0.929 . . . . 0.0 110.282 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.2 mmm-85 . . . . . 0 N--CA 1.49 1.551 0 O-C-N 121.3 -0.875 . . . . 0.0 110.317 -179.848 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.443 ' HB ' ' CZ ' ' A' ' 68' ' ' TYR . 9.5 p . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 121.242 0.544 . . . . 0.0 110.1 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.02 -44.82 83.22 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.201 -0.937 . . . . 0.0 109.431 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -60.49 -36.2 77.74 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.407 -0.808 . . . . 0.0 109.591 179.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -61.8 -48.56 80.07 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.3 -0.875 . . . . 0.0 110.322 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.48 ' CG1' ' CE2' ' A' ' 14' ' ' PHE . 46.6 t -58.54 -41.22 81.32 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.08 -1.012 . . . . 0.0 109.589 179.574 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 64.8 mt -61.3 -45.66 98.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.412 -0.805 . . . . 0.0 109.472 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.22 -47.2 83.51 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.32 -0.863 . . . . 0.0 109.144 179.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.457 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 14.2 m -62.92 -39.26 94.03 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.284 -0.885 . . . . 0.0 109.009 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.48 ' CE2' ' CG1' ' A' ' 10' ' ' VAL . 1.2 m-85 -66.98 -43.29 83.38 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.434 -0.791 . . . . 0.0 109.41 179.23 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.52 ' CD ' ' HA ' ' A' ' 20' ' ' ASP . 0.0 OUTLIER -53.18 -43.11 66.85 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.29 -0.881 . . . . 0.0 109.009 179.184 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 39.7 mt -58.89 -44.81 91.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.463 -0.773 . . . . 0.0 109.432 179.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 13' ' ' SER . 33.2 mt -65.05 -41.99 94.66 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.232 -0.917 . . . . 0.0 109.779 179.567 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.459 ' O ' ' HB2' ' A' ' 21' ' ' LYS . . . -76.33 -2.07 29.9 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.421 -0.799 . . . . 0.0 110.195 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.455 ' O ' ' C ' ' A' ' 20' ' ' ASP . 0.4 OUTLIER 64.93 77.37 0.31 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.317 -0.864 . . . . 0.0 110.328 179.783 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.52 ' HA ' ' CD ' ' A' ' 15' ' ' ARG . 4.6 p-10 37.44 45.36 0.56 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.593 -0.692 . . . . 0.0 110.517 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.459 ' HB2' ' O ' ' A' ' 18' ' ' ALA . 10.7 mmtt -122.08 144.89 42.5 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.351 -0.843 . . . . 0.0 110.116 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -65.5 -8.2 18.4 Favored 'Trans proline' 0 C--N 1.304 -1.783 0 O-C-N 124.218 1.641 . . . . 0.0 110.209 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.542 ' N ' ' CD1' ' A' ' 23' ' ' TYR . 19.5 p90 -143.85 167.53 22.1 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.315 -0.866 . . . . 0.0 110.288 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.508 HD11 HG22 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -123.19 140.66 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.303 -0.873 . . . . 0.0 109.767 179.797 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 mp -81.47 149.96 28.51 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.142 -0.974 . . . . 0.0 110.216 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.458 ' HA ' HD12 ' A' ' 42' ' ' ILE . . . -61.47 -40.03 93.06 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.368 -0.832 . . . . 0.0 110.268 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -63.59 -36.28 83.29 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.219 -0.926 . . . . 0.0 109.899 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.47 ' O ' ' CG ' ' A' ' 32' ' ' GLU . 2.6 mm-40 -60.62 -37.53 81.73 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.248 -0.907 . . . . 0.0 109.3 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 22.9 mt -66.53 -36.33 82.42 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.394 -0.816 . . . . 0.0 109.606 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.0 mtt85 -68.81 -34.53 75.68 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.331 -0.856 . . . . 0.0 110.116 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.9 -18.67 21.71 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.293 -0.88 . . . . 0.0 110.773 -179.499 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.47 ' CG ' ' O ' ' A' ' 28' ' ' GLU . 12.6 mm-40 -99.55 -23.61 15.03 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.025 -1.047 . . . . 0.0 110.745 -179.616 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.483 HD21 ' HD2' ' A' ' 34' ' ' PRO . 2.3 mt -128.63 141.83 42.86 Favored Pre-proline 0 N--CA 1.488 1.475 0 O-C-N 121.055 -1.028 . . . . 0.0 110.12 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.483 ' HD2' HD21 ' A' ' 33' ' ' LEU . 31.6 Cg_exo -43.58 130.91 7.28 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.825 1.434 . . . . 0.0 109.634 179.51 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.458 ' C ' ' O ' ' A' ' 34' ' ' PRO . 32.3 Cg_exo -35.18 -38.95 0.2 Allowed 'Trans proline' 0 C--N 1.308 -1.598 0 O-C-N 124.274 1.671 . . . . 0.0 110.904 -179.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.15 -43.9 85.7 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.35 -0.843 . . . . 0.0 110.954 -179.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.474 ' HB3' HD21 ' A' ' 33' ' ' LEU . 2.5 mp0 -70.02 -42.02 73.52 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.081 -1.012 . . . . 0.0 110.99 -179.301 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.48 ' O ' HG12 ' A' ' 42' ' ' ILE . . . -55.87 -45.83 78.44 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.245 -0.909 . . . . 0.0 110.662 -179.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -54.53 -46.86 73.64 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.111 -0.993 . . . . 0.0 110.68 -179.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -63.16 -47.01 84.48 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.094 -1.004 . . . . 0.0 110.551 -179.638 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.469 ' O ' ' HG2' ' A' ' 45' ' ' MET . 84.3 m -65.33 -48.36 73.3 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.15 -0.969 . . . . 0.0 110.681 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.48 HG12 ' O ' ' A' ' 38' ' ' ALA . 15.9 mm -47.58 -31.06 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.127 -0.983 . . . . 0.0 110.876 -179.529 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 10.2 tttt -85.01 -36.7 21.11 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.105 -0.997 . . . . 0.0 110.374 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.582 ' HG3' ' CE1' ' A' ' 63' ' ' PHE . 9.3 mmp_? -60.13 -73.42 0.09 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.34 -0.85 . . . . 0.0 110.271 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.5 ' HE3' ' HB3' ' A' ' 60' ' ' TYR . 21.2 ptp -56.73 138.97 77.24 Favored Pre-proline 0 N--CA 1.488 1.453 0 O-C-N 121.213 -0.929 . . . . 0.0 110.301 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo . . . . . 0 C--N 1.306 -1.694 0 O-C-N 123.963 1.507 . . . . 0.0 110.504 -179.769 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 121.287 0.565 . . . . 0.0 110.335 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.2 mp -114.95 159.54 20.61 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.306 -0.871 . . . . 0.0 109.725 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.458 ' O ' ' HB2' ' A' ' 45' ' ' MET . 4.9 m-20 -108.39 110.61 22.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.024 -1.048 . . . . 0.0 110.479 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.558 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 15.0 p90 -73.35 -26.7 61.13 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.336 -0.852 . . . . 0.0 110.14 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.558 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.13 -36.36 68.16 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.273 -0.892 . . . . 0.0 109.983 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.12 -34.41 76.33 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.248 -0.907 . . . . 0.0 109.885 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.582 ' CE1' ' HG3' ' A' ' 44' ' ' ARG . 2.7 t80 -71.77 -33.44 68.61 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.591 -0.693 . . . . 0.0 110.246 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.7 p -58.26 -48.19 81.2 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.302 -0.874 . . . . 0.0 110.383 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.3 t -68.55 -38.65 80.97 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.223 -0.923 . . . . 0.0 110.324 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.16 -31.03 71.63 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.235 -0.916 . . . . 0.0 110.367 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.462 ' HG ' ' CE1' ' A' ' 63' ' ' PHE . 0.5 OUTLIER -69.25 -43.27 74.31 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.243 -0.911 . . . . 0.0 110.326 -179.823 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.443 ' CZ ' ' HB ' ' A' ' 6' ' ' THR . 29.5 m-85 . . . . . 0 N--CA 1.492 1.639 0 O-C-N 121.185 -0.947 . . . . 0.0 110.236 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.199 0.523 . . . . 0.0 110.231 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 8.6 ttpt -58.19 -47.29 83.87 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.183 -0.948 . . . . 0.0 110.101 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.69 -37.8 74.11 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.197 -0.939 . . . . 0.0 110.128 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -63.65 -40.21 96.28 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.183 -0.948 . . . . 0.0 110.217 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . 0.433 ' HB1' ' HA ' ' A' ' 13' ' ' SER . . . -62.43 -43.07 99.69 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.284 -0.885 . . . . 0.0 110.036 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 87.4 t -62.71 -40.36 88.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.176 -0.952 . . . . 0.0 109.753 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.64 -36.3 82.38 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.421 -0.799 . . . . 0.0 110.182 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 34.8 m -69.85 -40.22 75.92 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.269 -0.894 . . . . 0.0 110.252 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.445 ' O ' HG21 ' B' ' 20' ' ' VAL . 57.6 t -69.01 -41.74 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.254 -0.904 . . . . 0.0 110.243 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 18.6 t -60.9 -44.41 97.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.286 -0.884 . . . . 0.0 110.101 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.35 -44.77 93.89 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.235 -0.915 . . . . 0.0 110.197 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.93 -45.76 87.78 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.237 -0.914 . . . . 0.0 110.082 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . 0.445 HG21 ' O ' ' B' ' 16' ' ' VAL . 88.3 t -61.45 -47.23 94.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.349 -0.844 . . . . 0.0 110.16 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . 0.453 ' HA ' ' HD3' ' B' ' 24' ' ' ARG . 15.0 t70 -55.72 -31.89 62.88 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.124 -0.985 . . . . 0.0 109.709 179.718 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -64.35 -36.49 84.3 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.422 -0.799 . . . . 0.0 110.353 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.33 -40.38 90.42 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.33 -0.856 . . . . 0.0 110.451 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . 0.453 ' HD3' ' HA ' ' B' ' 21' ' ' ASP . 0.2 OUTLIER . . . . . 0 N--CA 1.493 1.693 0 O-C-N 121.082 -1.011 . . . . 0.0 109.726 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.454 HG23 ' OH ' ' A' ' 68' ' ' TYR . 1.2 m . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 121.144 0.497 . . . . 0.0 110.171 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.74 -40.39 97.07 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.267 -0.896 . . . . 0.0 109.264 179.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -54.31 -34.44 60.96 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.541 -0.724 . . . . 0.0 109.459 179.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -60.08 -40.86 91.02 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.428 -0.795 . . . . 0.0 110.213 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.479 HG11 ' CD2' ' A' ' 14' ' ' PHE . 96.3 t -58.16 -42.42 83.2 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.052 -1.03 . . . . 0.0 109.453 179.514 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 75.3 mt -62.42 -49.29 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.394 -0.816 . . . . 0.0 109.368 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.09 -46.68 87.66 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.425 -0.797 . . . . 0.0 109.259 179.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 45.4 m -63.35 -40.41 97.2 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.339 -0.851 . . . . 0.0 109.223 179.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.497 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 1.6 m-85 -68.5 -41.2 80.38 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.396 -0.815 . . . . 0.0 109.569 179.221 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.18 -45.95 68.73 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.287 -0.883 . . . . 0.0 109.425 179.477 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.6 mt -58.24 -44.58 88.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.314 -0.866 . . . . 0.0 109.286 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.5 mp -64.97 -39.0 92.82 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.374 -0.829 . . . . 0.0 109.796 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.427 ' HB3' ' HB ' ' A' ' 24' ' ' ILE . . . -81.62 9.66 7.3 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.327 -0.858 . . . . 0.0 110.254 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 60.72 50.02 5.84 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.155 -0.966 . . . . 0.0 110.278 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.1 t70 59.38 58.76 2.88 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.334 -0.854 . . . . 0.0 110.43 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.9 mttp -139.68 141.67 28.82 Favored Pre-proline 0 N--CA 1.49 1.541 0 O-C-N 121.299 -0.876 . . . . 0.0 109.9 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -61.64 -11.79 21.97 Favored 'Trans proline' 0 C--N 1.304 -1.778 0 O-C-N 124.076 1.566 . . . . 0.0 109.913 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.407 ' O ' ' HB2' ' A' ' 18' ' ' ALA . 43.4 p90 -138.92 167.45 22.0 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.35 -0.844 . . . . 0.0 110.094 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.52 HD12 ' CD2' ' A' ' 29' ' ' LEU . 9.2 tt -144.67 158.78 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.267 -0.896 . . . . 0.0 110.214 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 16.1 mt -88.14 141.36 28.62 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.277 -0.89 . . . . 0.0 110.099 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.57 -33.7 70.24 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.247 -0.908 . . . . 0.0 110.343 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -62.71 -38.81 91.93 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.205 -0.935 . . . . 0.0 110.134 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -58.59 -40.76 84.07 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.215 -0.928 . . . . 0.0 109.489 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.52 ' CD2' HD12 ' A' ' 24' ' ' ILE . 2.1 mm? -59.37 -36.06 75.06 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.319 -0.863 . . . . 0.0 109.6 179.432 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 44.0 mtt180 -69.14 -34.72 75.45 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.381 -0.824 . . . . 0.0 110.506 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.0 ttt180 -87.26 -18.01 31.21 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.289 -0.882 . . . . 0.0 111.032 -179.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -101.73 -23.66 14.19 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.98 -1.075 . . . . 0.0 110.967 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.488 ' CD2' ' HB3' ' A' ' 37' ' ' GLN . 0.1 OUTLIER -126.93 164.87 32.39 Favored Pre-proline 0 C--N 1.303 -1.455 0 O-C-N 121.019 -1.05 . . . . 0.0 110.365 -179.805 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.455 ' HD2' HD21 ' A' ' 33' ' ' LEU . 30.9 Cg_exo -58.08 138.57 86.61 Favored 'Trans proline' 0 C--N 1.302 -1.904 0 O-C-N 124.173 1.617 . . . . 0.0 109.882 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.422 ' C ' ' O ' ' A' ' 34' ' ' PRO . 16.0 Cg_exo -40.11 -40.67 2.86 Favored 'Trans proline' 0 C--N 1.303 -1.817 0 O-C-N 124.052 1.554 . . . . 0.0 110.438 -179.643 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.426 ' OD1' ' CD ' ' A' ' 37' ' ' GLN . 1.4 p30 -65.94 -41.77 90.86 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.242 -0.911 . . . . 0.0 110.896 -179.578 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.488 ' HB3' ' CD2' ' A' ' 33' ' ' LEU . 0.4 OUTLIER -69.35 -39.51 78.08 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.021 -1.049 . . . . 0.0 110.763 -179.382 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.32 -43.53 98.71 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.135 -0.978 . . . . 0.0 110.871 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -64.22 -47.67 78.81 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.064 -1.023 . . . . 0.0 110.818 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.61 -43.15 97.73 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.126 -0.984 . . . . 0.0 110.511 -179.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.443 ' SG ' ' O ' ' A' ' 37' ' ' GLN . 72.7 m -65.05 -49.64 69.33 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.257 -0.902 . . . . 0.0 110.579 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 27.5 mt -61.44 -17.6 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.156 -0.965 . . . . 0.0 110.279 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -84.64 -19.67 32.55 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.103 -0.998 . . . . 0.0 110.293 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.419 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 5.1 mmt85 -88.99 -69.69 0.69 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.179 -0.95 . . . . 0.0 110.096 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.464 ' HE3' ' CA ' ' A' ' 60' ' ' TYR . 13.7 ptp -45.65 135.35 6.1 Favored Pre-proline 0 N--CA 1.488 1.43 0 O-C-N 121.243 -0.911 . . . . 0.0 110.248 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo . . . . . 0 C--N 1.305 -1.75 0 O-C-N 123.968 1.509 . . . . 0.0 110.308 -179.849 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.176 0.512 . . . . 0.0 110.091 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.433 ' HB3' ' SD ' ' A' ' 45' ' ' MET . 1.5 mt -119.42 159.93 23.28 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.21 -0.931 . . . . 0.0 110.337 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.42 ' O ' ' HB2' ' A' ' 45' ' ' MET . 3.4 m-20 -114.44 113.58 24.68 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.29 -0.881 . . . . 0.0 110.047 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.497 ' HB2' ' CD2' ' A' ' 14' ' ' PHE . 18.7 p90 -77.7 -22.08 51.02 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.247 -0.908 . . . . 0.0 110.205 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.446 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.26 -36.54 68.68 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.244 -0.91 . . . . 0.0 109.958 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.02 -34.68 76.96 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.277 -0.889 . . . . 0.0 109.865 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.45 ' O ' ' HB2' ' A' ' 67' ' ' LEU . 3.3 t80 -72.06 -29.2 63.9 Favored 'General case' 0 C--N 1.298 -1.674 0 O-C-N 121.578 -0.701 . . . . 0.0 109.938 179.579 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.2 p -65.39 -46.73 78.93 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.355 -0.841 . . . . 0.0 110.115 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 47.5 m -66.36 -43.82 84.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.338 -0.851 . . . . 0.0 109.994 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.95 -31.91 73.38 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.341 -0.849 . . . . 0.0 110.154 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.45 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.5 OUTLIER -63.4 -41.06 98.73 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.215 -0.928 . . . . 0.0 110.248 -179.966 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.454 ' OH ' HG23 ' A' ' 6' ' ' THR . 35.0 m-85 . . . . . 0 N--CA 1.489 1.499 0 O-C-N 121.289 -0.882 . . . . 0.0 110.369 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 8.2 mmtt . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 121.173 0.511 . . . . 0.0 110.295 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 3.0 tttt -63.67 -33.51 75.79 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.271 -0.893 . . . . 0.0 110.213 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.53 -42.73 99.71 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.258 -0.901 . . . . 0.0 110.14 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -61.16 -41.03 96.04 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.214 -0.929 . . . . 0.0 110.085 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.51 -45.21 91.72 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.287 -0.883 . . . . 0.0 110.189 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 71.3 t -60.82 -42.47 92.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.297 -0.877 . . . . 0.0 110.207 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.1 -38.71 80.16 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.249 -0.907 . . . . 0.0 110.182 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 65.3 m -66.49 -38.51 87.44 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.27 -0.894 . . . . 0.0 110.075 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.468 ' O ' ' CG2' ' B' ' 20' ' ' VAL . 74.0 t -69.91 -46.48 73.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.332 -0.855 . . . . 0.0 110.18 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 80.2 t -58.35 -46.55 89.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.278 -0.889 . . . . 0.0 110.093 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.34 -43.68 98.26 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.268 -0.895 . . . . 0.0 110.071 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.02 -45.63 84.71 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.277 -0.89 . . . . 0.0 110.174 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . 0.468 ' CG2' ' O ' ' B' ' 16' ' ' VAL . 43.2 t -59.21 -45.32 92.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.328 -0.858 . . . . 0.0 110.165 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . 0.471 ' HA ' ' HG2' ' B' ' 24' ' ' ARG . 12.8 t70 -60.52 -32.92 71.93 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.274 -0.891 . . . . 0.0 110.238 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -66.82 -40.82 88.16 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.206 -0.934 . . . . 0.0 110.478 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . 0.438 ' HB2' HD23 ' A' ' 67' ' ' LEU . . . -65.98 -42.65 89.56 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.247 -0.908 . . . . 0.0 110.961 -179.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . 0.471 ' HG2' ' HA ' ' B' ' 21' ' ' ASP . 3.0 ptp180 . . . . . 0 N--CA 1.493 1.68 0 O-C-N 121.048 -1.032 . . . . 0.0 110.76 -179.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.529 HG23 ' CE2' ' A' ' 68' ' ' TYR . 2.1 m . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 121.21 0.529 . . . . 0.0 110.213 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.82 -44.53 85.34 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.22 -0.925 . . . . 0.0 109.582 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 29.1 tp10 -54.56 -35.93 63.81 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.384 -0.822 . . . . 0.0 109.889 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -60.91 -43.02 99.16 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.376 -0.828 . . . . 0.0 110.26 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 45.0 t -59.98 -49.76 82.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.148 -0.97 . . . . 0.0 109.915 179.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 46.2 mt -55.08 -49.15 74.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.322 -0.861 . . . . 0.0 109.44 179.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.29 -43.26 83.02 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.297 -0.877 . . . . 0.0 109.096 179.123 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.2 m -66.7 -38.92 87.72 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.374 -0.829 . . . . 0.0 109.308 179.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.57 ' HB3' ' CE1' ' A' ' 60' ' ' TYR . 1.2 m-85 -67.83 -40.79 83.71 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.311 -0.868 . . . . 0.0 109.412 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -55.47 -48.9 73.8 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.315 -0.865 . . . . 0.0 109.526 179.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 37.7 mt -57.99 -42.2 82.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.391 -0.818 . . . . 0.0 109.917 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.49 ' CD1' ' HB3' ' A' ' 32' ' ' GLU . 2.7 mm? -65.09 -41.63 94.81 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.337 -0.852 . . . . 0.0 110.074 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.505 ' CB ' HG12 ' A' ' 24' ' ' ILE . . . -78.76 0.24 27.65 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.41 -0.806 . . . . 0.0 110.151 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.493 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 68.65 60.43 0.37 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.332 -0.855 . . . . 0.0 110.502 179.801 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.9 t70 59.04 52.34 6.38 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.202 -0.936 . . . . 0.0 110.42 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.408 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 32.8 mmtt -134.64 143.1 45.1 Favored Pre-proline 0 N--CA 1.489 1.503 0 O-C-N 121.198 -0.939 . . . . 0.0 110.07 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_endo -72.49 -1.68 10.62 Favored 'Trans proline' 0 C--N 1.305 -1.722 0 O-C-N 124.032 1.543 . . . . 0.0 109.988 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.443 ' O ' ' HB2' ' A' ' 18' ' ' ALA . 46.9 p90 -143.92 164.38 30.73 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.276 -0.89 . . . . 0.0 110.142 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.505 HG12 ' CB ' ' A' ' 18' ' ' ALA . 0.4 OUTLIER -129.08 149.44 33.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.211 -0.931 . . . . 0.0 110.034 -179.816 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.427 ' N ' HD11 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -91.68 143.95 26.02 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.225 -0.922 . . . . 0.0 110.205 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.47 -45.44 84.81 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.29 -0.881 . . . . 0.0 110.268 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -59.42 -36.0 75.05 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.323 -0.861 . . . . 0.0 110.395 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.438 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 4.7 tt0 -65.17 -42.82 93.3 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.298 -0.876 . . . . 0.0 110.166 -179.775 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 25.3 mt -64.01 -35.7 81.58 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.201 -0.937 . . . . 0.0 109.914 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.446 ' HA ' ' HB3' ' A' ' 38' ' ' ALA . 5.4 ttm-85 -67.99 -34.8 77.23 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.417 -0.802 . . . . 0.0 110.104 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 22.7 ttt-85 -90.84 -26.21 19.51 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.346 -0.846 . . . . 0.0 110.661 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.49 ' HB3' ' CD1' ' A' ' 17' ' ' LEU . 3.5 mm-40 -92.33 -23.58 19.21 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.226 -0.921 . . . . 0.0 111.235 -179.157 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.535 HD21 ' CB ' ' A' ' 37' ' ' GLN . 0.3 OUTLIER -124.26 164.78 27.88 Favored Pre-proline 0 N--CA 1.49 1.563 0 O-C-N 120.899 -1.126 . . . . 0.0 110.526 -179.562 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.468 ' HD2' HD21 ' A' ' 33' ' ' LEU . 34.3 Cg_exo -63.44 145.46 92.37 Favored 'Trans proline' 0 C--N 1.307 -1.652 0 O-C-N 124.072 1.564 . . . . 0.0 110.178 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -43.87 -35.75 7.32 Favored 'Trans proline' 0 C--N 1.302 -1.876 0 O-C-N 124.081 1.569 . . . . 0.0 110.472 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.97 -47.38 74.79 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.089 -1.007 . . . . 0.0 110.725 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.535 ' CB ' HD21 ' A' ' 33' ' ' LEU . 1.4 mp0 -69.81 -42.96 72.99 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.112 -0.993 . . . . 0.0 110.455 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.466 ' O ' ' CG1' ' A' ' 42' ' ' ILE . . . -56.64 -44.13 80.96 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.248 -0.908 . . . . 0.0 110.476 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -63.38 -49.12 75.1 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.185 -0.947 . . . . 0.0 110.321 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -66.44 -47.93 71.59 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.232 -0.918 . . . . 0.0 110.2 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.405 ' SG ' HG23 ' B' ' 20' ' ' VAL . 71.1 m -63.95 -43.6 95.36 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.207 -0.933 . . . . 0.0 110.147 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.466 ' CG1' ' O ' ' A' ' 38' ' ' ALA . 48.6 mt -61.4 -24.01 32.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.246 -0.908 . . . . 0.0 109.998 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.62 -41.94 15.87 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.212 -0.93 . . . . 0.0 110.224 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.579 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 2.4 mmp_? -66.99 -64.3 0.88 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.193 -0.942 . . . . 0.0 110.106 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.492 ' SD ' ' CG2' ' A' ' 24' ' ' ILE . 1.9 ttm -36.04 101.59 0.22 Allowed Pre-proline 0 N--CA 1.494 1.743 0 O-C-N 121.581 -0.699 . . . . 0.0 111.029 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.446 ' HD3' ' O ' ' A' ' 44' ' ' ARG . 12.7 Cg_endo . . . . . 0 C--N 1.305 -1.746 0 O-C-N 124.0 1.526 . . . . 0.0 109.781 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.186 0.517 . . . . 0.0 110.15 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.422 ' HB3' ' HG2' ' A' ' 45' ' ' MET . 58.3 mt -122.11 156.75 32.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.253 -0.904 . . . . 0.0 110.159 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.468 ' OD2' ' N ' ' A' ' 62' ' ' ALA . 7.3 t70 -103.91 110.98 23.32 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.135 -0.978 . . . . 0.0 110.583 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.581 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 20.5 p90 -71.36 -25.93 62.59 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.208 -0.933 . . . . 0.0 109.09 179.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.581 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.16 -41.48 75.49 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.493 -0.755 . . . . 0.0 109.563 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.468 ' N ' ' OD2' ' A' ' 59' ' ' ASP . . . -62.1 -37.5 85.3 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.301 -0.875 . . . . 0.0 109.611 179.378 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.579 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 2.6 t80 -71.87 -38.87 69.96 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.643 -0.661 . . . . 0.0 110.008 179.561 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.7 p -60.11 -47.13 87.18 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.339 -0.851 . . . . 0.0 110.294 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.41 -35.73 81.8 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.328 -0.858 . . . . 0.0 110.227 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.01 -32.74 59.54 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.289 -0.882 . . . . 0.0 110.179 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.522 HD13 ' CZ ' ' A' ' 63' ' ' PHE . 0.4 OUTLIER -55.16 -38.0 67.72 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.204 -0.935 . . . . 0.0 110.278 179.962 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.529 ' CE2' HG23 ' A' ' 6' ' ' THR . 16.3 m-85 . . . . . 0 N--CA 1.491 1.62 0 O-C-N 121.197 -0.939 . . . . 0.0 110.357 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 121.241 0.543 . . . . 0.0 110.261 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 7.5 ttmt -68.14 -33.14 73.94 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.246 -0.909 . . . . 0.0 110.188 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.7 96.96 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.255 -0.903 . . . . 0.0 110.072 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -63.5 -40.48 97.18 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.201 -0.937 . . . . 0.0 110.03 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.7 -43.53 84.12 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.285 -0.885 . . . . 0.0 110.032 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 59.3 t -63.08 -44.14 99.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.433 -0.792 . . . . 0.0 110.108 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.05 -41.61 92.68 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.268 -0.895 . . . . 0.0 109.921 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 99.9 m -62.6 -42.91 99.85 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.211 -0.931 . . . . 0.0 109.932 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 56.7 t -65.17 -45.34 94.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.389 -0.819 . . . . 0.0 109.974 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.46 HG21 ' CD2' ' A' ' 33' ' ' LEU . 76.1 t -60.28 -47.01 94.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.302 -0.874 . . . . 0.0 109.883 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.3 -42.83 82.5 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.288 -0.882 . . . . 0.0 110.04 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.25 -40.63 86.27 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.348 -0.845 . . . . 0.0 109.859 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . 0.405 HG23 ' SG ' ' A' ' 41' ' ' CYS . 98.6 t -64.9 -47.28 88.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.308 -0.87 . . . . 0.0 110.113 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 54.2 t0 -64.9 -32.51 74.26 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.262 -0.899 . . . . 0.0 110.087 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -58.21 -48.32 80.71 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.233 -0.917 . . . . 0.0 110.123 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.92 -38.89 87.36 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.318 -0.864 . . . . 0.0 110.37 -179.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 . . . . . 0 N--CA 1.492 1.65 0 O-C-N 121.169 -0.957 . . . . 0.0 110.318 -179.993 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.2 p . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.166 0.507 . . . . 0.0 110.17 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.73 -48.83 73.16 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.208 -0.932 . . . . 0.0 109.874 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -54.75 -36.16 64.52 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.402 -0.811 . . . . 0.0 110.055 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -61.19 -43.98 98.02 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.272 -0.892 . . . . 0.0 110.226 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 73.2 t -58.07 -45.64 88.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.14 -0.975 . . . . 0.0 109.686 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 36.8 mt -58.05 -47.2 87.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.404 -0.81 . . . . 0.0 109.335 179.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.56 -44.01 84.92 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.324 -0.86 . . . . 0.0 108.907 179.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.452 ' HA ' ' HB1' ' B' ' 12' ' ' ALA . 46.5 m -65.23 -40.13 93.66 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.373 -0.829 . . . . 0.0 108.976 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.471 ' HB3' ' CE2' ' A' ' 60' ' ' TYR . 3.1 m-85 -68.53 -41.34 80.05 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.432 -0.793 . . . . 0.0 109.509 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.0 ttt180 -53.5 -45.37 69.64 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.39 -0.819 . . . . 0.0 109.547 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.411 HG22 HD11 ' A' ' 16' ' ' ILE . 56.0 mt -61.53 -42.98 96.07 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 O-C-N 121.285 -0.884 . . . . 0.0 109.784 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.7 mp -63.68 -40.47 96.9 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.34 -0.85 . . . . 0.0 109.9 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.465 ' HB2' ' O ' ' A' ' 23' ' ' TYR . . . -79.53 4.72 14.93 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.377 -0.827 . . . . 0.0 110.218 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.433 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.4 OUTLIER 65.21 58.91 0.85 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.219 -0.926 . . . . 0.0 110.243 -179.986 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 54.51 63.99 1.97 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.263 -0.898 . . . . 0.0 110.345 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.1 mttp -144.86 143.12 19.87 Favored Pre-proline 0 N--CA 1.49 1.542 0 O-C-N 121.266 -0.896 . . . . 0.0 110.007 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -69.89 -4.41 14.05 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 O-C-N 124.037 1.546 . . . . 0.0 110.082 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.465 ' O ' ' HB2' ' A' ' 18' ' ' ALA . 50.1 p90 -138.66 165.39 27.04 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.276 -0.89 . . . . 0.0 109.873 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.539 HD12 ' N ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -139.86 138.53 38.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.165 -0.959 . . . . 0.0 110.277 -179.773 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.539 ' N ' HD12 ' A' ' 24' ' ' ILE . 5.4 tp -80.3 147.98 30.92 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.281 -0.887 . . . . 0.0 109.911 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.451 ' HA ' HD22 ' A' ' 29' ' ' LEU . . . -62.05 -26.85 68.5 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.233 -0.917 . . . . 0.0 110.143 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -70.56 -36.21 73.51 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.334 -0.854 . . . . 0.0 110.318 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.48 ' HB2' ' CD1' ' A' ' 24' ' ' ILE . 10.6 mt-10 -67.91 -50.18 57.66 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.232 -0.917 . . . . 0.0 110.254 -179.623 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.517 HD22 ' CD1' ' A' ' 42' ' ' ILE . 1.2 pp -66.54 -33.81 76.5 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.196 -0.94 . . . . 0.0 109.703 179.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.487 ' N ' HD13 ' A' ' 29' ' ' LEU . 0.0 OUTLIER -62.37 -35.73 80.05 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.36 -0.838 . . . . 0.0 109.977 179.908 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.82 -8.53 30.82 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.416 -0.802 . . . . 0.0 110.472 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -98.38 -23.27 15.67 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.1 -1.0 . . . . 0.0 110.673 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.477 ' CD2' ' CG2' ' B' ' 17' ' ' VAL . 2.9 mt -120.07 155.77 55.27 Favored Pre-proline 0 N--CA 1.488 1.453 0 O-C-N 121.159 -0.963 . . . . 0.0 110.464 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.441 ' HD2' HD22 ' A' ' 33' ' ' LEU . 51.4 Cg_exo -54.92 144.06 69.22 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 O-C-N 124.022 1.538 . . . . 0.0 110.271 179.702 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.409 ' C ' ' O ' ' A' ' 34' ' ' PRO . 26.5 Cg_endo -39.81 -42.41 3.04 Favored 'Trans proline' 0 C--N 1.304 -1.788 0 O-C-N 124.104 1.581 . . . . 0.0 110.59 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.07 -46.88 76.15 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.293 -0.88 . . . . 0.0 111.102 -179.433 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.467 ' HB3' HD21 ' A' ' 33' ' ' LEU . 33.3 mm-40 -69.53 -41.42 76.01 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.021 -1.05 . . . . 0.0 110.741 -179.291 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.454 ' HB2' ' HA ' ' A' ' 30' ' ' ARG . . . -56.08 -42.01 76.02 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.165 -0.96 . . . . 0.0 110.678 -179.513 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -60.11 -47.9 83.97 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.11 -0.994 . . . . 0.0 110.743 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -58.56 -44.23 89.65 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.189 -0.945 . . . . 0.0 110.559 -179.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 72.0 m -65.26 -42.54 93.14 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.173 -0.954 . . . . 0.0 110.358 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.517 ' CD1' HD22 ' A' ' 29' ' ' LEU . 1.1 mm -67.67 -21.64 27.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 O-C-N 121.259 -0.901 . . . . 0.0 110.474 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.81 -30.28 28.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.272 -0.892 . . . . 0.0 111.068 -179.303 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.564 ' HG2' ' CE1' ' A' ' 63' ' ' PHE . 1.1 mpt_? -94.32 -64.14 1.11 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.982 -1.074 . . . . 0.0 111.082 -179.229 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.543 ' CE ' ' HB3' ' A' ' 60' ' ' TYR . 5.5 ttm -30.0 112.15 0.29 Allowed Pre-proline 0 N--CA 1.497 1.886 0 O-C-N 121.796 -0.565 . . . . 0.0 111.305 -179.615 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo . . . . . 0 C--N 1.308 -1.595 0 O-C-N 124.232 1.648 . . . . 0.0 110.395 -179.815 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.289 0.566 . . . . 0.0 110.251 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.455 ' HB3' ' HG2' ' A' ' 45' ' ' MET . 1.4 mt -124.17 160.33 28.1 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.322 -0.861 . . . . 0.0 110.054 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.445 ' C ' ' HG3' ' A' ' 45' ' ' MET . 2.1 m-20 -113.91 112.03 22.68 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.144 -0.973 . . . . 0.0 110.694 -179.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.543 ' HB3' ' CE ' ' A' ' 45' ' ' MET . 14.2 p90 -73.67 -21.16 60.35 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.402 -0.811 . . . . 0.0 109.784 179.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.533 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.64 -36.73 67.34 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.36 -0.838 . . . . 0.0 109.466 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.45 -36.37 78.91 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.352 -0.842 . . . . 0.0 109.424 179.271 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.564 ' CE1' ' HG2' ' A' ' 44' ' ' ARG . 6.5 t80 -71.83 -35.42 69.9 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.787 -0.571 . . . . 0.0 110.06 179.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 32.1 t -58.35 -47.51 83.54 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.249 -0.907 . . . . 0.0 109.974 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 11.2 m -62.62 -36.9 84.26 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.197 -0.939 . . . . 0.0 109.901 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.63 -37.84 82.78 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.261 -0.899 . . . . 0.0 109.959 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.455 HD12 ' O ' ' B' ' 19' ' ' ALA . 0.5 OUTLIER -58.96 -42.7 90.52 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.27 -0.894 . . . . 0.0 110.123 179.885 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 . . . . . 0 N--CA 1.489 1.516 0 O-C-N 121.204 -0.935 . . . . 0.0 110.27 -179.963 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 31.7 mttp . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.248 0.547 . . . . 0.0 110.131 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 5.4 ttpt -57.95 -49.48 76.64 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.245 -0.909 . . . . 0.0 110.121 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.88 -38.27 78.44 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.322 -0.861 . . . . 0.0 110.116 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -64.85 -40.71 95.59 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.25 -0.906 . . . . 0.0 110.102 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . 0.452 ' HB1' ' HA ' ' A' ' 13' ' ' SER . . . -66.43 -41.9 88.48 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.251 -0.906 . . . . 0.0 110.136 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 93.2 t -61.4 -42.18 92.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.204 -0.935 . . . . 0.0 110.135 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.75 -40.87 96.65 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.262 -0.899 . . . . 0.0 110.172 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 14.6 m -62.79 -48.91 77.1 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.272 -0.892 . . . . 0.0 110.082 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 80.4 t -60.38 -47.23 93.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.25 -0.906 . . . . 0.0 110.084 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.477 ' CG2' ' CD2' ' A' ' 33' ' ' LEU . 58.2 t -60.58 -48.26 89.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.25 -0.906 . . . . 0.0 110.119 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.2 -44.09 92.25 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.224 -0.922 . . . . 0.0 109.943 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.455 ' O ' HD12 ' A' ' 67' ' ' LEU . . . -67.23 -44.87 78.42 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.361 -0.837 . . . . 0.0 109.934 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 99.5 t -67.26 -43.58 88.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.248 -0.907 . . . . 0.0 110.107 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -57.57 -35.8 70.84 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.282 -0.886 . . . . 0.0 110.116 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -55.03 -45.17 75.17 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.295 -0.878 . . . . 0.0 110.106 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.86 -37.32 85.85 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.347 -0.845 . . . . 0.0 110.192 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.281 -0.887 . . . . 0.0 110.108 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.218 0.533 . . . . 0.0 110.264 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.99 -46.89 88.91 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.271 -0.893 . . . . 0.0 109.843 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -54.28 -36.56 63.77 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.308 -0.87 . . . . 0.0 109.536 179.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 10.5 tp60 -62.44 -46.34 88.97 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.328 -0.858 . . . . 0.0 109.949 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.477 HG11 ' CD2' ' A' ' 14' ' ' PHE . 38.4 t -58.7 -41.48 82.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.342 -0.849 . . . . 0.0 109.963 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 51.0 mt -57.92 -49.58 80.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.328 -0.858 . . . . 0.0 109.427 179.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.91 -38.33 75.66 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 119.573 -0.851 . . . . 0.0 108.873 178.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.1 m -68.0 -40.55 83.0 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.486 -0.759 . . . . 0.0 109.294 179.048 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.554 ' CB ' ' CD1' ' A' ' 60' ' ' TYR . 4.1 m-85 -68.23 -41.35 81.36 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.303 -0.873 . . . . 0.0 109.649 179.467 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -54.43 -44.82 72.77 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.284 -0.885 . . . . 0.0 109.452 179.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.414 HG22 ' HA ' ' B' ' 9' ' ' LYS . 46.4 mt -62.22 -40.97 89.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.343 -0.848 . . . . 0.0 109.83 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.486 HD13 ' HB3' ' A' ' 32' ' ' GLU . 2.9 mm? -64.74 -41.69 95.74 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.218 -0.926 . . . . 0.0 109.829 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.453 ' O ' ' HB3' ' A' ' 19' ' ' SER . . . -81.76 4.24 22.77 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.323 -0.86 . . . . 0.0 110.201 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.453 ' HB3' ' O ' ' A' ' 18' ' ' ALA . 4.9 t 65.09 64.45 0.63 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.199 -0.938 . . . . 0.0 110.278 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 54.94 60.12 3.66 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.267 -0.896 . . . . 0.0 110.368 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.557 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 18.1 mttm -141.66 142.95 27.44 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.3 -0.875 . . . . 0.0 110.01 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -76.07 2.69 6.86 Favored 'Trans proline' 0 C--N 1.304 -1.803 0 O-C-N 124.147 1.604 . . . . 0.0 110.178 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.557 ' CZ ' ' HD3' ' A' ' 21' ' ' LYS . 32.9 p90 -143.7 155.08 44.09 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.307 -0.871 . . . . 0.0 110.107 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.525 HD13 ' CD2' ' A' ' 29' ' ' LEU . 0.4 OUTLIER -129.18 147.88 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.268 -0.895 . . . . 0.0 110.016 -179.871 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.47 ' N ' HD11 ' A' ' 24' ' ' ILE . 8.0 mp -92.14 146.37 23.78 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.134 -0.979 . . . . 0.0 110.431 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.14 -43.02 99.53 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.345 -0.847 . . . . 0.0 110.304 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -56.28 -39.6 72.92 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.252 -0.905 . . . . 0.0 109.834 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.454 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 0.7 OUTLIER -63.66 -45.44 90.17 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.427 -0.796 . . . . 0.0 109.523 179.724 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.531 ' CD1' HD11 ' A' ' 33' ' ' LEU . 3.1 mm? -58.32 -34.29 70.43 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.392 -0.818 . . . . 0.0 109.72 179.633 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 28.1 mtp180 -69.1 -34.78 75.64 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.354 -0.842 . . . . 0.0 110.652 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 10.1 ttt180 -93.88 -25.57 17.26 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.127 -0.983 . . . . 0.0 111.085 -179.176 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.486 ' HB3' HD13 ' A' ' 17' ' ' LEU . 2.7 mp0 -90.91 -23.34 20.52 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.0 -1.063 . . . . 0.0 111.197 -179.162 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.546 HD21 ' CB ' ' A' ' 37' ' ' GLN . 0.3 OUTLIER -128.61 160.86 60.59 Favored Pre-proline 0 N--CA 1.489 1.492 0 O-C-N 120.94 -1.1 . . . . 0.0 110.559 -179.606 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.446 ' HD2' ' CD2' ' A' ' 33' ' ' LEU . 28.0 Cg_exo -58.77 144.12 98.49 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 O-C-N 124.035 1.545 . . . . 0.0 110.241 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -46.64 -30.6 9.12 Favored 'Trans proline' 0 C--N 1.304 -1.78 0 O-C-N 124.093 1.575 . . . . 0.0 110.43 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -65.75 -47.37 75.48 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.22 -0.925 . . . . 0.0 110.556 -179.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.546 ' CB ' HD21 ' A' ' 33' ' ' LEU . 2.0 mp0 -69.66 -38.32 77.05 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.197 -0.94 . . . . 0.0 110.254 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.22 -44.03 79.16 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.319 -0.863 . . . . 0.0 110.293 -179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -64.88 -45.09 87.46 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.254 -0.904 . . . . 0.0 110.317 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -65.6 -47.21 76.48 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.166 -0.959 . . . . 0.0 110.39 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 62.8 m -65.36 -42.74 92.46 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.242 -0.911 . . . . 0.0 110.502 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.499 HG22 HD11 ' A' ' 42' ' ' ILE . 68.6 mt -71.68 -16.26 18.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.238 -0.914 . . . . 0.0 110.535 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.9 tptt -84.64 -17.55 38.25 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.221 -0.924 . . . . 0.0 110.263 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.579 ' HB2' ' CD2' ' A' ' 63' ' ' PHE . 4.9 mtt85 -105.13 -66.54 0.97 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.321 -0.862 . . . . 0.0 110.563 -179.628 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.53 ' C ' ' O ' ' A' ' 44' ' ' ARG . 3.1 ttm -26.35 108.98 0.2 Allowed Pre-proline 0 N--CA 1.499 1.985 0 O-C-N 121.877 -0.515 . . . . 0.0 111.495 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.461 ' HG2' ' OD1' ' A' ' 59' ' ' ASP . 10.8 Cg_endo . . . . . 0 C--N 1.307 -1.646 0 O-C-N 123.971 1.511 . . . . 0.0 110.227 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 121.265 0.555 . . . . 0.0 110.12 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.579 ' CD2' ' N ' ' A' ' 58' ' ' LEU . 3.0 mm? -92.89 160.54 14.86 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.289 -0.882 . . . . 0.0 109.965 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.515 ' N ' ' HG2' ' A' ' 45' ' ' MET . 0.7 OUTLIER -105.89 110.16 22.36 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.09 -1.006 . . . . 0.0 110.741 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.554 ' CD1' ' CB ' ' A' ' 14' ' ' PHE . 28.6 p90 -77.49 -19.26 56.16 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.93 -42.59 76.36 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.126 -0.984 . . . . 0.0 108.474 178.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.92 -31.96 72.32 Favored 'General case' 0 N--CA 1.488 1.444 0 CA-C-O 121.931 0.872 . . . . 0.0 108.961 178.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.579 ' CD2' ' HB2' ' A' ' 44' ' ' ARG . 25.7 t80 -60.59 -41.98 95.8 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.792 -0.567 . . . . 0.0 110.412 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.404 ' OG ' ' N ' ' A' ' 65' ' ' SER . 6.2 p -63.1 -50.68 69.56 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.147 -0.971 . . . . 0.0 110.456 -179.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.404 ' N ' ' OG ' ' A' ' 64' ' ' SER . 16.0 m -69.54 -35.68 75.67 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.145 -0.972 . . . . 0.0 110.43 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.36 -39.56 81.77 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.35 -0.844 . . . . 0.0 110.872 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.561 HD13 ' CE1' ' A' ' 63' ' ' PHE . 1.3 mt -75.09 -44.06 49.49 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.079 -1.013 . . . . 0.0 110.485 -179.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 . . . . . 0 N--CA 1.491 1.601 0 O-C-N 121.2 -0.938 . . . . 0.0 110.397 -179.822 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 121.258 0.552 . . . . 0.0 110.095 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.414 ' HA ' HG22 ' A' ' 16' ' ' ILE . 0.1 OUTLIER -66.06 -40.14 90.67 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.256 -0.903 . . . . 0.0 110.194 179.839 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.43 -43.98 79.96 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.323 -0.861 . . . . 0.0 110.113 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -60.33 -40.85 92.11 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.285 -0.884 . . . . 0.0 110.093 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . 0.423 ' O ' HG22 ' B' ' 16' ' ' VAL . . . -65.86 -45.23 82.93 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.303 -0.873 . . . . 0.0 110.14 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.422 ' O ' ' CG2' ' B' ' 17' ' ' VAL . 76.5 t -57.77 -42.44 81.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.292 -0.88 . . . . 0.0 110.121 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.97 -40.13 96.78 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.246 -0.909 . . . . 0.0 110.132 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 42.8 m -63.87 -43.74 95.18 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.227 -0.921 . . . . 0.0 110.16 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.423 HG22 ' O ' ' B' ' 12' ' ' ALA . 66.2 t -65.97 -43.61 92.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.263 -0.898 . . . . 0.0 110.096 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.442 HG21 HD23 ' A' ' 33' ' ' LEU . 31.9 t -63.77 -45.83 96.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.294 -0.879 . . . . 0.0 110.111 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.13 -37.07 83.74 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.258 -0.901 . . . . 0.0 110.041 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.99 -42.68 89.5 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.301 -0.874 . . . . 0.0 110.178 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 69.3 t -65.42 -40.73 89.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.252 -0.905 . . . . 0.0 110.141 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.75 -35.98 82.81 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.379 -0.825 . . . . 0.0 110.089 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.2 -43.62 95.78 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.402 -0.811 . . . . 0.0 110.186 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . 0.445 ' CB ' HD23 ' A' ' 67' ' ' LEU . . . -64.92 -35.25 80.56 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.23 -0.919 . . . . 0.0 110.474 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 5.4 ttt180 . . . . . 0 N--CA 1.493 1.679 0 O-C-N 121.124 -0.985 . . . . 0.0 110.359 -179.829 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.7 m . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.16 0.505 . . . . 0.0 110.23 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.85 -47.56 80.24 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.226 -0.921 . . . . 0.0 109.814 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -54.45 -36.05 63.67 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.31 -0.869 . . . . 0.0 109.797 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -61.66 -37.6 84.63 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.346 -0.847 . . . . 0.0 110.285 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.0 t -58.15 -50.55 77.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.172 -0.955 . . . . 0.0 109.646 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 23.4 mt -55.01 -49.95 67.13 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 121.276 -0.89 . . . . 0.0 109.153 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.07 -39.31 78.22 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.352 -0.843 . . . . 0.0 108.739 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 72.5 m -66.84 -41.11 87.95 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.46 -0.775 . . . . 0.0 109.087 179.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.574 ' HB3' ' CE2' ' A' ' 60' ' ' TYR . 5.1 m-85 -67.24 -41.42 85.67 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.368 -0.832 . . . . 0.0 109.322 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.7 ttt-85 -54.52 -44.62 72.91 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.427 -0.796 . . . . 0.0 109.632 179.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.443 HG22 HD11 ' A' ' 16' ' ' ILE . 44.3 mt -60.93 -44.65 98.41 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.368 -0.832 . . . . 0.0 109.953 179.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.444 HD22 HG21 ' B' ' 13' ' ' VAL . 3.2 mm? -64.41 -39.78 94.5 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.224 -0.923 . . . . 0.0 109.84 179.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.463 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -77.09 -4.26 43.47 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.306 -0.871 . . . . 0.0 110.044 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.463 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 66.93 63.34 0.47 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.266 -0.896 . . . . 0.0 110.359 179.895 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 55.59 62.16 2.55 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.276 -0.89 . . . . 0.0 110.432 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' A' ' 19' ' ' SER . 19.3 mttt -144.73 143.89 22.72 Favored Pre-proline 0 N--CA 1.49 1.563 0 O-C-N 121.329 -0.857 . . . . 0.0 109.887 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -73.72 -0.25 9.13 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 O-C-N 123.938 1.494 . . . . 0.0 110.094 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 13.6 p90 -146.38 155.66 42.76 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.286 -0.884 . . . . 0.0 110.283 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.529 HD12 ' N ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -124.18 142.22 41.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.427 -0.795 . . . . 0.0 109.754 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.529 ' N ' HD12 ' A' ' 24' ' ' ILE . 3.8 mp -80.23 136.54 36.48 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.136 -0.977 . . . . 0.0 110.003 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.32 -41.02 96.33 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.268 -0.895 . . . . 0.0 109.912 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.15 -42.77 77.49 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.38 -0.825 . . . . 0.0 109.541 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.457 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 64.0 tt0 -69.41 -42.39 75.13 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.501 -0.749 . . . . 0.0 109.648 179.541 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.526 HD22 ' CB ' ' A' ' 41' ' ' CYS . 1.2 tp -62.56 -41.4 98.89 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.412 -0.805 . . . . 0.0 108.92 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.53 ' HA ' ' CB ' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -62.43 -33.65 75.22 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.652 -0.655 . . . . 0.0 110.257 179.619 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.3 ttm180 -96.72 -24.8 15.79 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.355 -0.841 . . . . 0.0 111.504 -179.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.457 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 7.7 mm-40 -80.06 -21.55 43.3 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.815 -1.178 . . . . 0.0 111.073 -179.088 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.477 HD22 ' HD3' ' A' ' 34' ' ' PRO . 7.3 mt -116.72 169.65 6.96 Favored Pre-proline 0 C--N 1.303 -1.426 0 O-C-N 120.939 -1.101 . . . . 0.0 111.164 -179.076 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.546 ' CB ' ' HD2' ' A' ' 35' ' ' PRO . 35.3 Cg_exo -58.41 -149.39 0.01 OUTLIER 'Trans proline' 0 C--N 1.307 -1.62 0 O-C-N 124.225 1.645 . . . . 0.0 109.984 179.668 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.546 ' HD2' ' CB ' ' A' ' 34' ' ' PRO . 10.8 Cg_endo -96.24 -44.19 0.02 OUTLIER 'Trans proline' 0 C--N 1.308 -1.603 0 O-C-N 123.647 1.34 . . . . 0.0 110.451 179.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.2 -41.17 90.57 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.309 -0.869 . . . . 0.0 111.096 -179.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 10.7 mp0 -69.68 -44.82 69.67 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.061 -1.024 . . . . 0.0 111.011 -179.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.53 ' CB ' ' HA ' ' A' ' 30' ' ' ARG . . . -62.58 -46.76 86.85 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.306 -0.871 . . . . 0.0 110.769 -179.391 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 15.0 tm0? -65.86 -43.99 86.79 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.177 -0.952 . . . . 0.0 111.067 -179.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -65.51 -42.39 92.1 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.065 -1.022 . . . . 0.0 110.631 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.526 ' CB ' HD22 ' A' ' 29' ' ' LEU . 34.9 m -58.08 -50.51 73.2 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.189 -0.944 . . . . 0.0 110.548 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -58.4 -22.36 19.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.107 -0.995 . . . . 0.0 110.131 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -82.15 -15.41 53.43 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.136 -0.978 . . . . 0.0 110.609 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.56 ' HG3' ' CE1' ' A' ' 63' ' ' PHE . 0.8 OUTLIER -113.68 -60.03 1.94 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.033 -1.042 . . . . 0.0 110.682 -179.818 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.544 ' CE ' ' HB3' ' A' ' 60' ' ' TYR . 3.0 ttm -35.3 100.37 0.19 Allowed Pre-proline 0 N--CA 1.495 1.804 0 O-C-N 121.547 -0.72 . . . . 0.0 111.085 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.459 ' O ' HD11 ' A' ' 58' ' ' LEU . 18.7 Cg_exo . . . . . 0 C--N 1.305 -1.757 0 O-C-N 124.099 1.578 . . . . 0.0 110.073 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 121.353 0.597 . . . . 0.0 110.361 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.594 ' CD2' ' N ' ' A' ' 58' ' ' LEU . 3.3 mm? -105.94 160.29 15.38 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.25 -0.907 . . . . 0.0 109.511 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.451 ' C ' ' HG3' ' A' ' 45' ' ' MET . 1.7 m-20 -113.71 111.02 21.12 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.111 -0.993 . . . . 0.0 111.055 -179.365 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.574 ' CE2' ' HB3' ' A' ' 14' ' ' PHE . 15.6 p90 -76.35 -22.76 54.49 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.376 -0.828 . . . . 0.0 109.901 179.422 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.55 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.79 -38.91 70.56 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.341 -0.849 . . . . 0.0 109.632 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.3 -34.68 76.6 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.208 -0.932 . . . . 0.0 109.424 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.56 ' CE1' ' HG3' ' A' ' 44' ' ' ARG . 4.4 t80 -72.0 -35.84 69.57 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.655 -0.653 . . . . 0.0 110.044 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.5 p -60.83 -49.88 75.71 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.234 -0.916 . . . . 0.0 110.333 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 66.0 p -64.98 -43.84 91.28 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.162 -0.962 . . . . 0.0 110.218 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.48 -31.63 69.52 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.305 -0.872 . . . . 0.0 110.216 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.421 ' CD1' ' CZ ' ' A' ' 63' ' ' PHE . 0.6 OUTLIER -65.61 -36.97 85.27 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.203 -0.935 . . . . 0.0 110.202 -179.926 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.4 ' N ' ' CD1' ' A' ' 68' ' ' TYR . 11.1 m-85 . . . . . 0 N--CA 1.491 1.596 0 O-C-N 121.291 -0.881 . . . . 0.0 110.203 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.279 0.562 . . . . 0.0 110.17 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.76 -45.3 94.5 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.164 -0.96 . . . . 0.0 110.15 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.9 -35.72 69.3 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.232 -0.917 . . . . 0.0 110.042 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -65.26 -45.49 84.34 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.259 -0.901 . . . . 0.0 110.126 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . 0.411 ' HB1' HD11 ' A' ' 16' ' ' ILE . . . -62.91 -39.16 93.72 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.248 -0.907 . . . . 0.0 110.106 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.444 HG21 HD22 ' A' ' 17' ' ' LEU . 25.1 t -62.45 -42.73 96.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.357 -0.839 . . . . 0.0 110.154 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.7 -40.24 83.06 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.264 -0.898 . . . . 0.0 110.097 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' THR . . . . . 0.457 ' O ' ' HB2' ' B' ' 19' ' ' ALA . 1.3 m -62.36 -48.19 80.88 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.32 -0.863 . . . . 0.0 110.203 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 46.7 t -64.07 -43.62 97.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.247 -0.908 . . . . 0.0 110.268 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.416 HG22 ' O ' ' B' ' 13' ' ' VAL . 45.2 t -63.01 -49.31 84.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.244 -0.91 . . . . 0.0 110.317 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.34 -32.67 74.15 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.186 -0.946 . . . . 0.0 110.305 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.457 ' HB2' ' O ' ' B' ' 15' ' ' THR . . . -67.47 -44.88 77.53 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.198 -0.939 . . . . 0.0 110.411 -179.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 97.6 t -67.17 -42.52 88.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.237 -0.914 . . . . 0.0 110.361 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -65.14 -31.73 73.07 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.255 -0.903 . . . . 0.0 110.447 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -64.16 -49.54 71.7 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.173 -0.954 . . . . 0.0 110.573 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . 0.413 ' CB ' ' CD2' ' A' ' 67' ' ' LEU . . . -65.19 -34.69 78.97 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.101 -0.999 . . . . 0.0 110.505 -179.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.7 ttp85 . . . . . 0 N--CA 1.492 1.629 0 O-C-N 121.289 -0.882 . . . . 0.0 110.634 -179.681 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.64 ' CG2' ' CZ ' ' A' ' 68' ' ' TYR . 31.3 m . . . . . 0 N--CA 1.493 1.691 0 CA-C-O 121.336 0.588 . . . . 0.0 109.985 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.7 -38.29 89.83 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.181 -0.949 . . . . 0.0 109.098 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -59.14 -35.05 72.81 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.585 -0.697 . . . . 0.0 109.57 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.458 ' O ' ' OG ' ' A' ' 13' ' ' SER . 1.8 tt0 -60.87 -44.29 97.25 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.338 -0.851 . . . . 0.0 110.311 -179.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 95.7 t -65.66 -41.46 90.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 120.978 -1.076 . . . . 0.0 109.846 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.414 HG22 HD11 ' A' ' 11' ' ' ILE . 75.2 mt -65.54 -47.47 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.273 -0.892 . . . . 0.0 109.448 179.571 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.76 -45.99 85.16 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.338 -0.851 . . . . 0.0 108.763 179.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.493 ' HB2' ' CG2' ' B' ' 16' ' ' VAL . 1.5 p -63.12 -42.98 99.63 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.416 -0.803 . . . . 0.0 108.949 178.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -63.61 -41.8 98.28 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.319 -0.863 . . . . 0.0 109.266 179.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.625 ' NH2' ' CE2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -55.98 -41.49 74.86 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.482 -0.761 . . . . 0.0 109.321 179.14 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.526 ' CD1' ' HB2' ' B' ' 12' ' ' ALA . 77.1 mt -61.82 -45.08 99.47 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 O-C-N 121.355 -0.84 . . . . 0.0 109.953 179.545 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 19.9 mt -65.09 -41.31 95.12 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.183 -0.948 . . . . 0.0 110.092 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.455 ' O ' ' HB2' ' A' ' 21' ' ' LYS . . . -73.52 -0.26 14.57 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.253 -0.905 . . . . 0.0 110.229 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.473 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 0.1 OUTLIER 56.71 54.59 7.13 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.216 -0.927 . . . . 0.0 110.381 179.834 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.473 ' HB2' ' O ' ' A' ' 19' ' ' SER . 0.8 OUTLIER 58.43 45.25 16.93 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.255 -0.903 . . . . 0.0 110.384 179.765 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.533 ' O ' ' NH2' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -113.15 145.78 33.86 Favored Pre-proline 0 N--CA 1.494 1.746 0 O-C-N 121.15 -0.969 . . . . 0.0 110.267 179.849 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.569 ' HG2' ' CE2' ' A' ' 23' ' ' TYR . 12.3 Cg_endo -61.25 -11.39 18.92 Favored 'Trans proline' 0 C--N 1.303 -1.838 0 O-C-N 123.971 1.511 . . . . 0.0 109.843 179.292 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.569 ' CE2' ' HG2' ' A' ' 22' ' ' PRO . 8.4 p90 -150.2 170.82 18.05 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.243 -0.911 . . . . 0.0 110.292 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.493 HG21 HD11 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -123.11 145.09 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.329 -0.857 . . . . 0.0 109.878 179.906 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.489 ' N ' HD11 ' A' ' 24' ' ' ILE . 0.4 OUTLIER -94.44 146.75 23.86 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.157 -0.964 . . . . 0.0 110.281 -179.739 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.475 ' O ' ' HG ' ' A' ' 29' ' ' LEU . . . -62.42 -34.49 76.87 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.214 -0.929 . . . . 0.0 110.009 179.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -70.43 -34.17 72.16 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.357 -0.84 . . . . 0.0 110.223 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.466 ' O ' ' HG2' ' A' ' 32' ' ' GLU . 1.5 tp10 -66.32 -50.94 61.94 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.334 -0.854 . . . . 0.0 110.297 -179.711 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.561 ' CD1' ' N ' ' A' ' 30' ' ' ARG . 4.4 pp -66.94 -33.57 75.86 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.086 -1.009 . . . . 0.0 109.081 179.243 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.561 ' N ' ' CD1' ' A' ' 29' ' ' LEU . 4.6 mtt-85 -55.82 -34.8 65.69 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.432 -0.793 . . . . 0.0 109.795 179.304 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -92.81 -18.68 22.57 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.366 -0.834 . . . . 0.0 110.373 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 28' ' ' GLU . 43.8 mm-40 -92.35 -23.32 19.28 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.122 -0.986 . . . . 0.0 110.53 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.485 ' CD2' HG21 ' B' ' 17' ' ' VAL . 0.5 OUTLIER -122.62 144.28 42.03 Favored Pre-proline 0 N--CA 1.487 1.388 0 O-C-N 121.158 -0.964 . . . . 0.0 110.342 -179.791 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.454 ' HD2' HD21 ' A' ' 33' ' ' LEU . 2.4 Cg_endo -46.42 136.54 15.34 Favored 'Trans proline' 0 C--N 1.305 -1.743 0 O-C-N 123.945 1.497 . . . . 0.0 109.67 179.545 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.441 ' C ' ' O ' ' A' ' 34' ' ' PRO . 26.5 Cg_exo -38.07 -37.75 0.66 Allowed 'Trans proline' 0 C--N 1.304 -1.78 0 O-C-N 124.112 1.585 . . . . 0.0 110.784 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -65.93 -47.64 74.04 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.242 -0.911 . . . . 0.0 110.862 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.473 ' HB3' HD23 ' A' ' 33' ' ' LEU . 2.2 mp0 -70.31 -45.55 66.02 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.176 -0.953 . . . . 0.0 110.714 -179.548 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.499 ' CB ' ' HA ' ' A' ' 30' ' ' ARG . . . -55.98 -44.74 78.83 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.279 -0.888 . . . . 0.0 110.663 -179.45 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.8 -40.29 79.55 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.238 -0.914 . . . . 0.0 110.664 -179.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.462 ' HB3' HG12 ' B' ' 20' ' ' VAL . 0.2 OUTLIER -65.11 -45.43 85.17 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.159 -0.963 . . . . 0.0 110.573 -179.769 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.478 ' O ' ' HG2' ' A' ' 45' ' ' MET . 49.2 m -65.29 -51.44 60.69 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.178 -0.951 . . . . 0.0 110.731 -179.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.463 HG13 HD12 ' A' ' 29' ' ' LEU . 97.3 mt -45.26 -27.89 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.098 -1.001 . . . . 0.0 110.29 -179.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.8 tttp -86.14 -37.36 18.84 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.307 -0.871 . . . . 0.0 110.245 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.585 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 19.1 mmt180 -69.11 -76.47 0.09 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.358 -0.839 . . . . 0.0 110.75 -179.491 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.559 ' CB ' ' O ' ' A' ' 59' ' ' ASP . 2.8 ptp -39.42 102.73 0.26 Allowed Pre-proline 0 N--CA 1.493 1.675 0 O-C-N 121.417 -0.802 . . . . 0.0 110.41 -179.225 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.509 ' HD2' ' CB ' ' A' ' 62' ' ' ALA . 13.6 Cg_endo . . . . . 0 C--N 1.307 -1.634 0 O-C-N 124.448 1.762 . . . . 0.0 110.986 -179.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 121.386 0.612 . . . . 0.0 110.354 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 64.8 mt -132.7 153.48 51.1 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.277 -0.889 . . . . 0.0 109.666 179.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.559 ' O ' ' CB ' ' A' ' 45' ' ' MET . 12.6 t0 -86.98 109.62 19.5 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.033 -1.042 . . . . 0.0 110.326 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.625 ' CE2' ' NH2' ' A' ' 15' ' ' ARG . 26.1 p90 -83.57 -21.96 32.49 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.327 -0.858 . . . . 0.0 109.123 179.17 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.429 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -67.46 -37.72 83.36 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.454 -0.779 . . . . 0.0 109.548 179.472 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.509 ' CB ' ' HD2' ' A' ' 46' ' ' PRO . . . -63.66 -33.02 74.7 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.148 -0.97 . . . . 0.0 109.846 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.585 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 4.1 t80 -71.84 -34.48 69.32 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.503 -0.748 . . . . 0.0 110.163 179.699 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 33.7 p -66.44 -49.77 65.61 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.238 -0.914 . . . . 0.0 110.458 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.74 -39.56 93.83 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.202 -0.936 . . . . 0.0 110.308 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.88 -36.38 80.15 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.246 -0.909 . . . . 0.0 110.329 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.42 HD13 ' CZ ' ' A' ' 63' ' ' PHE . 0.4 OUTLIER -58.57 -42.25 87.55 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.162 -0.961 . . . . 0.0 110.251 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.64 ' CZ ' ' CG2' ' A' ' 6' ' ' THR . 10.5 m-85 . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.316 -0.865 . . . . 0.0 110.218 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 121.169 0.509 . . . . 0.0 110.241 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -58.19 -44.54 88.12 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.166 -0.959 . . . . 0.0 110.051 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.98 -34.89 78.48 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.266 -0.897 . . . . 0.0 109.982 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -65.55 -40.41 92.83 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.259 -0.9 . . . . 0.0 109.924 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . 0.526 ' HB2' ' CD1' ' A' ' 16' ' ' ILE . . . -62.89 -39.38 94.3 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.322 -0.861 . . . . 0.0 109.871 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.436 ' O ' ' CG2' ' B' ' 17' ' ' VAL . 99.4 t -60.37 -41.59 87.86 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.349 -0.844 . . . . 0.0 109.883 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.78 -42.27 95.22 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.321 -0.862 . . . . 0.0 110.061 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 22.2 m -61.91 -46.07 90.96 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.215 -0.928 . . . . 0.0 110.061 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.493 ' CG2' ' HB2' ' A' ' 13' ' ' SER . 21.1 t -64.39 -41.76 93.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.228 -0.92 . . . . 0.0 110.014 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.485 HG21 ' CD2' ' A' ' 33' ' ' LEU . 91.0 t -60.09 -46.23 94.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.275 -0.891 . . . . 0.0 110.136 179.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.17 -42.21 98.17 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.238 -0.913 . . . . 0.0 110.18 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.37 -43.82 89.52 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.256 -0.902 . . . . 0.0 110.212 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . 0.462 HG12 ' HB3' ' A' ' 40' ' ' TYR . 55.7 t -67.46 -45.57 85.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.256 -0.902 . . . . 0.0 110.169 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -57.25 -33.47 67.62 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.349 -0.844 . . . . 0.0 110.241 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.03 -45.88 90.22 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.248 -0.908 . . . . 0.0 110.211 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . 0.413 ' HB1' HD22 ' A' ' 67' ' ' LEU . . . -58.51 -35.02 71.61 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.175 -0.953 . . . . 0.0 110.198 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 44.7 ttt180 . . . . . 0 N--CA 1.491 1.589 0 O-C-N 121.218 -0.926 . . . . 0.0 110.185 -179.99 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.629 ' CG2' ' CZ ' ' A' ' 68' ' ' TYR . 1.9 m . . . . . 0 N--CA 1.491 1.621 0 CA-C-O 121.181 0.515 . . . . 0.0 110.375 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -68.36 -39.6 81.76 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.258 -0.901 . . . . 0.0 109.831 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -67.39 -36.45 81.33 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.392 -0.817 . . . . 0.0 109.9 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 6.0 tp60 -61.29 -45.97 92.24 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.327 -0.858 . . . . 0.0 110.139 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.563 ' CG1' ' CE2' ' A' ' 14' ' ' PHE . 75.6 t -58.05 -44.88 88.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.24 -0.913 . . . . 0.0 110.071 179.844 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 73.1 mt -54.78 -48.51 73.12 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.239 -0.913 . . . . 0.0 109.716 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.74 -42.67 84.39 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.173 -0.954 . . . . 0.0 109.099 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.463 ' HA ' ' HB3' ' B' ' 12' ' ' ALA . 2.2 m -68.1 -39.75 82.77 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.496 -0.753 . . . . 0.0 109.356 179.134 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.563 ' CE2' ' CG1' ' A' ' 10' ' ' VAL . 2.4 m-85 -68.58 -42.09 78.73 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.307 -0.871 . . . . 0.0 109.528 179.293 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.3 ttt-85 -53.34 -46.78 69.63 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.284 -0.885 . . . . 0.0 109.42 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.424 HG22 HD11 ' A' ' 16' ' ' ILE . 37.8 mt -59.42 -42.54 87.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.352 -0.842 . . . . 0.0 109.571 179.446 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mp -63.99 -41.55 97.47 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.358 -0.839 . . . . 0.0 109.806 179.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.454 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -74.45 -2.81 27.19 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.342 -0.849 . . . . 0.0 110.141 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.43 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.3 OUTLIER 65.29 74.69 0.38 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.263 -0.898 . . . . 0.0 110.258 -179.921 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.8 t0 49.04 59.08 4.7 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.264 -0.897 . . . . 0.0 110.317 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.556 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 11.2 mttt -148.6 144.81 18.88 Favored Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.19 -0.944 . . . . 0.0 110.169 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -77.25 4.33 5.96 Favored 'Trans proline' 0 C--N 1.305 -1.748 0 O-C-N 124.063 1.559 . . . . 0.0 110.117 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.556 ' CZ ' ' HD3' ' A' ' 21' ' ' LYS . 48.8 p90 -148.99 175.34 11.39 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.208 -0.932 . . . . 0.0 110.319 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.422 ' HB ' ' HB3' ' A' ' 18' ' ' ALA . 4.6 tt -151.33 156.96 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.274 -0.891 . . . . 0.0 110.119 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.2 mp -89.26 149.05 23.25 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.264 -0.897 . . . . 0.0 110.258 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.491 ' O ' ' HG ' ' A' ' 29' ' ' LEU . . . -58.03 -34.79 70.45 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.27 -0.894 . . . . 0.0 110.028 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -70.76 -34.11 71.49 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.269 -0.894 . . . . 0.0 110.018 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.453 ' O ' ' CG ' ' A' ' 32' ' ' GLU . 3.8 tp10 -62.5 -50.97 69.27 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.3 -0.875 . . . . 0.0 110.513 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.523 ' CD1' ' HA ' ' A' ' 38' ' ' ALA . 3.5 pp -66.98 -33.16 74.96 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.006 -1.059 . . . . 0.0 109.295 179.444 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.483 ' N ' ' CD1' ' A' ' 29' ' ' LEU . 3.2 ttt85 -58.18 -34.75 70.68 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.394 -0.816 . . . . 0.0 109.61 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.8 ttt180 -91.62 -29.85 16.67 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.433 -0.792 . . . . 0.0 110.196 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.453 ' CG ' ' O ' ' A' ' 28' ' ' GLU . 5.0 mm-40 -82.2 -23.56 35.39 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.174 -0.954 . . . . 0.0 110.26 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.532 ' CD2' ' HD2' ' A' ' 34' ' ' PRO . 6.5 mt -119.96 146.9 43.15 Favored Pre-proline 0 N--CA 1.489 1.476 0 O-C-N 121.257 -0.902 . . . . 0.0 110.094 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.532 ' HD2' ' CD2' ' A' ' 33' ' ' LEU . 1.1 Cg_endo -53.67 158.19 8.62 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 O-C-N 123.938 1.493 . . . . 0.0 110.284 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -50.54 -39.44 55.35 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 124.108 1.583 . . . . 0.0 110.69 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.97 -46.46 81.39 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.21 -0.932 . . . . 0.0 110.445 -179.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.528 ' CB ' HD21 ' A' ' 33' ' ' LEU . 58.5 mm-40 -69.66 -38.33 77.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.25 -0.906 . . . . 0.0 110.686 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.523 ' HA ' ' CD1' ' A' ' 29' ' ' LEU . . . -57.46 -42.12 81.91 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.203 -0.936 . . . . 0.0 110.798 -179.497 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.5 tp60 -60.69 -47.08 87.87 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.179 -0.951 . . . . 0.0 110.692 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -66.0 -43.87 86.49 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.21 -0.931 . . . . 0.0 110.586 -179.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 3.2 m -62.67 -42.91 99.88 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.223 -0.923 . . . . 0.0 111.005 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.416 HG13 ' CD2' ' A' ' 29' ' ' LEU . 68.6 mt -75.2 -12.35 14.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.067 -1.021 . . . . 0.0 110.524 -179.435 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.88 -16.07 49.01 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.23 -0.919 . . . . 0.0 111.129 -179.359 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.514 ' O ' ' C ' ' A' ' 45' ' ' MET . 1.1 mpp_? -117.26 -56.66 2.22 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.086 -1.009 . . . . 0.0 110.997 -179.479 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.514 ' C ' ' O ' ' A' ' 44' ' ' ARG . 3.9 ttm -29.48 94.52 0.06 OUTLIER Pre-proline 0 N--CA 1.498 1.964 0 O-C-N 121.691 -0.63 . . . . 0.0 111.531 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.471 ' N ' ' O ' ' A' ' 44' ' ' ARG . 11.5 Cg_endo . . . . . 0 C--N 1.307 -1.641 0 O-C-N 124.121 1.59 . . . . 0.0 110.363 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . 0.451 ' O ' HD12 ' A' ' 58' ' ' LEU . . . . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 121.293 0.568 . . . . 0.0 110.227 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.581 ' CD2' ' N ' ' A' ' 58' ' ' LEU . 2.1 mm? -112.77 156.4 22.91 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.226 -0.921 . . . . 0.0 109.785 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.455 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.6 OUTLIER -111.53 110.46 20.89 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.068 -1.02 . . . . 0.0 110.441 -179.855 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.519 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 18.4 p90 -75.02 -21.75 58.89 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.263 -0.898 . . . . 0.0 109.593 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.519 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.9 -39.15 71.17 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.295 -0.878 . . . . 0.0 109.457 179.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.47 -32.33 73.2 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.34 -0.85 . . . . 0.0 109.087 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.458 ' O ' ' HB3' ' A' ' 67' ' ' LEU . 2.0 t80 -61.78 -38.53 88.39 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-O 121.192 0.52 . . . . 0.0 110.35 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 25.1 m -56.79 -49.67 74.62 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.329 -0.857 . . . . 0.0 110.825 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.0 m -66.18 -36.16 82.36 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.076 -1.015 . . . . 0.0 110.74 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.88 -30.12 56.08 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.145 -0.972 . . . . 0.0 110.842 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.458 ' HB3' ' O ' ' A' ' 63' ' ' PHE . 0.3 OUTLIER -78.18 -46.77 19.64 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.066 -1.021 . . . . 0.0 109.945 -179.632 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.629 ' CZ ' ' CG2' ' A' ' 6' ' ' THR . 12.4 m-85 . . . . . 0 N--CA 1.492 1.652 0 C-N-CA 119.939 -0.705 . . . . 0.0 110.463 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt . . . . . 0 N--CA 1.492 1.649 0 CA-C-O 121.142 0.496 . . . . 0.0 110.143 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 1.4 ttmt -58.75 -40.25 83.29 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.122 -0.986 . . . . 0.0 110.001 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.06 -35.43 80.21 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.24 -0.912 . . . . 0.0 109.888 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.6 tm-20 -65.96 -40.32 91.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.373 -0.83 . . . . 0.0 110.144 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . 0.463 ' HB3' ' HA ' ' A' ' 13' ' ' SER . . . -62.54 -41.76 99.09 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.338 -0.851 . . . . 0.0 110.068 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 58.1 t -63.36 -40.55 89.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.264 -0.897 . . . . 0.0 109.892 179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.77 -39.04 87.33 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.369 -0.832 . . . . 0.0 110.276 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 23.7 m -66.15 -43.67 86.36 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.212 -0.93 . . . . 0.0 110.312 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.467 ' O ' HG22 ' B' ' 20' ' ' VAL . 61.5 t -67.53 -40.41 84.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.283 -0.886 . . . . 0.0 110.363 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 98.8 t -58.14 -49.0 83.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.233 -0.917 . . . . 0.0 110.498 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.44 -38.83 92.4 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.24 -0.912 . . . . 0.0 110.276 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.45 -46.04 74.24 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.261 -0.9 . . . . 0.0 110.145 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . 0.493 ' CG1' ' OE1' ' A' ' 37' ' ' GLN . 83.8 t -67.49 -45.92 84.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.291 -0.881 . . . . 0.0 110.091 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -57.46 -38.23 74.13 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.204 -0.935 . . . . 0.0 110.194 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.27 -45.32 72.41 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.226 -0.921 . . . . 0.0 109.946 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.52 -38.81 92.32 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.372 -0.83 . . . . 0.0 109.84 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 22.1 ttt-85 . . . . . 0 N--CA 1.49 1.573 0 O-C-N 121.232 -0.918 . . . . 0.0 109.928 179.767 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.548 ' CG2' ' CE1' ' A' ' 68' ' ' TYR . 3.4 m . . . . . 0 N--CA 1.493 1.699 0 CA-C-O 121.268 0.556 . . . . 0.0 110.076 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -66.57 -44.43 82.29 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.243 -0.91 . . . . 0.0 109.64 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -58.83 -36.52 74.65 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.482 -0.761 . . . . 0.0 109.914 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.49 -47.68 84.52 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.324 -0.86 . . . . 0.0 110.113 -179.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 24.5 t -57.98 -51.18 73.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.289 -0.882 . . . . 0.0 109.784 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 16.5 mt -57.88 -49.7 80.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.392 -0.818 . . . . 0.0 109.621 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.91 -41.89 83.6 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.289 -0.882 . . . . 0.0 109.183 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 65.3 m -67.96 -37.09 81.14 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.392 -0.817 . . . . 0.0 109.33 179.177 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.583 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 2.1 m-85 -67.91 -44.14 77.61 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.31 -0.869 . . . . 0.0 109.644 179.452 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.68 -48.12 72.79 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.266 -0.896 . . . . 0.0 109.608 179.531 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 60.8 mt -60.33 -42.95 92.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.313 -0.867 . . . . 0.0 109.776 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.412 ' N ' HD21 ' A' ' 17' ' ' LEU . 1.8 mm? -62.5 -40.54 97.03 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.32 -0.863 . . . . 0.0 109.915 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.486 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -82.9 7.62 14.87 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.394 -0.816 . . . . 0.0 110.295 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.486 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.8 OUTLIER 67.37 66.27 0.4 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.208 -0.933 . . . . 0.0 110.278 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.454 ' N ' ' OD1' ' A' ' 20' ' ' ASP . 1.0 OUTLIER 49.52 62.03 2.84 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.273 -0.892 . . . . 0.0 110.38 179.906 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.577 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 25.6 mttm -140.84 141.96 26.4 Favored Pre-proline 0 N--CA 1.488 1.454 0 O-C-N 121.235 -0.916 . . . . 0.0 110.074 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -72.02 -1.03 9.39 Favored 'Trans proline' 0 C--N 1.305 -1.748 0 O-C-N 124.059 1.558 . . . . 0.0 110.211 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.577 ' CZ ' ' HD3' ' A' ' 21' ' ' LYS . 39.6 p90 -142.07 162.39 35.61 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.287 -0.883 . . . . 0.0 110.035 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.512 HD11 HG22 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -128.1 140.6 48.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.151 -0.968 . . . . 0.0 110.238 -179.84 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.428 ' HB2' ' HG3' ' A' ' 28' ' ' GLU . 1.1 mt -80.33 144.61 32.63 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.265 -0.897 . . . . 0.0 110.167 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.469 ' O ' ' HG ' ' A' ' 29' ' ' LEU . . . -62.65 -36.54 83.16 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.338 -0.851 . . . . 0.0 110.296 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -68.25 -34.6 76.51 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.105 -0.997 . . . . 0.0 109.936 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.484 ' O ' ' CG ' ' A' ' 32' ' ' GLU . 62.2 mt-10 -65.88 -50.36 64.8 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.29 -0.881 . . . . 0.0 110.003 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.493 HD22 ' CD1' ' A' ' 42' ' ' ILE . 1.7 pp -67.2 -32.99 74.43 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.2 -0.938 . . . . 0.0 109.933 179.62 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.511 ' HA ' ' CB ' ' A' ' 38' ' ' ALA . 6.8 mtt180 -66.35 -34.16 77.35 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.28 -0.887 . . . . 0.0 110.639 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -95.36 -25.54 16.25 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.176 -0.953 . . . . 0.0 111.614 -178.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.492 ' CG ' ' HA ' ' A' ' 29' ' ' LEU . 15.5 pt-20 -92.13 -24.16 19.19 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.815 -1.178 . . . . 0.0 111.204 -178.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.498 ' CD2' ' HB3' ' A' ' 37' ' ' GLN . 0.1 OUTLIER -108.63 141.89 24.27 Favored Pre-proline 0 N--CA 1.492 1.643 0 O-C-N 121.043 -1.035 . . . . 0.0 110.427 -179.972 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.423 ' O ' ' C ' ' A' ' 35' ' ' PRO . 23.1 Cg_exo -44.54 137.7 8.23 Favored 'Trans proline' 0 C--N 1.303 -1.818 0 O-C-N 124.2 1.632 . . . . 0.0 109.765 179.664 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.423 ' C ' ' O ' ' A' ' 34' ' ' PRO . 37.1 Cg_endo -39.6 -38.49 1.66 Allowed 'Trans proline' 0 C--N 1.305 -1.721 0 O-C-N 124.039 1.547 . . . . 0.0 110.378 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -66.21 -45.71 79.8 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.275 -0.89 . . . . 0.0 110.665 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.498 ' HB3' ' CD2' ' A' ' 33' ' ' LEU . 52.4 mm-40 -69.97 -42.56 73.0 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.171 -0.955 . . . . 0.0 110.797 -179.429 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.511 ' CB ' ' HA ' ' A' ' 30' ' ' ARG . . . -63.54 -48.76 76.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.107 -0.995 . . . . 0.0 110.521 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.9 tm0? -56.24 -43.08 78.31 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.196 -0.94 . . . . 0.0 110.499 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -66.27 -42.88 87.85 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.228 -0.92 . . . . 0.0 110.285 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.48 ' O ' ' HG2' ' A' ' 45' ' ' MET . 84.5 m -65.0 -50.93 64.38 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.273 -0.892 . . . . 0.0 110.446 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.493 ' CD1' HD22 ' A' ' 29' ' ' LEU . 19.0 mm -40.41 -32.07 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.291 -0.881 . . . . 0.0 110.325 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.48 -42.19 14.69 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.377 -0.827 . . . . 0.0 110.805 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.575 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 3.9 mmt180 -63.7 -74.71 0.09 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.205 -0.934 . . . . 0.0 110.499 -179.405 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.527 ' HE3' ' CA ' ' A' ' 60' ' ' TYR . 6.8 ptp -56.82 119.48 30.29 Favored Pre-proline 0 N--CA 1.489 1.479 0 O-C-N 121.05 -1.031 . . . . 0.0 110.2 -179.723 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo . . . . . 0 C--N 1.305 -1.726 0 O-C-N 123.972 1.511 . . . . 0.0 110.236 -179.763 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . 0.406 ' C ' HD23 ' A' ' 58' ' ' LEU . . . . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.187 0.518 . . . . 0.0 110.174 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.59 ' CD2' ' N ' ' A' ' 58' ' ' LEU . 2.5 mm? -116.62 159.61 21.92 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.307 -0.87 . . . . 0.0 110.08 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.438 ' O ' ' HB2' ' A' ' 45' ' ' MET . 88.1 m-20 -109.32 114.36 27.97 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.248 -0.907 . . . . 0.0 110.183 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.583 ' HB2' ' CD2' ' A' ' 14' ' ' PHE . 23.8 p90 -84.31 -24.85 29.67 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.246 -0.909 . . . . 0.0 110.094 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.501 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.26 -35.9 67.94 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.243 -0.911 . . . . 0.0 109.93 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.99 -33.0 73.8 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.289 -0.882 . . . . 0.0 109.972 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.575 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 1.8 t80 -71.66 -32.75 68.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.558 -0.714 . . . . 0.0 110.053 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.8 t -66.27 -47.31 74.08 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.279 -0.888 . . . . 0.0 110.325 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.7 t -65.51 -36.83 85.0 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.192 -0.943 . . . . 0.0 110.357 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -75.21 -28.81 60.1 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.185 -0.947 . . . . 0.0 110.272 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.445 ' HB3' ' O ' ' A' ' 63' ' ' PHE . 0.4 OUTLIER -78.48 -45.25 22.54 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.214 -0.929 . . . . 0.0 109.584 179.966 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.548 ' CE1' ' CG2' ' A' ' 6' ' ' THR . 17.4 m-85 . . . . . 0 N--CA 1.492 1.627 0 O-C-N 121.485 -0.76 . . . . 0.0 110.281 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 4.8 mttt . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 121.229 0.537 . . . . 0.0 110.086 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 14.1 ttmt -61.56 -49.56 76.18 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.269 -0.894 . . . . 0.0 110.083 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.15 -38.14 67.87 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.222 -0.924 . . . . 0.0 109.945 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -66.09 -40.06 90.51 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.286 -0.884 . . . . 0.0 109.814 179.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.7 -37.05 84.95 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.32 -0.863 . . . . 0.0 110.07 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 76.6 t -62.49 -40.85 89.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.215 -0.928 . . . . 0.0 109.826 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.28 -38.07 82.44 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.345 -0.847 . . . . 0.0 109.999 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 56.3 m -62.93 -50.33 71.24 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.37 -0.831 . . . . 0.0 110.059 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 92.8 t -62.32 -43.91 98.6 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.318 -0.864 . . . . 0.0 110.053 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 93.5 t -59.83 -45.24 95.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.256 -0.903 . . . . 0.0 110.038 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.47 -38.06 89.69 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.179 -0.951 . . . . 0.0 110.094 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.66 -44.15 91.32 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.256 -0.902 . . . . 0.0 110.178 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 56.4 t -66.16 -39.78 85.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.238 -0.914 . . . . 0.0 110.265 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -65.46 -31.51 72.64 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.192 -0.942 . . . . 0.0 110.234 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -62.59 -38.21 89.23 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.283 -0.885 . . . . 0.0 110.318 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.74 -39.19 93.68 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.202 -0.936 . . . . 0.0 110.38 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.642 0 O-C-N 121.246 -0.909 . . . . 0.0 109.965 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.298 0.571 . . . . 0.0 110.233 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.11 -47.69 83.48 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.235 -0.915 . . . . 0.0 109.82 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -54.4 -36.23 63.71 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.422 -0.799 . . . . 0.0 109.791 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -61.46 -44.58 96.85 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.401 -0.812 . . . . 0.0 110.281 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 41.7 t -62.64 -41.27 91.54 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.14 -0.975 . . . . 0.0 109.967 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 58.6 mt -59.3 -47.11 91.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.32 -0.862 . . . . 0.0 109.743 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.63 -42.59 83.69 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.265 -0.897 . . . . 0.0 109.055 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.423 ' HA ' ' HB1' ' B' ' 12' ' ' ALA . 0.0 OUTLIER -67.74 -38.42 83.5 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.437 -0.789 . . . . 0.0 109.21 178.914 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.478 ' HB3' ' CE1' ' A' ' 60' ' ' TYR . 0.9 OUTLIER -68.42 -43.22 77.64 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.33 -0.857 . . . . 0.0 109.647 179.284 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.1 ttt180 -53.42 -46.42 69.78 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.264 -0.898 . . . . 0.0 109.565 179.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.427 HD11 ' HB1' ' B' ' 12' ' ' ALA . 42.7 mt -58.13 -45.01 88.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.23 -0.918 . . . . 0.0 109.705 179.562 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.3 mp -63.13 -41.65 99.35 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.396 -0.815 . . . . 0.0 109.74 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.476 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -75.92 -1.78 27.14 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.319 -0.863 . . . . 0.0 110.04 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 67.61 62.43 0.43 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.29 -0.881 . . . . 0.0 110.446 179.997 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.419 ' HB2' ' O ' ' A' ' 19' ' ' SER . 87.0 m-20 54.1 61.22 3.15 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.257 -0.902 . . . . 0.0 110.362 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 39.2 mtmt -149.03 142.71 16.3 Favored Pre-proline 0 N--CA 1.489 1.495 0 O-C-N 121.297 -0.877 . . . . 0.0 109.86 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -69.9 -3.57 12.37 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 O-C-N 123.981 1.516 . . . . 0.0 110.095 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 33.1 p90 -145.74 159.16 43.58 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.252 -0.905 . . . . 0.0 110.154 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 10.5 tt -136.15 153.84 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.213 -0.929 . . . . 0.0 110.216 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 39.9 mt -80.86 134.3 35.74 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.196 -0.94 . . . . 0.0 110.234 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.52 -40.12 71.39 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.231 -0.918 . . . . 0.0 109.875 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -61.68 -38.29 87.27 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.319 -0.863 . . . . 0.0 109.729 179.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.441 ' HG2' ' OE2' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -68.66 -43.73 75.59 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.297 -0.877 . . . . 0.0 109.229 179.315 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.483 HD13 ' HB2' ' A' ' 33' ' ' LEU . 0.8 OUTLIER -64.27 -39.95 94.98 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.513 -0.742 . . . . 0.0 109.199 179.124 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.505 ' HA ' ' CB ' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -58.38 -34.77 71.08 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.544 -0.722 . . . . 0.0 110.236 179.826 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.8 ttt85 -93.12 -17.93 23.2 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.258 -0.901 . . . . 0.0 110.441 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.441 ' OE2' ' HG2' ' A' ' 28' ' ' GLU . 0.4 OUTLIER -88.56 -23.25 23.2 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.168 -0.957 . . . . 0.0 110.352 -179.893 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.483 ' HB2' HD13 ' A' ' 29' ' ' LEU . 13.1 mt -123.61 143.93 42.99 Favored Pre-proline 0 C--N 1.304 -1.381 0 O-C-N 121.231 -0.918 . . . . 0.0 110.383 -179.51 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.427 ' HD2' ' HB2' ' A' ' 37' ' ' GLN . 30.3 Cg_exo -46.62 145.19 6.68 Favored 'Trans proline' 0 C--N 1.305 -1.747 0 O-C-N 123.951 1.5 . . . . 0.0 109.918 179.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.414 ' C ' ' O ' ' A' ' 34' ' ' PRO . 27.8 Cg_endo -42.12 -40.47 6.48 Favored 'Trans proline' 0 C--N 1.304 -1.802 0 O-C-N 123.94 1.495 . . . . 0.0 110.371 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -65.77 -46.92 76.97 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.226 -0.921 . . . . 0.0 110.578 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.427 ' HB2' ' HD2' ' A' ' 34' ' ' PRO . 1.2 mp0 -69.41 -43.63 73.03 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.219 -0.926 . . . . 0.0 110.289 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.505 ' CB ' ' HA ' ' A' ' 30' ' ' ARG . . . -61.19 -48.13 82.95 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.366 -0.834 . . . . 0.0 110.5 -179.651 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.422 ' O ' ' HB2' ' A' ' 43' ' ' LYS . 9.8 tt0 -57.51 -48.04 80.34 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.174 -0.954 . . . . 0.0 110.106 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -64.02 -41.56 97.42 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.262 -0.899 . . . . 0.0 110.241 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 66.9 m -64.53 -50.77 66.04 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.212 -0.93 . . . . 0.0 110.257 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.462 HG13 ' CD2' ' A' ' 29' ' ' LEU . 64.2 mt -66.72 -14.42 17.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.269 -0.895 . . . . 0.0 109.955 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.527 ' HD3' ' CZ ' ' A' ' 44' ' ' ARG . 9.8 tttp -73.55 -16.23 61.27 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.379 -0.825 . . . . 0.0 110.253 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.649 ' CB ' ' CD1' ' A' ' 63' ' ' PHE . 5.1 mpt_? -119.06 -58.42 1.94 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.358 -0.839 . . . . 0.0 110.647 -179.6 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.515 ' C ' ' O ' ' A' ' 44' ' ' ARG . 3.9 ttm -26.96 90.99 0.05 OUTLIER Pre-proline 0 N--CA 1.499 1.994 0 O-C-N 121.973 -0.454 . . . . 0.0 111.529 -179.663 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.52 ' N ' ' O ' ' A' ' 44' ' ' ARG . 18.1 Cg_endo . . . . . 0 C--N 1.305 -1.728 0 O-C-N 124.141 1.601 . . . . 0.0 110.172 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.551 0 CA-C-O 121.284 0.564 . . . . 0.0 110.205 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.425 ' HB3' ' HG2' ' A' ' 45' ' ' MET . 45.0 mt -130.05 160.15 34.56 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.237 -0.914 . . . . 0.0 109.997 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.456 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.8 OUTLIER -113.38 110.77 20.86 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.086 -1.008 . . . . 0.0 110.706 179.925 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.612 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 18.3 p90 -73.01 -28.12 62.18 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.26 -0.9 . . . . 0.0 109.512 179.283 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.612 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.09 -43.42 78.02 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.445 -0.784 . . . . 0.0 109.881 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.34 -33.3 74.44 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.252 -0.905 . . . . 0.0 109.798 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.649 ' CD1' ' CB ' ' A' ' 44' ' ' ARG . 4.0 t80 -72.12 -34.58 68.7 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.605 -0.684 . . . . 0.0 110.207 179.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.28 -49.67 74.73 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.259 -0.901 . . . . 0.0 110.388 -179.716 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.1 t -58.46 -39.06 78.9 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.178 -0.951 . . . . 0.0 110.293 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.06 -39.76 75.47 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.32 -0.863 . . . . 0.0 110.245 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.596 ' CD1' ' CZ ' ' A' ' 63' ' ' PHE . 1.8 mt -59.91 -40.04 87.44 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.24 -0.913 . . . . 0.0 110.277 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 . . . . . 0 N--CA 1.492 1.632 0 O-C-N 121.238 -0.914 . . . . 0.0 110.252 -179.922 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 121.191 0.52 . . . . 0.0 110.218 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 1.4 ttpt -62.39 -42.3 99.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.23 -0.919 . . . . 0.0 110.011 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.31 -36.11 75.04 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.265 -0.897 . . . . 0.0 109.911 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.42 -42.16 83.68 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.253 -0.904 . . . . 0.0 109.938 179.739 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . 0.427 ' HB1' HD11 ' A' ' 16' ' ' ILE . . . -62.72 -40.89 98.6 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.299 -0.875 . . . . 0.0 109.445 179.494 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.443 HG12 HD22 ' A' ' 33' ' ' LEU . 73.7 t -63.36 -40.39 88.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.356 -0.84 . . . . 0.0 109.493 179.307 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.71 -35.82 79.15 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.39 -0.819 . . . . 0.0 110.074 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 2.4 m -70.07 -47.22 62.82 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.214 -0.929 . . . . 0.0 110.319 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.461 HG13 HD12 ' A' ' 33' ' ' LEU . 23.1 t -62.33 -43.09 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.248 -0.908 . . . . 0.0 110.352 -179.757 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 88.1 t -62.08 -51.04 77.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.276 -0.89 . . . . 0.0 110.334 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.68 -40.16 86.89 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.213 -0.929 . . . . 0.0 110.286 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.85 -41.21 97.84 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.201 -0.937 . . . . 0.0 110.196 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 71.5 t -66.79 -41.29 87.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.191 -0.943 . . . . 0.0 110.223 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -64.58 -39.59 94.0 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.273 -0.892 . . . . 0.0 110.307 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -58.44 -47.52 83.7 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.085 -1.009 . . . . 0.0 110.308 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.3 -40.8 78.6 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.31 -0.869 . . . . 0.0 110.345 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 3.4 mmm-85 . . . . . 0 N--CA 1.492 1.629 0 O-C-N 121.262 -0.899 . . . . 0.0 110.192 -179.878 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.221 0.534 . . . . 0.0 110.208 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.55 -50.01 71.19 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.243 -0.91 . . . . 0.0 109.821 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -36.7 65.53 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.392 -0.817 . . . . 0.0 109.942 179.674 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.428 ' HA ' ' OE1' ' A' ' 9' ' ' GLN . 3.1 tp60 -61.61 -37.49 84.12 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.232 -0.917 . . . . 0.0 110.2 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.471 HG13 ' HB2' ' A' ' 64' ' ' SER . 66.9 t -58.13 -43.49 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.163 -0.961 . . . . 0.0 109.951 179.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.2 mp -62.77 -48.66 87.05 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.278 -0.889 . . . . 0.0 109.54 179.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.69 -42.31 83.39 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.213 -0.93 . . . . 0.0 109.095 179.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.7 p -66.68 -39.14 88.0 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.394 -0.816 . . . . 0.0 109.046 178.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.519 ' HB3' ' CZ ' ' A' ' 60' ' ' TYR . 1.1 m-85 -68.6 -41.91 78.92 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.374 -0.829 . . . . 0.0 109.522 179.039 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.9 ttt180 -54.12 -44.02 70.97 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.341 -0.849 . . . . 0.0 109.629 179.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.406 HD11 ' HB1' ' B' ' 12' ' ' ALA . 68.3 mt -62.63 -44.93 99.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.409 -0.807 . . . . 0.0 109.859 179.607 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.419 HD11 ' N ' ' A' ' 17' ' ' LEU . 6.4 mp -65.0 -34.4 78.36 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.373 -0.829 . . . . 0.0 109.899 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.467 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -81.07 -1.62 44.9 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.32 -0.863 . . . . 0.0 110.162 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.413 ' HB3' ' O ' ' A' ' 18' ' ' ALA . 8.8 t 59.01 74.75 0.43 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.251 -0.905 . . . . 0.0 110.206 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 47.77 62.63 2.37 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.267 -0.896 . . . . 0.0 110.208 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.565 ' HD2' ' CZ ' ' A' ' 23' ' ' TYR . 0.8 OUTLIER -145.96 142.91 18.34 Favored Pre-proline 0 N--CA 1.489 1.493 0 O-C-N 121.239 -0.913 . . . . 0.0 110.144 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -76.37 3.2 6.51 Favored 'Trans proline' 0 C--N 1.303 -1.831 0 O-C-N 124.094 1.576 . . . . 0.0 110.127 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.565 ' CZ ' ' HD2' ' A' ' 21' ' ' LYS . 9.1 p90 -148.91 167.9 24.5 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.224 -0.922 . . . . 0.0 110.228 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.49 HD11 ' N ' ' A' ' 25' ' ' LEU . 0.3 OUTLIER -129.11 145.48 35.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.19 -0.944 . . . . 0.0 110.053 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.49 ' N ' HD11 ' A' ' 24' ' ' ILE . 4.7 mt -89.42 151.18 22.16 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.236 -0.915 . . . . 0.0 110.235 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.82 -39.35 91.49 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.229 -0.92 . . . . 0.0 110.046 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -65.52 -34.9 79.33 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.298 -0.876 . . . . 0.0 110.077 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.443 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 12.2 mm-40 -62.07 -46.42 89.17 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.399 -0.813 . . . . 0.0 110.15 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 21.7 mt -59.86 -35.38 74.67 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.237 -0.914 . . . . 0.0 109.961 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.2 mmm-85 -69.06 -35.74 76.87 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.299 -0.876 . . . . 0.0 110.696 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -90.1 -29.79 18.09 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.149 -0.969 . . . . 0.0 110.71 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.443 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 3.1 mm-40 -91.61 -23.19 19.94 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.107 -0.996 . . . . 0.0 110.57 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.529 HD21 ' CB ' ' A' ' 37' ' ' GLN . 0.3 OUTLIER -128.48 144.95 53.97 Favored Pre-proline 0 N--CA 1.489 1.48 0 O-C-N 121.073 -1.017 . . . . 0.0 110.385 -179.715 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.453 ' HD2' HD21 ' A' ' 33' ' ' LEU . 2.6 Cg_endo -49.01 142.09 20.8 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 O-C-N 124.082 1.57 . . . . 0.0 110.107 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -43.31 -33.56 4.01 Favored 'Trans proline' 0 C--N 1.304 -1.792 0 O-C-N 124.005 1.529 . . . . 0.0 110.611 -179.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -65.38 -47.11 77.52 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.112 -0.992 . . . . 0.0 110.341 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.529 ' CB ' HD21 ' A' ' 33' ' ' LEU . 1.7 mp0 -70.18 -42.1 72.85 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.189 -0.945 . . . . 0.0 110.355 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.28 -42.61 77.74 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.258 -0.901 . . . . 0.0 110.62 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -60.53 -48.55 81.29 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.168 -0.957 . . . . 0.0 110.429 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -63.51 -46.74 84.69 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.162 -0.961 . . . . 0.0 110.471 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 89.0 m -65.3 -41.06 94.47 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.257 -0.902 . . . . 0.0 110.623 -179.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 63.0 mt -67.85 -23.03 28.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.183 -0.948 . . . . 0.0 110.601 -179.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -84.79 -23.54 29.12 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.191 -0.943 . . . . 0.0 110.783 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.488 ' HG2' ' CE1' ' A' ' 63' ' ' PHE . 0.7 OUTLIER -92.49 -56.91 2.85 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.108 -0.995 . . . . 0.0 110.641 -179.544 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.507 ' CE ' ' HB3' ' A' ' 60' ' ' TYR . 0.6 OUTLIER -33.98 103.57 0.23 Allowed Pre-proline 0 N--CA 1.496 1.839 0 O-C-N 121.606 -0.684 . . . . 0.0 111.059 -179.845 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.404 ' O ' ' O ' ' A' ' 45' ' ' MET . 32.2 Cg_exo . . . . . 0 C--N 1.307 -1.65 0 O-C-N 124.122 1.59 . . . . 0.0 110.359 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 121.311 0.577 . . . . 0.0 110.356 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.45 ' HB3' ' HB3' ' A' ' 45' ' ' MET . 15.0 mt -127.86 154.31 45.62 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.331 -0.856 . . . . 0.0 109.871 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.452 ' C ' ' HG3' ' A' ' 45' ' ' MET . 5.5 m-20 -105.23 110.87 23.4 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.105 -0.997 . . . . 0.0 110.552 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.519 ' CZ ' ' HB3' ' A' ' 14' ' ' PHE . 22.2 p90 -80.42 -21.22 42.43 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.322 -0.861 . . . . 0.0 109.759 179.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.509 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.9 -37.85 69.42 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.372 -0.83 . . . . 0.0 109.808 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.06 -33.75 76.78 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.246 -0.909 . . . . 0.0 109.642 179.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.558 ' CZ ' HD13 ' A' ' 67' ' ' LEU . 1.5 t80 -71.91 -35.93 69.83 Favored 'General case' 0 C--N 1.299 -1.597 0 O-C-N 121.553 -0.717 . . . . 0.0 109.874 179.539 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.471 ' HB2' HG13 ' A' ' 10' ' ' VAL . 0.3 OUTLIER -58.34 -49.61 76.58 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.279 -0.888 . . . . 0.0 110.074 179.886 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 41.8 m -64.3 -36.85 85.44 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.183 -0.948 . . . . 0.0 110.05 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.47 -34.43 72.39 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.297 -0.877 . . . . 0.0 110.024 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.558 HD13 ' CZ ' ' A' ' 63' ' ' PHE . 0.2 OUTLIER -61.38 -44.75 96.62 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.285 -0.884 . . . . 0.0 109.955 179.891 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 . . . . . 0 N--CA 1.489 1.521 0 O-C-N 121.298 -0.876 . . . . 0.0 110.129 179.676 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.452 ' O ' ' HG3' ' B' ' 8' ' ' LYS . 5.5 ptpp? . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 121.218 0.532 . . . . 0.0 110.264 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 3.4 ttmt -57.66 -49.18 77.34 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.191 -0.943 . . . . 0.0 109.882 179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.69 -33.84 64.53 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.252 -0.905 . . . . 0.0 109.612 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.66 -40.55 84.51 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.352 -0.843 . . . . 0.0 109.878 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . 0.406 ' HB1' HD11 ' A' ' 16' ' ' ILE . . . -62.66 -42.78 99.8 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.324 -0.86 . . . . 0.0 109.715 179.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.441 ' O ' ' CG2' ' B' ' 17' ' ' VAL . 70.2 t -59.48 -40.46 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.358 -0.839 . . . . 0.0 109.593 179.464 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.9 -41.41 87.15 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.402 -0.811 . . . . 0.0 109.893 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.11 -44.95 94.21 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.357 -0.839 . . . . 0.0 110.129 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.45 HG13 ' CD1' ' A' ' 33' ' ' LEU . 95.6 t -64.31 -42.9 96.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.302 -0.873 . . . . 0.0 109.921 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.441 ' CG2' ' O ' ' B' ' 13' ' ' VAL . 22.1 t -61.29 -48.21 89.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.311 -0.868 . . . . 0.0 110.025 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.71 -45.87 90.76 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.249 -0.907 . . . . 0.0 109.995 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.01 -45.57 88.35 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.254 -0.904 . . . . 0.0 110.048 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 46.9 t -62.6 -43.02 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.156 -0.965 . . . . 0.0 109.887 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.09 -36.85 75.83 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.252 -0.905 . . . . 0.0 109.972 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.63 -44.52 96.07 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.318 -0.864 . . . . 0.0 109.903 179.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . 0.423 ' HB2' HD22 ' A' ' 67' ' ' LEU . . . -63.1 -35.08 79.08 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.308 -0.87 . . . . 0.0 110.258 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 44.3 ttt180 . . . . . 0 N--CA 1.492 1.654 0 O-C-N 121.311 -0.868 . . . . 0.0 110.369 -179.855 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 121.276 0.56 . . . . 0.0 110.035 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -66.91 -44.84 79.72 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.307 -0.871 . . . . 0.0 109.681 179.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -54.66 -35.71 63.82 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.426 -0.796 . . . . 0.0 109.789 179.44 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -60.9 -45.33 95.06 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.295 -0.878 . . . . 0.0 109.986 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 61.8 t -63.87 -43.83 97.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.183 -0.948 . . . . 0.0 109.46 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 86.3 mt -60.67 -45.7 97.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.389 -0.819 . . . . 0.0 109.369 179.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.54 -41.67 81.4 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.327 -0.858 . . . . 0.0 108.778 179.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.446 ' HA ' ' CB ' ' B' ' 12' ' ' ALA . 2.6 m -68.03 -39.53 83.1 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 178.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.563 ' HB3' ' CZ ' ' A' ' 60' ' ' TYR . 2.6 m-85 -68.47 -41.96 79.41 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.481 -0.762 . . . . 0.0 109.506 179.205 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -53.39 -45.84 69.43 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.298 -0.876 . . . . 0.0 109.436 179.428 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.464 HD11 HG22 ' A' ' 16' ' ' ILE . 49.7 mt -62.34 -41.3 91.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.415 -0.803 . . . . 0.0 109.711 179.387 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 mp -65.02 -38.58 91.38 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.313 -0.867 . . . . 0.0 110.0 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -85.5 3.68 39.28 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.311 -0.868 . . . . 0.0 110.334 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.453 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 0.1 OUTLIER 60.6 61.39 1.73 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.248 -0.908 . . . . 0.0 110.379 179.949 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 19' ' ' SER . 1.2 m-20 56.13 61.94 2.55 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.218 -0.926 . . . . 0.0 110.439 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 19' ' ' SER . 89.8 mttt -144.84 138.68 14.58 Favored Pre-proline 0 N--CA 1.489 1.494 0 O-C-N 121.287 -0.883 . . . . 0.0 109.733 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -68.3 -3.69 11.36 Favored 'Trans proline' 0 C--N 1.304 -1.8 0 O-C-N 124.008 1.53 . . . . 0.0 110.44 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 18.5 p90 -138.79 156.52 47.28 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.173 -0.954 . . . . 0.0 110.145 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.518 ' CG2' ' SD ' ' A' ' 45' ' ' MET . 0.2 OUTLIER -128.93 138.19 55.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.259 -0.9 . . . . 0.0 110.235 -179.803 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -80.54 141.9 34.67 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.277 -0.889 . . . . 0.0 110.41 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.453 ' HB2' HG22 ' A' ' 42' ' ' ILE . . . -61.21 -40.63 94.71 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.37 -0.831 . . . . 0.0 110.455 -179.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -55.97 -36.78 68.22 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.273 -0.892 . . . . 0.0 110.516 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -67.42 -45.55 75.79 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.198 -0.939 . . . . 0.0 109.888 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.431 ' CD2' HD13 ' A' ' 24' ' ' ILE . 20.4 mt -60.77 -36.68 79.57 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.241 -0.912 . . . . 0.0 109.756 179.697 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.0 tpt180 -62.21 -34.63 76.84 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.33 -0.856 . . . . 0.0 109.643 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 7.4 ttp180 -92.92 -35.91 13.07 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.325 -0.86 . . . . 0.0 110.212 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -77.98 -23.76 48.27 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.334 -0.853 . . . . 0.0 110.744 -179.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.545 ' CD2' ' HB3' ' A' ' 37' ' ' GLN . 0.2 OUTLIER -125.46 163.5 38.17 Favored Pre-proline 0 N--CA 1.487 1.409 0 O-C-N 121.094 -1.004 . . . . 0.0 110.422 -179.622 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.465 ' HD2' HD21 ' A' ' 33' ' ' LEU . 39.6 Cg_exo -64.58 149.58 89.63 Favored 'Trans proline' 0 C--N 1.305 -1.754 0 O-C-N 124.035 1.545 . . . . 0.0 110.101 179.774 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -43.72 -44.85 11.29 Favored 'Trans proline' 0 C--N 1.304 -1.8 0 O-C-N 124.035 1.545 . . . . 0.0 110.418 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.49 ' OD1' ' NE2' ' A' ' 37' ' ' GLN . 3.4 p30 -65.89 -40.06 91.22 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.174 -0.954 . . . . 0.0 110.68 -179.729 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.545 ' HB3' ' CD2' ' A' ' 33' ' ' LEU . 76.0 mm-40 -70.07 -38.54 75.77 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.007 -1.058 . . . . 0.0 110.434 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.2 -42.44 93.53 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.162 -0.961 . . . . 0.0 110.363 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -58.54 -48.98 79.07 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.182 -0.949 . . . . 0.0 110.213 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -66.33 -48.08 71.42 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.242 -0.911 . . . . 0.0 110.17 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 89.6 m -65.39 -43.08 91.78 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.414 -0.804 . . . . 0.0 110.531 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.464 ' O ' HG21 ' A' ' 42' ' ' ILE . 83.8 mt -71.2 -21.17 21.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.164 -0.96 . . . . 0.0 110.364 -179.745 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -84.31 -43.59 14.64 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.176 -0.952 . . . . 0.0 110.382 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.595 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 1.6 mmp_? -68.83 -62.87 1.2 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.198 -0.939 . . . . 0.0 110.459 -179.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.535 ' HE3' ' CB ' ' A' ' 60' ' ' TYR . 2.3 ttm -30.43 118.1 0.33 Allowed Pre-proline 0 N--CA 1.494 1.768 0 O-C-N 121.853 -0.529 . . . . 0.0 111.336 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.466 ' O ' HD22 ' A' ' 58' ' ' LEU . 9.6 Cg_endo . . . . . 0 C--N 1.306 -1.694 0 O-C-N 124.084 1.571 . . . . 0.0 110.321 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . 0.43 ' C ' ' HG ' ' A' ' 58' ' ' LEU . . . . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 121.247 0.546 . . . . 0.0 110.135 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.482 ' HB3' ' HB3' ' A' ' 45' ' ' MET . 1.1 mt -135.54 160.34 38.78 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.245 -0.91 . . . . 0.0 110.29 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.429 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.5 OUTLIER -107.16 111.26 23.6 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.34 -0.85 . . . . 0.0 110.138 179.759 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.563 ' CZ ' ' HB3' ' A' ' 14' ' ' PHE . 17.9 p90 -72.57 -23.69 61.0 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.286 -0.883 . . . . 0.0 110.081 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.516 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.88 -35.81 66.92 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.251 -0.906 . . . . 0.0 109.787 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.2 -34.26 75.93 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.285 -0.885 . . . . 0.0 109.821 179.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.595 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 12.1 t80 -72.04 -34.81 69.07 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.633 -0.667 . . . . 0.0 110.292 179.761 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.4 m -57.04 -49.72 74.95 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.21 -0.932 . . . . 0.0 110.461 -179.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.2 m -57.89 -35.71 71.39 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.171 -0.956 . . . . 0.0 110.614 -179.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.17 -46.09 82.24 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.13 -0.981 . . . . 0.0 110.635 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.592 HD22 ' CE1' ' A' ' 63' ' ' PHE . 0.1 OUTLIER -62.08 -43.54 98.61 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.253 -0.904 . . . . 0.0 110.593 -179.695 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 . . . . . 0 N--CA 1.493 1.71 0 O-C-N 121.182 -0.948 . . . . 0.0 110.509 -179.633 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.286 0.565 . . . . 0.0 110.203 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.433 ' O ' HG21 ' B' ' 13' ' ' VAL . 0.0 OUTLIER -70.81 -51.01 29.45 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.206 -0.934 . . . . 0.0 110.027 179.945 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.34 -40.57 71.37 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.258 -0.901 . . . . 0.0 109.943 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -65.63 -40.77 92.92 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.331 -0.856 . . . . 0.0 110.168 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . 0.446 ' CB ' ' HA ' ' A' ' 13' ' ' SER . . . -67.43 -38.01 83.9 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.269 -0.894 . . . . 0.0 110.2 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.435 ' O ' HG22 ' B' ' 17' ' ' VAL . 46.9 t -63.13 -44.14 99.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.328 -0.858 . . . . 0.0 110.152 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.2 -41.84 89.52 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.195 -0.94 . . . . 0.0 110.226 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 28.3 m -63.77 -37.43 87.32 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.317 -0.864 . . . . 0.0 110.234 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 88.0 t -68.89 -46.43 79.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.202 -0.936 . . . . 0.0 110.198 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.45 ' O ' ' HB2' ' B' ' 21' ' ' ASP . 59.3 t -58.74 -43.52 88.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.225 -0.922 . . . . 0.0 110.195 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.97 -44.72 91.88 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.266 -0.897 . . . . 0.0 110.243 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.27 -43.54 94.49 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.196 -0.94 . . . . 0.0 110.22 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 61.2 t -66.96 -42.5 88.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.323 -0.861 . . . . 0.0 110.328 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' B' ' 17' ' ' VAL . 3.1 t0 -60.82 -31.63 71.03 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.252 -0.905 . . . . 0.0 110.376 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -59.24 -51.24 70.83 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.184 -0.948 . . . . 0.0 110.251 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.4 -38.24 87.06 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.245 -0.909 . . . . 0.0 110.148 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.614 0 O-C-N 121.385 -0.822 . . . . 0.0 110.512 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.5 HG23 ' CE1' ' A' ' 68' ' ' TYR . 6.6 m . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.282 0.563 . . . . 0.0 110.159 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.54 -46.04 84.54 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.249 -0.907 . . . . 0.0 109.71 179.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -57.61 -36.65 72.06 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.402 -0.811 . . . . 0.0 109.879 179.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 37.3 tt0 -61.61 -45.85 92.33 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.263 -0.898 . . . . 0.0 110.115 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.445 HG11 ' CE2' ' A' ' 14' ' ' PHE . 54.1 t -59.47 -42.11 86.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.109 -0.995 . . . . 0.0 109.745 179.675 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 86.8 mt -65.31 -48.12 84.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 121.321 -0.862 . . . . 0.0 109.36 179.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.56 -39.81 77.53 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.282 -0.886 . . . . 0.0 108.792 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.473 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 7.0 m -67.21 -43.92 80.87 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 178.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.532 ' CB ' ' CD1' ' A' ' 60' ' ' TYR . 5.8 m-85 -67.32 -40.71 85.98 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.474 -0.766 . . . . 0.0 109.309 179.044 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.514 ' O ' ' N ' ' A' ' 20' ' ' ASP . 17.2 ttt180 -52.93 -40.95 64.01 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.407 -0.808 . . . . 0.0 109.223 179.241 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 49.1 mt -64.55 -43.91 96.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.407 -0.808 . . . . 0.0 110.224 179.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 13' ' ' SER . 15.5 mt -62.96 -41.73 99.62 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.087 -1.008 . . . . 0.0 110.096 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.465 ' HB2' ' O ' ' A' ' 23' ' ' TYR . . . -83.59 13.31 4.7 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.311 -0.868 . . . . 0.0 110.299 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.429 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 65.69 57.8 0.83 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.21 -0.931 . . . . 0.0 110.28 179.899 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.514 ' N ' ' O ' ' A' ' 15' ' ' ARG . 0.6 OUTLIER 55.42 63.29 2.13 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.303 -0.873 . . . . 0.0 110.48 179.858 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -147.34 143.7 18.47 Favored Pre-proline 0 N--CA 1.49 1.565 0 O-C-N 121.202 -0.936 . . . . 0.0 110.034 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.467 ' O ' ' CD1' ' A' ' 23' ' ' TYR . 14.5 Cg_endo -72.89 -1.23 10.14 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 124.153 1.607 . . . . 0.0 110.114 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.467 ' CD1' ' O ' ' A' ' 22' ' ' PRO . 10.7 m-85 -130.44 150.06 51.84 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.262 -0.899 . . . . 0.0 109.866 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.523 HD12 ' N ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -135.28 145.01 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.116 -0.99 . . . . 0.0 110.106 -179.828 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.523 ' N ' HD12 ' A' ' 24' ' ' ILE . 2.1 mp -80.09 153.54 28.67 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.267 -0.896 . . . . 0.0 110.061 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.458 ' O ' ' HB2' ' A' ' 29' ' ' LEU . . . -66.32 -45.37 80.54 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.249 -0.907 . . . . 0.0 110.071 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.84 -36.93 77.84 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.143 -0.973 . . . . 0.0 109.687 179.705 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.468 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 0.9 OUTLIER -58.37 -38.7 77.81 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.294 -0.878 . . . . 0.0 109.183 179.273 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.458 ' HB2' ' O ' ' A' ' 26' ' ' ALA . 20.3 mt -61.42 -38.04 85.67 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.42 -0.8 . . . . 0.0 109.571 179.377 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.403 ' HA ' ' CB ' ' A' ' 38' ' ' ALA . 14.4 mtp85 -68.27 -34.03 75.45 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.306 -0.871 . . . . 0.0 110.077 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 15.4 ttt-85 -87.17 -21.56 25.85 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.284 -0.885 . . . . 0.0 110.7 -179.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.468 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 0.5 OUTLIER -99.02 -23.83 15.14 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.048 -1.033 . . . . 0.0 110.646 -179.552 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.478 ' CD2' ' HB3' ' A' ' 37' ' ' GLN . 3.5 mt -124.01 162.17 42.85 Favored Pre-proline 0 C--N 1.304 -1.39 0 O-C-N 121.11 -0.994 . . . . 0.0 110.196 -179.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.476 ' HD2' HD21 ' A' ' 33' ' ' LEU . 34.8 Cg_exo -62.72 179.86 0.64 Allowed 'Trans proline' 0 C--N 1.304 -1.768 0 O-C-N 123.918 1.483 . . . . 0.0 109.889 179.418 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.463 ' HD2' ' CB ' ' A' ' 34' ' ' PRO . 19.0 Cg_endo -63.99 -49.26 4.07 Favored 'Trans proline' 0 C--N 1.304 -1.772 0 O-C-N 123.941 1.495 . . . . 0.0 110.35 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -66.01 -40.94 91.55 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.292 -0.88 . . . . 0.0 110.863 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.478 ' HB3' ' CD2' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -69.65 -40.9 76.2 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.07 -1.019 . . . . 0.0 110.564 -179.5 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.403 ' CB ' ' HA ' ' A' ' 30' ' ' ARG . . . -66.45 -40.74 89.61 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.151 -0.968 . . . . 0.0 110.353 -179.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -66.08 -48.87 69.56 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.187 -0.946 . . . . 0.0 110.509 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -62.08 -45.58 92.88 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.237 -0.914 . . . . 0.0 110.593 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 68.7 m -60.74 -44.33 96.8 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.149 -0.969 . . . . 0.0 110.514 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 72.3 mt -61.17 -32.84 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.169 -0.957 . . . . 0.0 110.404 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -76.44 -24.49 53.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.136 -0.978 . . . . 0.0 110.346 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.639 ' CD ' ' CE1' ' A' ' 63' ' ' PHE . 0.1 OUTLIER -84.07 -61.79 1.73 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.207 -0.933 . . . . 0.0 110.142 179.987 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.483 ' HE3' ' HB3' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -34.39 103.46 0.23 Allowed Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.672 -0.642 . . . . 0.0 111.241 179.89 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo . . . . . 0 C--N 1.305 -1.725 0 O-C-N 123.889 1.468 . . . . 0.0 109.683 179.361 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 121.253 0.549 . . . . 0.0 110.204 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.471 ' HB3' ' HB3' ' A' ' 45' ' ' MET . 54.5 mt -114.57 159.77 20.04 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.322 -0.861 . . . . 0.0 110.198 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.501 ' OD1' ' N ' ' A' ' 59' ' ' ASP . 13.5 p30 -110.34 111.09 22.15 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.253 -0.905 . . . . 0.0 110.468 179.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.572 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 24.8 p90 -74.8 -27.35 60.27 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.169 -0.957 . . . . 0.0 109.268 179.435 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.572 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.12 -44.74 79.43 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.446 -0.784 . . . . 0.0 109.591 179.616 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.48 -32.83 72.85 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.254 -0.904 . . . . 0.0 109.472 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.639 ' CE1' ' CD ' ' A' ' 44' ' ' ARG . 1.1 t80 -71.67 -40.34 69.69 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.626 -0.671 . . . . 0.0 109.983 179.641 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 21.0 p -58.92 -45.14 91.07 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.295 -0.878 . . . . 0.0 110.23 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 16.3 t -60.51 -39.69 88.69 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.276 -0.89 . . . . 0.0 110.219 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.26 -40.7 51.22 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.215 -0.928 . . . . 0.0 110.104 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.502 ' HG ' ' N ' ' A' ' 68' ' ' TYR . 0.0 OUTLIER -66.48 -45.55 79.31 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.274 -0.891 . . . . 0.0 109.68 179.821 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.502 ' N ' ' HG ' ' A' ' 67' ' ' LEU . 3.9 m-85 . . . . . 0 N--CA 1.491 1.62 0 O-C-N 121.632 -0.668 . . . . 0.0 110.223 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 33.3 tttt . . . . . 0 N--CA 1.498 1.952 0 CA-C-O 120.928 0.394 . . . . 0.0 110.767 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 7.2 ttmt -57.02 -33.85 67.59 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.038 -1.038 . . . . 0.0 110.037 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.38 -38.65 88.0 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.269 -0.894 . . . . 0.0 109.664 179.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -65.39 -42.1 93.0 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.296 -0.877 . . . . 0.0 109.807 179.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . 0.458 ' O ' HG22 ' B' ' 16' ' ' VAL . . . -63.16 -33.05 74.63 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.35 -0.844 . . . . 0.0 109.888 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.453 HG21 HD23 ' A' ' 17' ' ' LEU . 87.8 t -65.72 -42.29 92.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.287 -0.883 . . . . 0.0 110.135 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.71 -39.56 81.17 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.23 -0.919 . . . . 0.0 110.245 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.5 m -65.97 -43.74 87.01 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.301 -0.874 . . . . 0.0 110.193 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.458 HG22 ' O ' ' B' ' 12' ' ' ALA . 67.9 t -64.93 -43.22 96.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.246 -0.909 . . . . 0.0 110.06 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.425 HG23 ' HG2' ' A' ' 37' ' ' GLN . 43.6 t -58.58 -50.44 78.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.288 -0.883 . . . . 0.0 110.039 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.8 -46.69 88.44 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.251 -0.905 . . . . 0.0 109.822 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.78 -45.96 87.4 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.342 -0.849 . . . . 0.0 109.901 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . 0.435 HG21 ' O ' ' B' ' 16' ' ' VAL . 75.3 t -63.26 -44.14 99.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.278 -0.889 . . . . 0.0 109.642 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -59.61 -40.25 86.91 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.399 -0.813 . . . . 0.0 109.708 179.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -54.21 -40.13 67.34 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.231 -0.918 . . . . 0.0 109.532 179.539 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.04 -39.39 85.77 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.344 -0.847 . . . . 0.0 109.627 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 6.9 ttm-85 . . . . . 0 N--CA 1.488 1.449 0 O-C-N 121.261 -0.899 . . . . 0.0 109.69 179.506 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.455 HG21 ' CE2' ' A' ' 68' ' ' TYR . 3.6 m . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.338 0.59 . . . . 0.0 110.15 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -69.99 -45.2 67.8 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.253 -0.904 . . . . 0.0 109.864 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -54.78 -37.07 65.58 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.34 -0.85 . . . . 0.0 109.806 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.0 tp60 -61.98 -45.0 95.55 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.306 -0.871 . . . . 0.0 110.0 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.453 ' O ' ' HB2' ' A' ' 14' ' ' PHE . 17.3 t -60.36 -45.14 96.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.238 -0.914 . . . . 0.0 109.947 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.404 HG23 HD11 ' A' ' 11' ' ' ILE . 69.2 mt -59.4 -49.65 82.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.319 -0.863 . . . . 0.0 109.911 179.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.97 -47.91 81.54 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.186 -0.947 . . . . 0.0 109.343 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.0 p -65.42 -36.06 82.8 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.336 -0.852 . . . . 0.0 109.201 179.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.453 ' HB2' ' O ' ' A' ' 10' ' ' VAL . 1.0 OUTLIER -68.29 -43.99 76.46 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.431 -0.793 . . . . 0.0 109.323 179.308 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.2 ttt180 -53.53 -48.44 69.04 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.391 -0.818 . . . . 0.0 108.974 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 50.7 mt -58.93 -43.42 88.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.412 -0.805 . . . . 0.0 109.566 179.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.469 HD11 ' N ' ' A' ' 17' ' ' LEU . 5.1 mp -64.94 -36.05 83.13 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.324 -0.86 . . . . 0.0 110.033 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.443 ' HA ' ' OE1' ' A' ' 28' ' ' GLU . . . -81.04 0.78 34.29 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.311 -0.868 . . . . 0.0 110.149 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.44 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 3.3 t 65.28 76.14 0.34 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.259 -0.901 . . . . 0.0 110.172 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.409 ' C ' ' O ' ' A' ' 19' ' ' SER . 10.4 t70 42.85 56.34 4.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.284 -0.885 . . . . 0.0 110.298 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.438 ' HG3' ' O ' ' A' ' 19' ' ' SER . 9.5 mttm -143.94 143.85 24.43 Favored Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.225 -0.922 . . . . 0.0 110.116 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.464 ' O ' ' CD1' ' A' ' 23' ' ' TYR . 19.2 Cg_endo -76.27 3.36 6.32 Favored 'Trans proline' 0 C--N 1.304 -1.795 0 O-C-N 124.049 1.552 . . . . 0.0 110.182 179.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.464 ' CD1' ' O ' ' A' ' 22' ' ' PRO . 47.7 m-85 -141.91 165.84 26.37 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.305 -0.872 . . . . 0.0 110.429 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.523 ' CD1' ' HB3' ' A' ' 28' ' ' GLU . 0.3 OUTLIER -132.48 146.32 33.1 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.376 -0.827 . . . . 0.0 109.841 179.932 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.522 ' N ' HD11 ' A' ' 24' ' ' ILE . 49.2 mt -92.33 155.64 17.79 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.164 -0.96 . . . . 0.0 110.344 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.488 ' O ' ' HG ' ' A' ' 29' ' ' LEU . . . -63.07 -38.97 93.32 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.35 -0.844 . . . . 0.0 110.056 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.05 -33.99 70.81 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.226 -0.921 . . . . 0.0 109.705 179.473 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.523 ' HB3' ' CD1' ' A' ' 24' ' ' ILE . 19.9 tt0 -62.9 -51.27 67.62 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.357 -0.839 . . . . 0.0 110.227 -179.563 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.494 ' HA ' ' HG2' ' A' ' 32' ' ' GLU . 4.0 pp -67.8 -33.28 74.49 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.01 -1.056 . . . . 0.0 109.221 179.132 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.45 ' HA ' ' HB3' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -65.55 -33.91 77.02 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.233 -0.917 . . . . 0.0 110.539 179.908 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -89.73 -15.1 33.22 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.062 -1.023 . . . . 0.0 111.395 -179.147 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.494 ' HG2' ' HA ' ' A' ' 29' ' ' LEU . 12.1 pt-20 -108.79 -24.32 11.35 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.797 -1.19 . . . . 0.0 111.329 -179.339 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.513 HD21 ' CB ' ' A' ' 37' ' ' GLN . 0.5 OUTLIER -110.1 146.32 33.95 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 120.944 -1.098 . . . . 0.0 110.173 -179.929 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.428 ' O ' ' C ' ' A' ' 35' ' ' PRO . 47.8 Cg_exo -48.17 140.75 19.2 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 O-C-N 123.934 1.491 . . . . 0.0 110.194 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.428 ' C ' ' O ' ' A' ' 34' ' ' PRO . 29.8 Cg_endo -41.12 -38.15 3.07 Favored 'Trans proline' 0 C--N 1.304 -1.804 0 O-C-N 124.062 1.559 . . . . 0.0 110.263 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -65.74 -44.16 86.79 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.308 -0.87 . . . . 0.0 110.441 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.513 ' CB ' HD21 ' A' ' 33' ' ' LEU . 62.6 mm-40 -68.95 -42.19 77.02 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.197 -0.939 . . . . 0.0 110.26 -179.731 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.493 ' HA ' ' CD1' ' A' ' 29' ' ' LEU . . . -56.25 -43.4 78.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.23 -0.919 . . . . 0.0 110.248 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -65.9 -44.75 84.3 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.24 -0.912 . . . . 0.0 110.148 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.09 -47.81 78.6 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.233 -0.917 . . . . 0.0 110.009 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.478 ' O ' ' HG2' ' A' ' 45' ' ' MET . 60.9 m -65.84 -51.0 62.57 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.453 -0.779 . . . . 0.0 111.082 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.493 HG13 ' CD1' ' A' ' 29' ' ' LEU . 44.3 mt -50.84 -28.49 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 O-C-N 121.208 -0.932 . . . . 0.0 110.675 -179.282 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 6.1 tttt -85.81 -27.14 25.33 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.218 -0.926 . . . . 0.0 110.693 -179.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.573 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 13.8 mmt180 -76.72 -71.63 0.39 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.245 -0.909 . . . . 0.0 110.801 -179.452 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.529 ' HE3' ' CA ' ' A' ' 60' ' ' TYR . 12.0 ptp -57.33 122.48 55.0 Favored Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 121.173 -0.954 . . . . 0.0 110.498 -179.636 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo . . . . . 0 C--N 1.307 -1.657 0 O-C-N 123.95 1.5 . . . . 0.0 110.199 179.92 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.19 0.519 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.44 ' HB3' ' HG3' ' A' ' 45' ' ' MET . 70.8 mt -118.99 156.89 28.81 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.278 -0.889 . . . . 0.0 110.33 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -107.81 113.29 26.42 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.278 -0.888 . . . . 0.0 110.212 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.529 ' CA ' ' HE3' ' A' ' 45' ' ' MET . 26.0 p90 -83.78 -23.29 31.57 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.214 -0.929 . . . . 0.0 110.339 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.482 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.02 -41.46 74.99 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.119 -0.988 . . . . 0.0 109.508 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.51 -32.42 73.77 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.321 -0.862 . . . . 0.0 109.612 179.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.573 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 5.3 t80 -69.65 -33.09 72.12 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 121.62 -0.675 . . . . 0.0 110.252 179.725 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.452 ' HA ' HD22 ' A' ' 67' ' ' LEU . 5.8 p -63.92 -50.05 70.21 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.222 -0.924 . . . . 0.0 110.154 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 25.8 t -68.8 -35.39 76.96 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.203 -0.936 . . . . 0.0 110.108 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.18 -46.17 68.17 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.333 -0.854 . . . . 0.0 110.512 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.576 HD13 ' CG ' ' A' ' 68' ' ' TYR . 0.3 OUTLIER -69.33 -38.19 78.06 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.1 -1.0 . . . . 0.0 110.112 -179.84 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.576 ' CG ' HD13 ' A' ' 67' ' ' LEU . 2.4 m-85 . . . . . 0 N--CA 1.493 1.685 0 O-C-N 121.484 -0.76 . . . . 0.0 110.248 179.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.524 ' HG2' ' N ' ' B' ' 9' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.092 0.472 . . . . 0.0 110.408 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.524 ' N ' ' HG2' ' B' ' 8' ' ' LYS . 0.7 OUTLIER -57.61 -51.1 70.87 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.008 -1.058 . . . . 0.0 109.834 179.914 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.11 -33.98 67.89 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.252 -0.905 . . . . 0.0 109.581 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -68.7 -40.75 79.85 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.406 -0.809 . . . . 0.0 109.809 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.04 -35.87 81.69 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.344 -0.847 . . . . 0.0 109.983 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 57.8 t -61.62 -43.4 96.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.359 -0.838 . . . . 0.0 110.043 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.87 -35.57 75.08 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.236 -0.915 . . . . 0.0 110.131 179.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 17.0 m -68.16 -48.6 64.86 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.271 -0.893 . . . . 0.0 109.956 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 74.1 t -61.22 -44.32 98.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.237 -0.914 . . . . 0.0 110.13 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.412 HG21 ' HG3' ' A' ' 37' ' ' GLN . 44.1 t -58.46 -48.07 86.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.227 -0.921 . . . . 0.0 110.05 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.3 -39.81 88.24 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.348 -0.845 . . . . 0.0 110.134 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.54 -44.29 82.82 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.274 -0.891 . . . . 0.0 110.006 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . 0.444 ' HB ' ' OE1' ' A' ' 37' ' ' GLN . 77.5 t -63.79 -47.49 90.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.21 -0.931 . . . . 0.0 110.138 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -55.2 -38.05 67.88 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.18 -0.95 . . . . 0.0 109.636 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -63.38 -36.88 85.19 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.395 -0.816 . . . . 0.0 109.953 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.76 -39.48 93.68 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.305 -0.872 . . . . 0.0 110.3 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.58 0 O-C-N 121.257 -0.902 . . . . 0.0 109.845 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.608 ' CG2' ' CE1' ' A' ' 68' ' ' TYR . 2.9 m . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 121.229 0.538 . . . . 0.0 110.09 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -69.84 -44.31 70.15 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.205 -0.934 . . . . 0.0 109.774 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 19.7 tp10 -54.98 -36.41 65.35 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.371 -0.831 . . . . 0.0 109.697 179.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.402 ' O ' ' OG ' ' A' ' 13' ' ' SER . 1.1 tp60 -61.25 -44.83 96.61 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.295 -0.878 . . . . 0.0 109.858 179.89 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 59.2 t -58.38 -41.22 80.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.244 -0.91 . . . . 0.0 109.549 179.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.443 ' HA ' ' CE1' ' A' ' 60' ' ' TYR . 69.2 mt -66.71 -43.91 89.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.419 -0.801 . . . . 0.0 109.492 179.295 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.59 -43.27 84.5 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.276 -0.89 . . . . 0.0 108.861 179.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.419 ' O ' HD21 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -66.74 -38.66 87.1 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 178.71 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.552 ' HB3' ' CE2' ' A' ' 60' ' ' TYR . 1.2 m-85 -68.38 -42.28 79.36 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.491 -0.755 . . . . 0.0 109.437 179.124 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.77 -43.37 72.73 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.296 -0.878 . . . . 0.0 109.399 179.303 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.453 HD12 ' HE3' ' B' ' 8' ' ' LYS . 80.9 mt -63.79 -44.83 98.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.314 -0.866 . . . . 0.0 109.624 179.402 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.452 ' CD1' ' HB3' ' A' ' 32' ' ' GLU . 3.2 mm? -63.31 -34.75 78.36 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.32 -0.863 . . . . 0.0 109.735 179.585 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.517 ' CB ' ' O ' ' A' ' 23' ' ' TYR . . . -79.92 2.44 23.43 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.375 -0.828 . . . . 0.0 110.112 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.466 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 4.3 t 60.27 80.3 0.21 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.282 -0.886 . . . . 0.0 110.113 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.465 ' O ' ' HG2' ' A' ' 21' ' ' LYS . 6.3 m-20 45.31 59.33 3.6 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.346 -0.846 . . . . 0.0 110.438 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.466 ' HG3' ' O ' ' A' ' 19' ' ' SER . 18.4 mttp -153.5 141.72 14.01 Favored Pre-proline 0 N--CA 1.489 1.502 0 O-C-N 121.25 -0.906 . . . . 0.0 110.047 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.503 ' HG2' ' CE2' ' A' ' 23' ' ' TYR . 23.4 Cg_endo -78.36 6.25 4.89 Favored 'Trans proline' 0 C--N 1.303 -1.824 0 O-C-N 124.172 1.617 . . . . 0.0 110.232 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.517 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 22.1 m-85 -135.91 166.16 23.97 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.277 -0.889 . . . . 0.0 110.107 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.517 HD11 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -138.45 140.58 39.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.137 -0.977 . . . . 0.0 110.062 -179.945 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.517 ' N ' HD11 ' A' ' 24' ' ' ILE . 4.4 mp -83.55 154.45 23.81 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.174 -0.953 . . . . 0.0 110.019 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.83 -45.28 71.57 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.254 -0.904 . . . . 0.0 110.304 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -56.54 -39.69 73.84 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.268 -0.895 . . . . 0.0 109.937 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -59.26 -41.62 89.26 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.327 -0.858 . . . . 0.0 109.199 179.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.568 ' CD1' ' CD1' ' A' ' 33' ' ' LEU . 2.0 mm? -61.52 -33.82 74.47 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.53 -0.731 . . . . 0.0 109.417 179.265 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 14.8 mmm-85 -68.91 -34.38 75.31 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.381 -0.824 . . . . 0.0 110.322 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.2 -25.45 15.29 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.146 -0.971 . . . . 0.0 111.413 -179.139 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.452 ' HB3' ' CD1' ' A' ' 17' ' ' LEU . 12.3 mm-40 -91.64 -23.59 19.79 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 120.925 -1.109 . . . . 0.0 111.449 -178.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.568 ' CD1' ' CD1' ' A' ' 29' ' ' LEU . 7.8 mt -123.85 163.64 33.93 Favored Pre-proline 0 N--CA 1.487 1.392 0 O-C-N 120.847 -1.158 . . . . 0.0 110.734 -179.297 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.479 ' HG2' ' NE2' ' A' ' 37' ' ' GLN . 21.7 Cg_exo -61.52 139.33 81.2 Favored 'Trans proline' 0 C--N 1.306 -1.69 0 O-C-N 124.114 1.586 . . . . 0.0 110.003 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.431 ' C ' ' O ' ' A' ' 34' ' ' PRO . 31.7 Cg_endo -39.98 -41.65 3.03 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 O-C-N 124.065 1.561 . . . . 0.0 110.511 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -66.0 -37.58 86.31 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.283 -0.885 . . . . 0.0 111.081 -179.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.516 ' OE1' ' CG2' ' B' ' 17' ' ' VAL . 0.1 OUTLIER -69.64 -42.16 74.62 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.928 -1.107 . . . . 0.0 110.42 -179.562 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.471 ' O ' HG12 ' A' ' 42' ' ' ILE . . . -56.01 -48.3 76.17 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.179 -0.951 . . . . 0.0 110.288 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -56.11 -48.83 75.43 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.086 -1.009 . . . . 0.0 110.469 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -62.56 -48.12 80.88 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.152 -0.968 . . . . 0.0 110.101 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 56.6 m -65.26 -47.29 77.25 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.255 -0.903 . . . . 0.0 110.046 179.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.471 HG12 ' O ' ' A' ' 38' ' ' ALA . 16.2 mm -57.41 -22.88 18.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.389 -0.819 . . . . 0.0 110.109 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 26.1 tttt -84.47 -24.14 29.6 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.284 -0.885 . . . . 0.0 110.385 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.581 ' HB3' ' CG ' ' A' ' 63' ' ' PHE . 10.6 mmt180 -93.65 -67.92 0.83 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.246 -0.909 . . . . 0.0 110.275 -179.858 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.49 ' HG3' ' HA ' ' A' ' 60' ' ' TYR . 2.0 ttm -36.62 105.44 0.3 Allowed Pre-proline 0 N--CA 1.493 1.721 0 O-C-N 121.598 -0.689 . . . . 0.0 111.001 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.464 ' HD2' ' OD1' ' A' ' 59' ' ' ASP . 37.6 Cg_exo . . . . . 0 C--N 1.305 -1.729 0 O-C-N 124.03 1.542 . . . . 0.0 109.785 179.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 121.317 0.58 . . . . 0.0 110.275 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.41 ' HB3' ' HB3' ' A' ' 45' ' ' MET . 1.1 mt -111.62 157.75 20.05 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.226 -0.921 . . . . 0.0 110.181 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.464 ' OD1' ' HD2' ' A' ' 46' ' ' PRO . 0.7 OUTLIER -110.52 111.44 22.69 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.125 -0.984 . . . . 0.0 110.397 179.738 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.552 ' CE2' ' HB3' ' A' ' 14' ' ' PHE . 22.7 p90 -73.66 -24.82 60.03 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.217 -0.927 . . . . 0.0 109.182 179.362 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.547 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.65 -42.68 79.36 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.465 -0.772 . . . . 0.0 109.765 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.45 -40.3 86.39 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.298 -0.876 . . . . 0.0 109.874 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.581 ' CG ' ' HB3' ' A' ' 44' ' ' ARG . 1.7 t80 -71.97 -35.17 69.46 Favored 'General case' 0 C--N 1.298 -1.666 0 O-C-N 121.591 -0.693 . . . . 0.0 110.384 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 70.3 m -58.37 -43.48 88.46 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.21 -0.931 . . . . 0.0 110.465 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.28 -40.69 95.05 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.173 -0.954 . . . . 0.0 110.272 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.61 -31.94 67.46 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.281 -0.887 . . . . 0.0 110.452 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.535 ' HG ' ' CE1' ' A' ' 63' ' ' PHE . 0.5 OUTLIER -64.67 -44.41 90.48 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.109 -0.994 . . . . 0.0 110.386 -179.825 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.608 ' CE1' ' CG2' ' A' ' 6' ' ' THR . 28.4 m-85 . . . . . 0 N--CA 1.49 1.571 0 O-C-N 121.198 -0.939 . . . . 0.0 110.27 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.453 ' HE3' HD12 ' A' ' 16' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.241 0.543 . . . . 0.0 110.134 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.32 -40.34 81.82 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.291 -0.88 . . . . 0.0 110.159 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.11 -46.5 79.1 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.23 -0.919 . . . . 0.0 109.964 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -62.12 -40.95 97.63 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.277 -0.89 . . . . 0.0 110.032 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.33 -37.11 86.33 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.342 -0.849 . . . . 0.0 110.184 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.439 ' O ' ' CG2' ' B' ' 17' ' ' VAL . 42.7 t -65.31 -45.09 94.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.321 -0.862 . . . . 0.0 110.128 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.33 -35.94 74.75 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.234 -0.916 . . . . 0.0 110.173 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 15.0 m -67.54 -40.95 85.01 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.378 -0.826 . . . . 0.0 110.347 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.497 ' O ' ' CG2' ' B' ' 20' ' ' VAL . 57.4 t -69.91 -40.18 78.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.248 -0.908 . . . . 0.0 110.168 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.516 ' CG2' ' OE1' ' A' ' 37' ' ' GLN . 16.7 t -61.45 -47.41 93.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.365 -0.834 . . . . 0.0 110.238 -179.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.86 -46.01 92.27 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.253 -0.904 . . . . 0.0 110.322 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.04 -41.4 95.23 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.228 -0.92 . . . . 0.0 110.287 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . 0.497 ' CG2' ' O ' ' B' ' 16' ' ' VAL . 75.1 t -67.1 -39.44 83.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.25 -0.906 . . . . 0.0 110.425 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.44 -33.73 76.55 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.235 -0.916 . . . . 0.0 110.333 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -58.09 -49.38 77.14 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.286 -0.884 . . . . 0.0 110.267 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.15 -37.32 85.39 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.235 -0.915 . . . . 0.0 110.411 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 51.1 ttt-85 . . . . . 0 N--CA 1.493 1.694 0 O-C-N 121.268 -0.895 . . . . 0.0 110.648 -179.609 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.5 m . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.194 0.521 . . . . 0.0 110.141 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.579 ' HA ' ' CZ ' ' A' ' 68' ' ' TYR . . . -69.99 -41.48 74.34 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.335 -0.853 . . . . 0.0 109.873 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -59.66 -36.9 77.35 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.278 -0.889 . . . . 0.0 109.742 179.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.452 ' O ' ' OG ' ' A' ' 13' ' ' SER . 2.0 tt0 -64.58 -44.04 91.94 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.439 -0.788 . . . . 0.0 110.284 -179.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.46 HG23 ' OH ' ' A' ' 68' ' ' TYR . 54.3 t -57.87 -43.75 85.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.203 -0.936 . . . . 0.0 109.86 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.5 mt -63.74 -49.16 83.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.329 -0.857 . . . . 0.0 109.351 179.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.06 -43.15 86.78 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.294 -0.879 . . . . 0.0 108.92 179.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.485 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 1.0 OUTLIER -63.56 -46.63 85.02 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.608 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.567 ' HB3' ' CE2' ' A' ' 60' ' ' TYR . 3.6 m-85 -59.81 -43.14 94.63 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.465 -0.772 . . . . 0.0 109.129 178.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -52.96 -40.59 63.82 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 61.6 mt -67.1 -44.93 87.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.541 -0.724 . . . . 0.0 110.267 179.41 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 13' ' ' SER . 9.3 mt -57.88 -42.11 83.9 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.929 -1.107 . . . . 0.0 109.698 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.461 ' HB2' ' O ' ' A' ' 23' ' ' TYR . . . -79.5 4.07 16.79 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.378 -0.826 . . . . 0.0 110.298 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.436 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.3 OUTLIER 64.91 66.8 0.55 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.268 -0.895 . . . . 0.0 110.234 179.959 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 52.11 59.88 4.22 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.213 -0.929 . . . . 0.0 110.308 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.448 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 20.9 mttt -143.51 142.05 20.27 Favored Pre-proline 0 N--CA 1.49 1.525 0 O-C-N 121.182 -0.949 . . . . 0.0 110.014 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -69.81 -3.15 11.47 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 O-C-N 124.089 1.573 . . . . 0.0 110.263 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.523 ' O ' ' CD1' ' A' ' 23' ' ' TYR . 7.0 p90 -143.4 152.37 41.5 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.239 -0.913 . . . . 0.0 110.055 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.9 tt -123.0 147.39 27.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.243 -0.911 . . . . 0.0 110.344 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.476 ' HB2' ' HB2' ' A' ' 28' ' ' GLU . 1.2 mp -80.48 141.43 35.22 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.241 -0.912 . . . . 0.0 109.92 179.867 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.484 ' O ' ' HG ' ' A' ' 29' ' ' LEU . . . -60.27 -40.6 90.94 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.203 -0.936 . . . . 0.0 110.471 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -65.01 -35.17 80.34 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.165 -0.959 . . . . 0.0 110.124 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.476 ' HB2' ' HB2' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -68.8 -49.98 54.04 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.366 -0.834 . . . . 0.0 109.869 179.992 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.509 ' CD1' HD13 ' A' ' 42' ' ' ILE . 0.9 OUTLIER -66.82 -34.07 77.01 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.373 -0.829 . . . . 0.0 110.042 179.834 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.539 ' HA ' ' CB ' ' A' ' 38' ' ' ALA . 17.2 ttp180 -69.18 -34.48 75.0 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.319 -0.863 . . . . 0.0 111.12 -179.642 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.531 ' HB3' ' NH1' ' A' ' 31' ' ' ARG . 5.0 ttp-105 -86.48 -22.46 26.43 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.007 -1.058 . . . . 0.0 111.32 -178.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.508 ' HG2' ' HA ' ' A' ' 29' ' ' LEU . 12.8 pt-20 -90.7 -24.03 20.55 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.831 -1.168 . . . . 0.0 110.776 -179.542 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.461 ' HB2' ' O ' ' A' ' 29' ' ' LEU . 7.6 mt -103.17 155.91 36.06 Favored Pre-proline 0 N--CA 1.488 1.457 0 O-C-N 121.122 -0.986 . . . . 0.0 110.409 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.46 ' HB2' ' OD1' ' A' ' 36' ' ' ASP . 6.2 Cg_exo -59.18 142.54 99.36 Favored 'Trans proline' 0 C--N 1.302 -1.892 0 O-C-N 124.069 1.563 . . . . 0.0 109.775 179.593 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.429 ' C ' ' O ' ' A' ' 34' ' ' PRO . 33.7 Cg_exo -37.72 -44.08 1.56 Allowed 'Trans proline' 0 C--N 1.305 -1.749 0 O-C-N 124.055 1.555 . . . . 0.0 110.917 -179.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.46 ' OD1' ' HB2' ' A' ' 34' ' ' PRO . 2.9 p-10 -65.9 -45.82 80.58 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.091 -1.006 . . . . 0.0 111.04 -179.606 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.447 ' HB3' HD21 ' A' ' 33' ' ' LEU . 0.6 OUTLIER -69.82 -37.85 76.36 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.951 -1.093 . . . . 0.0 110.705 -179.53 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.539 ' CB ' ' HA ' ' A' ' 30' ' ' ARG . . . -60.96 -43.86 98.13 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.369 -0.832 . . . . 0.0 110.952 -179.478 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.3 tm0? -60.09 -44.92 94.46 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.255 -0.903 . . . . 0.0 110.849 -179.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -62.21 -41.72 98.63 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.237 -0.914 . . . . 0.0 110.922 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.403 ' HB2' HD12 ' A' ' 29' ' ' LEU . 27.5 m -62.69 -50.88 69.41 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.128 -0.982 . . . . 0.0 110.755 -179.489 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.509 HD13 ' CD1' ' A' ' 29' ' ' LEU . 1.1 mt -63.84 -18.01 21.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.203 -0.935 . . . . 0.0 110.188 -179.736 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.429 ' C ' ' HD2' ' A' ' 44' ' ' ARG . 9.2 tttt -83.22 -16.01 48.19 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.25 -0.906 . . . . 0.0 110.772 -179.69 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.57 ' HB3' ' CG ' ' A' ' 63' ' ' PHE . 2.0 mpt_? -114.32 -62.26 1.62 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.106 -0.996 . . . . 0.0 110.675 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.561 ' HE3' ' CB ' ' A' ' 60' ' ' TYR . 2.3 ttm -32.88 111.1 0.35 Allowed Pre-proline 0 N--CA 1.497 1.92 0 O-C-N 121.618 -0.676 . . . . 0.0 111.272 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo . . . . . 0 C--N 1.306 -1.687 0 O-C-N 124.024 1.539 . . . . 0.0 110.194 179.934 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 121.253 0.549 . . . . 0.0 110.107 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.437 ' HB3' ' HB3' ' A' ' 45' ' ' MET . 54.3 mt -93.76 159.04 15.38 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.323 -0.861 . . . . 0.0 110.176 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.45 ' C ' ' HG3' ' A' ' 45' ' ' MET . 1.2 m-20 -115.28 110.42 19.39 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.105 -0.997 . . . . 0.0 110.41 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.579 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 15.9 p90 -72.77 -25.77 61.29 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.379 -0.826 . . . . 0.0 110.271 179.767 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.579 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.7 -36.73 67.5 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.279 -0.888 . . . . 0.0 109.958 -179.7 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.56 -43.36 80.84 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.322 -0.861 . . . . 0.0 109.557 179.416 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.57 ' CG ' ' HB3' ' A' ' 44' ' ' ARG . 1.5 t80 -72.12 -35.29 69.11 Favored 'General case' 0 C--N 1.297 -1.689 0 O-C-N 121.75 -0.593 . . . . 0.0 110.311 179.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.566 ' O ' ' CE2' ' A' ' 68' ' ' TYR . 44.3 m -59.67 -49.87 76.07 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.298 -0.876 . . . . 0.0 110.569 -179.606 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.97 -41.24 82.49 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.184 -0.947 . . . . 0.0 110.344 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.64 -39.6 73.96 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.231 -0.918 . . . . 0.0 110.386 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.447 ' CD2' ' HB2' ' B' ' 23' ' ' ALA . 15.3 mt -57.75 -41.12 81.3 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.144 -0.972 . . . . 0.0 110.241 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.579 ' CZ ' ' HA ' ' A' ' 7' ' ' ALA . 2.7 m-85 . . . . . 0 N--CA 1.49 1.568 0 O-C-N 121.271 -0.893 . . . . 0.0 110.077 -179.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.451 ' HB2' ' OE1' ' B' ' 11' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.204 0.526 . . . . 0.0 110.133 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.65 -45.63 82.24 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.24 -0.913 . . . . 0.0 110.025 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.99 -40.84 77.34 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.314 -0.866 . . . . 0.0 109.997 179.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . 0.451 ' OE1' ' HB2' ' B' ' 8' ' ' LYS . 5.2 mt-10 -62.05 -40.92 97.39 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.333 -0.854 . . . . 0.0 110.024 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . 0.406 ' O ' HG21 ' B' ' 16' ' ' VAL . . . -65.43 -43.08 91.61 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.415 -0.803 . . . . 0.0 110.0 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.438 ' O ' HG22 ' B' ' 17' ' ' VAL . 90.1 t -58.64 -44.25 89.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.215 -0.928 . . . . 0.0 110.013 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.29 -39.56 90.89 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.307 -0.87 . . . . 0.0 110.179 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 19.7 m -64.66 -44.43 90.42 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.226 -0.921 . . . . 0.0 110.136 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.406 HG21 ' O ' ' B' ' 12' ' ' ALA . 59.8 t -65.18 -42.28 93.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.246 -0.909 . . . . 0.0 110.08 179.898 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.438 HG22 ' O ' ' B' ' 13' ' ' VAL . 74.4 t -60.66 -44.79 97.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.271 -0.893 . . . . 0.0 110.256 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.71 -46.32 90.16 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.197 -0.94 . . . . 0.0 110.199 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.51 -42.02 92.53 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.27 -0.894 . . . . 0.0 110.232 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 57.6 t -66.04 -46.04 89.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.304 -0.873 . . . . 0.0 110.244 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -63.08 -32.58 73.98 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.235 -0.915 . . . . 0.0 110.221 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 4.5 tp60 -56.9 -41.45 78.12 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.268 -0.895 . . . . 0.0 110.11 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . 0.447 ' HB2' ' CD2' ' A' ' 67' ' ' LEU . . . -60.63 -39.06 86.85 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.207 -0.933 . . . . 0.0 109.981 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 O-C-N 121.367 -0.833 . . . . 0.0 110.264 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.564 HG21 ' CZ ' ' A' ' 68' ' ' TYR . 1.9 m . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 121.195 0.521 . . . . 0.0 110.258 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -67.8 -37.97 82.69 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.289 -0.882 . . . . 0.0 109.43 179.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.6 tp10 -59.85 -36.02 75.98 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.418 -0.801 . . . . 0.0 109.681 179.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.15 -45.66 93.74 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.327 -0.858 . . . . 0.0 110.046 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.509 HG13 ' CD2' ' A' ' 14' ' ' PHE . 21.7 t -61.88 -43.64 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.097 -1.002 . . . . 0.0 109.649 179.621 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 34.8 mt -57.3 -49.47 79.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.385 -0.822 . . . . 0.0 109.413 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.05 -41.85 93.19 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.293 -0.879 . . . . 0.0 109.063 179.09 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.433 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 5.1 m -65.46 -41.24 93.6 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.48 -0.762 . . . . 0.0 109.153 179.022 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.557 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 2.2 m-85 -68.43 -41.26 80.58 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.385 -0.822 . . . . 0.0 109.395 179.257 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.422 ' HD3' ' HA ' ' A' ' 20' ' ' ASP . 1.5 tmm_? -53.58 -43.63 68.7 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.353 -0.842 . . . . 0.0 109.612 179.509 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 54.8 mt -60.14 -44.94 96.28 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.283 -0.886 . . . . 0.0 109.691 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 13' ' ' SER . 38.5 mt -65.36 -40.15 93.21 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.295 -0.878 . . . . 0.0 109.803 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.468 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -72.35 -4.88 32.58 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.298 -0.876 . . . . 0.0 110.103 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.468 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.3 OUTLIER 68.48 54.17 0.54 Allowed 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.24 -0.912 . . . . 0.0 110.2 -179.922 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.422 ' HA ' ' HD3' ' A' ' 15' ' ' ARG . 2.2 t70 63.02 36.74 12.2 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.204 -0.935 . . . . 0.0 110.313 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.465 ' HG3' ' O ' ' A' ' 18' ' ' ALA . 7.5 mmtt -118.47 144.75 35.86 Favored Pre-proline 0 N--CA 1.49 1.543 0 O-C-N 121.237 -0.914 . . . . 0.0 110.037 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -68.77 -5.33 15.2 Favored 'Trans proline' 0 C--N 1.304 -1.79 0 O-C-N 124.123 1.591 . . . . 0.0 109.999 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.544 ' N ' ' CD1' ' A' ' 23' ' ' TYR . 18.0 p90 -141.01 165.11 28.45 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.419 -0.8 . . . . 0.0 110.106 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.543 ' CD1' ' CD2' ' A' ' 29' ' ' LEU . 0.4 OUTLIER -125.76 149.88 30.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.217 -0.927 . . . . 0.0 109.96 -179.886 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.581 ' CD2' ' N ' ' A' ' 25' ' ' LEU . 2.9 mm? -90.99 154.64 19.3 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.26 -0.9 . . . . 0.0 110.238 -179.872 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.0 -37.64 78.83 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.3 -0.875 . . . . 0.0 110.112 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -65.89 -35.2 79.98 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.277 -0.889 . . . . 0.0 110.071 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.455 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 1.1 mt-10 -62.59 -43.99 97.43 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.322 -0.862 . . . . 0.0 109.93 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.543 ' CD2' ' CD1' ' A' ' 24' ' ' ILE . 3.8 mm? -62.55 -34.31 76.69 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.173 -0.955 . . . . 0.0 109.883 179.738 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.77 -39.05 80.43 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.312 -0.868 . . . . 0.0 110.175 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.74 -15.9 27.68 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.267 -0.895 . . . . 0.0 110.298 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.455 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 3.1 mm-40 -100.41 -23.58 14.71 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.109 -0.994 . . . . 0.0 110.383 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.528 HD21 ' CB ' ' A' ' 37' ' ' GLN . 0.3 OUTLIER -134.8 151.4 75.63 Favored Pre-proline 0 N--CA 1.487 1.395 0 O-C-N 121.103 -0.998 . . . . 0.0 110.306 -179.694 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.471 ' HD2' HD21 ' A' ' 33' ' ' LEU . 8.8 Cg_endo -50.5 140.41 35.73 Favored 'Trans proline' 0 C--N 1.304 -1.763 0 O-C-N 124.009 1.531 . . . . 0.0 110.218 179.727 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -43.72 -35.03 6.19 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 124.029 1.542 . . . . 0.0 110.328 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -62.68 -45.63 91.89 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.179 -0.951 . . . . 0.0 110.239 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.528 ' CB ' HD21 ' A' ' 33' ' ' LEU . 1.9 mp0 -69.33 -42.23 75.6 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.179 -0.951 . . . . 0.0 110.297 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.45 -48.42 79.21 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.243 -0.911 . . . . 0.0 110.225 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -57.48 -43.06 83.79 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.31 -0.869 . . . . 0.0 109.867 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -66.13 -44.22 84.85 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.284 -0.885 . . . . 0.0 110.127 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.466 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 5.5 m -59.52 -50.7 72.9 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.3 -0.875 . . . . 0.0 110.494 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 81.2 mt -60.0 -25.21 32.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.269 -0.895 . . . . 0.0 110.339 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.85 -40.37 72.41 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.27 -0.894 . . . . 0.0 109.721 179.495 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.592 ' CB ' ' CD2' ' A' ' 63' ' ' PHE . 11.1 mpt_? -84.46 -69.07 0.67 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.373 -0.829 . . . . 0.0 109.815 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.535 ' CE ' ' HB3' ' A' ' 60' ' ' TYR . 21.5 mtt -32.04 116.78 0.39 Allowed Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.775 -0.578 . . . . 0.0 111.197 179.42 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.533 ' HD2' ' CB ' ' A' ' 62' ' ' ALA . 38.8 Cg_exo . . . . . 0 C--N 1.305 -1.753 0 O-C-N 124.013 1.533 . . . . 0.0 110.048 179.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 121.274 0.559 . . . . 0.0 110.016 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.592 ' CD2' ' N ' ' A' ' 58' ' ' LEU . 0.9 OUTLIER -105.6 160.73 14.96 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.28 -0.887 . . . . 0.0 110.217 -179.615 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.514 ' OD1' ' N ' ' A' ' 59' ' ' ASP . 1.5 p-10 -107.46 110.53 22.5 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.097 -1.002 . . . . 0.0 111.081 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.576 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 16.0 p90 -72.77 -23.21 60.79 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.328 -0.858 . . . . 0.0 109.231 178.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.576 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.19 -41.92 72.59 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.273 -0.892 . . . . 0.0 108.719 179.436 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.533 ' CB ' ' HD2' ' A' ' 46' ' ' PRO . . . -58.89 -32.19 69.28 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 119.494 -0.882 . . . . 0.0 108.79 178.493 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.592 ' CD2' ' CB ' ' A' ' 44' ' ' ARG . 26.2 t80 -59.7 -49.33 78.16 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 121.257 0.551 . . . . 0.0 110.708 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.468 ' OG ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -70.5 -37.25 74.16 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.123 -0.985 . . . . 0.0 110.78 -179.432 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 51.3 p -64.52 -41.78 96.18 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.149 -0.969 . . . . 0.0 110.467 -179.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -75.57 -40.69 56.31 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.148 -0.97 . . . . 0.0 110.507 -179.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.574 HD12 ' CD1' ' A' ' 63' ' ' PHE . 0.2 OUTLIER -64.02 -43.98 93.95 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.204 -0.935 . . . . 0.0 110.424 -179.713 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.564 ' CZ ' HG21 ' A' ' 6' ' ' THR . 24.5 m-85 . . . . . 0 N--CA 1.489 1.501 0 O-C-N 121.23 -0.919 . . . . 0.0 110.287 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.649 0 CA-C-O 121.248 0.547 . . . . 0.0 110.282 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 10.4 ttpt -62.3 -39.45 93.05 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.251 -0.906 . . . . 0.0 110.239 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.66 -40.04 86.42 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.211 -0.931 . . . . 0.0 110.15 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.31 -39.81 91.87 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.316 -0.865 . . . . 0.0 110.273 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.98 -41.87 98.51 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.18 -0.95 . . . . 0.0 109.984 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.462 ' O ' HG22 ' B' ' 17' ' ' VAL . 59.0 t -63.65 -43.11 98.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.264 -0.898 . . . . 0.0 109.721 179.518 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.51 -42.21 95.91 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.317 -0.864 . . . . 0.0 110.005 179.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 22.8 m -64.57 -43.21 94.63 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.314 -0.866 . . . . 0.0 110.018 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 30.9 t -63.61 -46.51 94.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.255 -0.903 . . . . 0.0 110.024 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.512 ' CG2' HD22 ' A' ' 33' ' ' LEU . 83.2 t -58.16 -42.32 82.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.245 -0.91 . . . . 0.0 109.944 179.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.67 -45.57 93.66 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.231 -0.918 . . . . 0.0 109.917 179.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.97 -42.06 90.35 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.301 -0.874 . . . . 0.0 109.957 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . 0.503 HG23 ' CZ ' ' A' ' 63' ' ' PHE . 52.2 t -67.77 -43.2 86.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.278 -0.889 . . . . 0.0 110.045 179.837 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . 0.459 ' O ' ' HG2' ' B' ' 24' ' ' ARG . 2.0 t70 -64.2 -34.04 77.17 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.283 -0.885 . . . . 0.0 110.123 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.9 -36.58 82.6 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.232 -0.917 . . . . 0.0 110.243 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.38 -42.77 92.32 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.238 -0.913 . . . . 0.0 110.618 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . 0.459 ' HG2' ' O ' ' B' ' 21' ' ' ASP . 2.1 ptm180 . . . . . 0 N--CA 1.493 1.679 0 O-C-N 121.041 -1.037 . . . . 0.0 110.274 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 121.265 0.555 . . . . 0.0 110.092 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -70.04 -46.25 65.42 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.162 -0.961 . . . . 0.0 109.909 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -54.64 -36.68 64.79 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.383 -0.823 . . . . 0.0 110.051 179.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -61.63 -43.09 99.51 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.255 -0.903 . . . . 0.0 110.236 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 98.2 t -61.79 -42.13 93.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.194 -0.941 . . . . 0.0 109.996 179.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 82.7 mt -57.41 -49.88 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.31 -0.869 . . . . 0.0 109.683 179.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.54 -37.61 76.04 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 119.504 -0.878 . . . . 0.0 108.796 178.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.466 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 41.7 m -67.66 -39.7 84.54 Favored 'General case' 0 N--CA 1.485 1.324 0 O-C-N 121.456 -0.778 . . . . 0.0 109.206 178.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.507 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 0.7 OUTLIER -68.41 -42.62 78.73 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.346 -0.847 . . . . 0.0 109.534 179.185 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -53.95 -41.57 67.92 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.245 -0.91 . . . . 0.0 108.939 179.077 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.431 HG22 HD11 ' A' ' 16' ' ' ILE . 40.8 mt -62.0 -41.11 89.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.459 -0.775 . . . . 0.0 109.611 179.21 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 13' ' ' SER . 26.7 mt -64.89 -41.94 95.19 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.256 -0.902 . . . . 0.0 109.456 179.455 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.477 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -77.14 -7.31 55.58 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.438 -0.789 . . . . 0.0 110.092 179.761 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.477 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 68.07 67.44 0.34 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.231 -0.918 . . . . 0.0 110.235 -179.908 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 59.85 61.84 1.82 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.246 -0.908 . . . . 0.0 110.3 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.436 ' HB2' ' CB ' ' A' ' 18' ' ' ALA . 6.3 mttt -147.92 142.78 16.93 Favored Pre-proline 0 N--CA 1.489 1.487 0 O-C-N 121.234 -0.916 . . . . 0.0 110.01 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -74.29 0.92 7.9 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 O-C-N 123.955 1.503 . . . . 0.0 110.081 179.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.463 ' O ' ' HB2' ' A' ' 18' ' ' ALA . 45.5 p90 -145.83 164.82 30.73 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.259 -0.901 . . . . 0.0 110.159 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.523 ' CG2' ' SD ' ' A' ' 45' ' ' MET . 0.2 OUTLIER -131.62 141.91 44.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.162 -0.961 . . . . 0.0 110.2 -179.873 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.469 ' O ' HD11 ' A' ' 24' ' ' ILE . 4.2 mt -81.52 157.7 24.73 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.13 -0.981 . . . . 0.0 110.205 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.73 -41.06 75.8 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.302 -0.874 . . . . 0.0 110.32 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -60.7 -35.41 76.23 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.176 -0.953 . . . . 0.0 110.17 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.455 ' OE1' ' OE2' ' A' ' 32' ' ' GLU . 9.0 mt-10 -64.25 -44.11 92.82 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.348 -0.845 . . . . 0.0 109.925 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 18.0 mt -60.66 -33.72 73.24 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.203 -0.936 . . . . 0.0 109.609 179.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.9 mtt85 -67.89 -35.08 77.88 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.388 -0.82 . . . . 0.0 110.309 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.4 ttt180 -95.62 -20.62 18.81 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.164 -0.96 . . . . 0.0 110.82 -179.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.46 ' OE1' ' HB3' ' A' ' 17' ' ' LEU . 86.5 mt-10 -96.14 -23.78 16.59 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.05 -1.031 . . . . 0.0 110.466 -179.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.525 HD21 ' CB ' ' A' ' 37' ' ' GLN . 6.0 mt -129.44 153.59 80.62 Favored Pre-proline 0 C--N 1.305 -1.348 0 O-C-N 121.233 -0.917 . . . . 0.0 110.078 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.461 ' HD2' HD21 ' A' ' 33' ' ' LEU . 33.1 Cg_exo -56.19 154.46 28.45 Favored 'Trans proline' 0 C--N 1.306 -1.69 0 O-C-N 123.94 1.495 . . . . 0.0 110.264 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -47.68 -38.74 29.66 Favored 'Trans proline' 0 C--N 1.307 -1.652 0 O-C-N 124.048 1.551 . . . . 0.0 110.305 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.73 -46.33 85.87 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.248 -0.908 . . . . 0.0 110.291 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.525 ' CB ' HD21 ' A' ' 33' ' ' LEU . 9.6 mp0 -69.27 -44.42 71.92 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.282 -0.886 . . . . 0.0 110.383 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.44 ' O ' ' CD1' ' A' ' 42' ' ' ILE . . . -56.26 -48.07 77.29 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.175 -0.953 . . . . 0.0 110.367 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.8 tm0? -64.74 -43.02 94.7 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.226 -0.921 . . . . 0.0 110.191 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -64.93 -46.79 80.17 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.281 -0.887 . . . . 0.0 110.305 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.443 ' SG ' ' O ' ' A' ' 37' ' ' GLN . 62.2 m -65.46 -49.71 68.09 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.157 -0.965 . . . . 0.0 110.452 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.44 ' CD1' ' O ' ' A' ' 38' ' ' ALA . 6.3 mt -58.22 -24.03 23.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.221 -0.924 . . . . 0.0 110.38 -179.769 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.41 -30.3 33.62 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.156 -0.965 . . . . 0.0 110.367 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.583 ' HG3' ' CE1' ' A' ' 63' ' ' PHE . 2.2 mmt180 -86.27 -58.93 2.44 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.218 -0.927 . . . . 0.0 110.195 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.523 ' SD ' ' CG2' ' A' ' 24' ' ' ILE . 1.4 ttm -38.29 119.27 1.02 Allowed Pre-proline 0 N--CA 1.492 1.641 0 O-C-N 121.511 -0.743 . . . . 0.0 110.722 179.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo . . . . . 0 C--N 1.305 -1.736 0 O-C-N 123.937 1.493 . . . . 0.0 110.22 179.792 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 121.268 0.556 . . . . 0.0 110.207 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.495 ' CB ' ' HG2' ' A' ' 45' ' ' MET . 13.2 mt -92.71 155.76 17.49 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.186 -0.946 . . . . 0.0 110.17 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.442 ' C ' ' HG3' ' A' ' 45' ' ' MET . 4.4 m-20 -103.32 111.7 24.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.2 -0.938 . . . . 0.0 110.13 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.507 ' HB2' ' CD2' ' A' ' 14' ' ' PHE . 23.7 p90 -72.63 -22.35 60.96 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.389 -0.82 . . . . 0.0 110.157 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.488 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.01 -34.18 65.58 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.182 -0.949 . . . . 0.0 110.021 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.23 -36.49 79.58 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.234 -0.916 . . . . 0.0 109.827 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.587 ' CE1' ' HB3' ' A' ' 67' ' ' LEU . 3.5 t80 -72.1 -35.42 69.2 Favored 'General case' 0 C--N 1.297 -1.683 0 O-C-N 121.676 -0.64 . . . . 0.0 110.455 179.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.5 m -56.51 -49.76 73.78 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.258 -0.901 . . . . 0.0 110.567 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.5 m -66.15 -35.6 80.92 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.247 -0.908 . . . . 0.0 110.471 -179.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.13 -39.36 63.36 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.299 -0.875 . . . . 0.0 110.841 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.587 ' HB3' ' CE1' ' A' ' 63' ' ' PHE . 0.3 OUTLIER -72.55 -41.22 66.02 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.099 -1.001 . . . . 0.0 110.413 -179.499 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.54 ' N ' ' HG ' ' A' ' 67' ' ' LEU . 1.8 m-85 . . . . . 0 N--CA 1.491 1.625 0 O-C-N 121.38 -0.825 . . . . 0.0 110.206 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 5.6 ptpp? . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.217 0.532 . . . . 0.0 110.093 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 6.2 ttmt -62.63 -45.67 91.77 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.277 -0.89 . . . . 0.0 109.983 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.52 -37.87 79.47 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.219 -0.926 . . . . 0.0 109.906 179.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -63.34 -43.08 98.77 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.238 -0.914 . . . . 0.0 110.014 179.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . 0.425 ' O ' HG22 ' B' ' 16' ' ' VAL . . . -63.65 -37.56 87.81 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.299 -0.875 . . . . 0.0 110.088 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 87.9 t -60.63 -43.27 94.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.269 -0.894 . . . . 0.0 110.018 179.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.07 -39.07 84.77 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.298 -0.876 . . . . 0.0 110.158 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 53.0 m -65.52 -49.01 70.53 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.182 -0.949 . . . . 0.0 110.118 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.425 HG22 ' O ' ' B' ' 12' ' ' ALA . 36.9 t -63.53 -40.73 90.15 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.319 -0.863 . . . . 0.0 110.21 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.408 HG21 HD23 ' A' ' 33' ' ' LEU . 71.6 t -61.94 -47.26 94.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.224 -0.922 . . . . 0.0 110.271 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.44 -41.1 96.75 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.161 -0.962 . . . . 0.0 110.425 -179.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.78 -45.6 81.82 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.18 -0.95 . . . . 0.0 110.371 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 58.4 t -67.83 -45.91 83.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.178 -0.951 . . . . 0.0 110.39 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -56.88 -31.78 65.19 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.253 -0.904 . . . . 0.0 110.271 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -56.79 -49.88 74.0 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.268 -0.895 . . . . 0.0 110.572 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.94 -34.87 73.84 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.226 -0.921 . . . . 0.0 110.545 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 2.5 tpt180 . . . . . 0 N--CA 1.493 1.689 0 O-C-N 121.164 -0.96 . . . . 0.0 110.489 -179.654 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.517 ' CG2' ' OH ' ' A' ' 68' ' ' TYR . 2.0 m . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 121.261 0.553 . . . . 0.0 110.107 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.88 -44.99 83.71 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.237 -0.914 . . . . 0.0 109.628 179.626 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.14 -36.01 67.78 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.467 -0.771 . . . . 0.0 109.959 179.532 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -61.11 -44.17 97.76 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.296 -0.878 . . . . 0.0 110.273 -179.642 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.462 ' HB ' ' HB3' ' A' ' 64' ' ' SER . 22.8 t -58.62 -46.36 90.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.151 -0.968 . . . . 0.0 109.964 179.842 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 21.5 mt -65.18 -49.73 77.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.303 -0.873 . . . . 0.0 109.699 179.789 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.14 -40.84 91.2 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.268 -0.895 . . . . 0.0 109.177 179.274 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.46 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 68.1 m -67.02 -41.15 87.11 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.394 -0.816 . . . . 0.0 109.277 179.134 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.532 ' HB3' ' CD2' ' A' ' 60' ' ' TYR . 1.7 m-85 -68.2 -43.01 79.03 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.386 -0.821 . . . . 0.0 109.57 179.426 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.1 ttp180 -53.24 -41.19 65.2 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.217 -0.927 . . . . 0.0 109.124 179.222 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.5 mt -59.8 -44.86 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.446 -0.784 . . . . 0.0 109.504 179.151 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 13' ' ' SER . 18.4 mt -65.05 -41.68 94.94 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.287 -0.883 . . . . 0.0 109.701 179.508 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.489 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -73.29 -1.41 17.82 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.307 -0.871 . . . . 0.0 110.074 179.778 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.489 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 1.4 t 68.28 64.92 0.34 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.198 -0.939 . . . . 0.0 110.267 -179.998 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 50.26 58.2 5.75 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.397 -0.814 . . . . 0.0 110.293 179.953 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.564 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 29.8 mttt -140.7 143.01 30.64 Favored Pre-proline 0 N--CA 1.49 1.56 0 O-C-N 121.303 -0.873 . . . . 0.0 110.085 179.852 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_endo -65.62 -7.6 16.81 Favored 'Trans proline' 0 C--N 1.305 -1.722 0 O-C-N 123.931 1.49 . . . . 0.0 110.122 179.83 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.564 ' CZ ' ' HD3' ' A' ' 21' ' ' LYS . 23.3 p90 -138.99 166.4 24.59 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.214 -0.929 . . . . 0.0 110.495 -179.927 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.533 HD12 ' N ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -136.32 144.48 32.85 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.374 -0.829 . . . . 0.0 109.87 -179.967 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.533 ' N ' HD12 ' A' ' 24' ' ' ILE . 4.0 mt -79.87 150.4 30.64 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.188 -0.945 . . . . 0.0 110.075 -179.825 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.17 -45.61 76.46 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.297 -0.877 . . . . 0.0 110.327 -179.875 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.456 ' CG ' ' N ' ' A' ' 28' ' ' GLU . 22.9 pt-20 -59.27 -37.54 77.88 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.138 -0.976 . . . . 0.0 109.747 179.883 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.456 ' N ' ' CG ' ' A' ' 27' ' ' GLU . 6.2 tt0 -66.75 -34.66 78.32 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.237 -0.914 . . . . 0.0 108.876 179.076 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.466 HD13 ' HB2' ' A' ' 33' ' ' LEU . 2.6 tp -66.67 -39.92 88.37 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 108.706 -0.849 . . . . 0.0 108.706 178.803 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.23 -34.43 78.09 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.561 -0.712 . . . . 0.0 109.544 179.065 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.7 tpt180 -84.46 -39.3 19.1 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.484 -0.76 . . . . 0.0 110.876 -179.792 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.452 ' OE1' HD21 ' A' ' 17' ' ' LEU . 2.2 mt-10 -76.15 -23.5 54.79 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.217 -0.927 . . . . 0.0 110.973 -179.084 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.534 HD21 ' CB ' ' A' ' 37' ' ' GLN . 4.2 mt -127.87 156.59 75.69 Favored Pre-proline 0 N--CA 1.488 1.458 0 O-C-N 121.07 -1.019 . . . . 0.0 110.228 -179.837 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.473 ' HD2' ' CG ' ' A' ' 37' ' ' GLN . 22.9 Cg_exo -60.01 142.49 98.55 Favored 'Trans proline' 0 C--N 1.304 -1.774 0 O-C-N 124.011 1.532 . . . . 0.0 110.184 179.979 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -41.68 -38.87 4.59 Favored 'Trans proline' 0 C--N 1.304 -1.773 0 O-C-N 124.065 1.561 . . . . 0.0 110.225 179.996 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -63.12 -43.28 98.87 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.337 -0.852 . . . . 0.0 110.242 179.956 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.534 ' CB ' HD21 ' A' ' 33' ' ' LEU . 25.0 mm100 -69.21 -41.99 76.34 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.188 -0.945 . . . . 0.0 109.981 179.966 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.463 ' O ' HG12 ' A' ' 42' ' ' ILE . . . -63.67 -48.22 78.08 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.294 -0.879 . . . . 0.0 110.089 179.969 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -54.95 -48.6 72.96 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.251 -0.906 . . . . 0.0 109.926 179.932 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -64.01 -47.86 78.61 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.311 -0.868 . . . . 0.0 109.854 179.771 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.48 ' O ' ' HG2' ' A' ' 45' ' ' MET . 75.9 m -65.43 -49.57 68.69 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.341 -0.849 . . . . 0.0 110.381 179.929 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.463 HG12 ' O ' ' A' ' 38' ' ' ALA . 9.0 mm -41.54 -33.43 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.317 -0.865 . . . . 0.0 110.241 -179.893 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.44 -37.67 19.52 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.29 -0.881 . . . . 0.0 110.263 179.948 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.525 ' HG3' ' CE1' ' A' ' 63' ' ' PHE . 0.9 OUTLIER -65.79 -75.66 0.09 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.284 -0.885 . . . . 0.0 110.243 -179.878 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.537 ' CE ' ' HB3' ' A' ' 60' ' ' TYR . 6.3 ptp -53.02 108.58 1.14 Allowed Pre-proline 0 N--CA 1.488 1.462 0 O-C-N 121.22 -0.925 . . . . 0.0 110.175 179.952 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.459 ' HD3' ' O ' ' A' ' 44' ' ' ARG . 17.3 Cg_exo . . . . . 0 C--N 1.305 -1.756 0 O-C-N 123.995 1.524 . . . . 0.0 110.326 -179.865 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.269 0.557 . . . . 0.0 110.334 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 91.7 mt -127.71 160.29 32.12 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.294 -0.879 . . . . 0.0 110.024 179.94 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -111.75 111.93 23.26 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.149 -0.969 . . . . 0.0 110.517 -179.775 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.537 ' HB3' ' CE ' ' A' ' 45' ' ' MET . 14.5 p90 -81.66 -19.82 40.87 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.318 -0.864 . . . . 0.0 109.647 179.415 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.422 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.03 -36.65 68.24 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.249 -0.907 . . . . 0.0 109.793 179.883 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.458 ' HB1' ' HD2' ' A' ' 46' ' ' PRO . . . -63.94 -34.95 79.14 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.224 -0.923 . . . . 0.0 109.763 179.593 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.58 ' CE1' ' CD1' ' A' ' 67' ' ' LEU . 4.6 t80 -71.78 -32.74 67.96 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.567 -0.708 . . . . 0.0 110.114 179.628 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.462 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.9 OUTLIER -71.79 -49.29 40.02 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.348 -0.845 . . . . 0.0 110.297 -179.876 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 66.2 m -63.75 -42.34 97.86 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.251 -0.905 . . . . 0.0 110.301 -179.887 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.52 -28.75 65.18 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.188 -0.945 . . . . 0.0 110.27 -179.87 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.58 ' CD1' ' CE1' ' A' ' 63' ' ' PHE . 8.4 mt -61.44 -42.41 98.71 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.205 -0.935 . . . . 0.0 110.365 -179.935 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.517 ' OH ' ' CG2' ' A' ' 6' ' ' THR . 20.1 m-85 . . . . . 0 N--CA 1.492 1.644 0 O-C-N 121.208 -0.932 . . . . 0.0 110.223 179.987 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 3.1 tmtm? . . . . . 0 N--CA 1.492 1.641 0 CA-C-O 121.268 0.556 . . . . 0.0 110.132 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.79 -44.69 96.37 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.18 -0.95 . . . . 0.0 110.147 179.974 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.01 -38.8 68.35 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.219 -0.926 . . . . 0.0 109.949 179.871 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -65.48 -39.93 92.51 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.286 -0.884 . . . . 0.0 110.017 179.806 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.28 -37.5 85.75 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.208 -0.933 . . . . 0.0 109.991 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.441 ' O ' HG22 ' B' ' 17' ' ' VAL . 51.9 t -65.0 -40.44 89.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.208 -0.933 . . . . 0.0 109.8 179.658 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.63 -35.59 76.57 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.326 -0.858 . . . . 0.0 110.058 179.843 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 41.2 m -68.1 -43.6 78.12 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.291 -0.88 . . . . 0.0 110.238 -179.981 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.415 ' CG1' HD12 ' A' ' 33' ' ' LEU . 92.1 t -66.6 -42.48 89.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.273 -0.892 . . . . 0.0 110.134 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.527 HG21 ' CD2' ' A' ' 33' ' ' LEU . 70.1 t -63.38 -47.54 91.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.406 -0.809 . . . . 0.0 110.313 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.31 -40.76 95.36 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.307 -0.871 . . . . 0.0 110.198 -179.976 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.67 -37.97 88.0 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.286 -0.884 . . . . 0.0 110.236 179.977 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 54.5 t -67.92 -43.86 85.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.199 -0.938 . . . . 0.0 110.273 -179.902 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 38.4 t0 -62.1 -35.57 79.1 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.308 -0.87 . . . . 0.0 110.366 -179.965 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -60.05 -50.08 75.12 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.222 -0.924 . . . . 0.0 110.297 -179.978 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.76 -35.07 79.39 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.278 -0.889 . . . . 0.0 110.107 179.994 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.689 0 O-C-N 121.247 -0.908 . . . . 0.0 110.182 179.833 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 121.237 0.541 . . . . 0.0 110.191 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.68 -47.78 77.17 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.186 -0.946 . . . . 0.0 109.867 179.909 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.65 -36.15 64.26 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.425 -0.797 . . . . 0.0 109.981 179.586 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.45 -44.68 96.68 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.364 -0.835 . . . . 0.0 110.37 -179.711 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.463 HG23 ' CD2' ' A' ' 67' ' ' LEU . 88.6 t -57.99 -41.38 80.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.261 -0.9 . . . . 0.0 110.012 179.996 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.468 HG22 HD12 ' A' ' 11' ' ' ILE . 59.5 mt -63.65 -49.83 80.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.359 -0.838 . . . . 0.0 109.651 179.653 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.25 -42.45 91.15 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.284 -0.885 . . . . 0.0 109.033 179.22 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.09 -39.43 94.05 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.379 -0.826 . . . . 0.0 109.302 179.033 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.623 ' CB ' ' CD1' ' A' ' 60' ' ' TYR . 3.1 m-85 -68.15 -42.17 80.51 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.308 -0.87 . . . . 0.0 109.51 179.282 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -55.85 -41.18 73.94 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.166 -0.959 . . . . 0.0 109.429 179.209 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.519 HD11 ' CB ' ' B' ' 12' ' ' ALA . 96.8 mt -60.27 -44.84 96.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.388 -0.82 . . . . 0.0 109.728 179.408 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 61.1 mt -64.98 -41.89 95.04 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.315 -0.866 . . . . 0.0 109.548 179.561 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.478 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -71.06 -15.27 62.53 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.357 -0.839 . . . . 0.0 110.089 179.625 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.478 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 68.05 72.25 0.31 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.291 -0.881 . . . . 0.0 110.339 -179.985 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.47 ' HB2' ' O ' ' A' ' 19' ' ' SER . 2.7 m-20 56.62 61.9 2.49 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.347 -0.845 . . . . 0.0 110.367 179.857 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 19' ' ' SER . 35.1 mttp -153.5 142.1 14.3 Favored Pre-proline 0 N--CA 1.489 1.49 0 O-C-N 121.274 -0.891 . . . . 0.0 110.093 179.878 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -76.59 3.9 6.02 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 O-C-N 124.092 1.575 . . . . 0.0 110.188 179.912 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.467 ' O ' ' HB2' ' A' ' 18' ' ' ALA . 20.6 p90 -145.9 156.52 43.59 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.185 -0.947 . . . . 0.0 110.026 179.999 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.468 HD11 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -125.67 142.74 41.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.169 -0.957 . . . . 0.0 109.735 179.997 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.468 ' N ' HD11 ' A' ' 24' ' ' ILE . 6.0 mp -80.14 145.81 32.15 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.132 -0.98 . . . . 0.0 109.919 -179.729 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.464 ' HA ' HD22 ' A' ' 29' ' ' LEU . . . -58.68 -44.91 90.36 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.324 -0.86 . . . . 0.0 110.366 -179.628 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.77 -34.18 77.74 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.216 -0.928 . . . . 0.0 110.369 180.0 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.449 ' N ' ' OE1' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -64.08 -51.08 65.74 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.12 -0.988 . . . . 0.0 110.288 -179.698 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.516 ' CD1' ' HA ' ' A' ' 38' ' ' ALA . 1.0 OUTLIER -67.27 -33.54 75.51 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.141 -0.974 . . . . 0.0 109.579 179.402 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.53 ' HA ' ' CB ' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -61.23 -35.0 76.04 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.524 -0.735 . . . . 0.0 110.347 -179.965 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.2 ttt180 -94.03 -17.83 22.48 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.221 -0.925 . . . . 0.0 110.262 -179.949 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -90.09 -21.62 22.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.273 -0.892 . . . . 0.0 110.246 179.972 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.467 HD21 ' HD2' ' A' ' 34' ' ' PRO . 11.2 mt -117.59 154.27 50.69 Favored Pre-proline 0 N--CA 1.487 1.395 0 O-C-N 121.261 -0.899 . . . . 0.0 110.249 -179.698 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.471 ' HD2' ' HB2' ' A' ' 37' ' ' GLN . 39.7 Cg_exo -59.24 153.87 50.17 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 O-C-N 123.875 1.461 . . . . 0.0 110.134 179.788 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -43.89 -44.1 11.95 Favored 'Trans proline' 0 C--N 1.305 -1.72 0 O-C-N 124.088 1.573 . . . . 0.0 110.542 -179.857 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.409 ' O ' ' HB2' ' A' ' 40' ' ' TYR . 0.3 OUTLIER -65.53 -46.91 77.76 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.273 -0.892 . . . . 0.0 110.393 -179.835 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.471 ' HB2' ' HD2' ' A' ' 34' ' ' PRO . 3.8 mp0 -69.69 -41.82 74.94 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.202 -0.936 . . . . 0.0 110.377 -179.935 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.53 ' CB ' ' HA ' ' A' ' 30' ' ' ARG . . . -59.21 -48.38 81.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.183 -0.948 . . . . 0.0 110.374 -179.811 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 -66.23 -43.48 86.49 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.25 -0.906 . . . . 0.0 110.37 -179.894 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.409 ' HB2' ' O ' ' A' ' 36' ' ' ASP . 1.2 t80 -62.31 -47.08 85.88 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.31 -0.869 . . . . 0.0 110.548 -179.76 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.455 ' O ' ' SD ' ' A' ' 45' ' ' MET . 71.9 m -62.43 -51.17 68.59 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.284 -0.885 . . . . 0.0 110.508 -179.668 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.46 ' CD1' ' HG3' ' A' ' 30' ' ' ARG . 53.3 mt -58.84 -19.08 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.244 -0.91 . . . . 0.0 110.332 -179.96 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 4.9 tttm -85.22 -19.98 30.84 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.323 -0.861 . . . . 0.0 110.529 -179.717 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.58 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 12.6 mmt85 -100.35 -72.82 0.66 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.176 -0.953 . . . . 0.0 110.759 -179.56 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.522 ' N ' ' HB2' ' A' ' 63' ' ' PHE . 1.4 ptm -45.25 127.47 5.85 Favored Pre-proline 0 N--CA 1.487 1.412 0 O-C-N 121.14 -0.975 . . . . 0.0 110.265 -179.698 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.46 ' HG2' ' HB3' ' A' ' 59' ' ' ASP . 9.4 Cg_endo . . . . . 0 C--N 1.305 -1.738 0 O-C-N 124.084 1.571 . . . . 0.0 110.3 -179.94 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.591 0 CA-C-O 121.069 0.461 . . . . 0.0 110.213 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.422 HD13 ' N ' ' A' ' 58' ' ' LEU . 2.5 mp -129.03 143.66 50.94 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.223 -0.923 . . . . 0.0 110.089 179.592 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.464 ' OD1' ' HB1' ' A' ' 61' ' ' ALA . 7.7 t0 -94.69 111.29 23.06 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.18 -0.95 . . . . 0.0 110.244 179.755 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.623 ' CD1' ' CB ' ' A' ' 14' ' ' PHE . 21.7 p90 -76.87 -25.29 52.92 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.189 -0.944 . . . . 0.0 108.882 179.118 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.527 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.42 -45.35 80.76 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.519 -0.738 . . . . 0.0 109.449 179.33 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.425 ' HB3' ' CD ' ' A' ' 46' ' ' PRO . . . -57.16 -36.15 70.4 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.346 -0.846 . . . . 0.0 109.643 179.549 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.58 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 1.6 t80 -71.8 -37.86 70.32 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.647 -0.658 . . . . 0.0 110.004 179.581 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.4 p -56.03 -49.73 72.89 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.313 -0.867 . . . . 0.0 110.234 -179.897 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.1 m -62.27 -37.3 84.95 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.165 -0.96 . . . . 0.0 110.064 179.892 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.89 -39.05 64.17 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.234 -0.916 . . . . 0.0 110.115 179.753 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.544 ' HG ' ' N ' ' A' ' 68' ' ' TYR . 0.1 OUTLIER -60.32 -44.86 95.08 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.247 -0.908 . . . . 0.0 109.593 179.893 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.544 ' N ' ' HG ' ' A' ' 67' ' ' LEU . 4.5 m-85 . . . . . 0 N--CA 1.492 1.65 0 O-C-N 121.569 -0.707 . . . . 0.0 110.239 179.985 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 24.6 ttmt . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 121.157 0.503 . . . . 0.0 110.153 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 8.7 ttpt -62.37 -48.44 79.78 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.274 -0.891 . . . . 0.0 110.174 -179.935 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.74 -40.22 72.21 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.196 -0.94 . . . . 0.0 109.986 179.915 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.35 -41.43 98.85 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.215 -0.928 . . . . 0.0 109.974 179.855 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . 0.519 ' CB ' HD11 ' A' ' 16' ' ' ILE . . . -62.86 -42.83 99.9 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.276 -0.89 . . . . 0.0 110.057 179.909 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 79.0 t -57.53 -43.06 82.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.261 -0.899 . . . . 0.0 110.057 179.829 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.94 -37.55 85.13 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.338 -0.851 . . . . 0.0 109.97 179.849 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 11.8 m -64.61 -44.26 91.13 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.296 -0.878 . . . . 0.0 109.879 179.91 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.417 ' O ' HG22 ' B' ' 20' ' ' VAL . 73.5 t -65.71 -45.54 91.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.294 -0.879 . . . . 0.0 110.043 179.935 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 59.5 t -58.42 -45.84 89.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.255 -0.903 . . . . 0.0 110.116 179.914 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.36 -43.79 93.45 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.297 -0.877 . . . . 0.0 110.256 179.993 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.44 -45.86 82.18 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.279 -0.888 . . . . 0.0 110.2 -179.95 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . 0.417 HG22 ' O ' ' B' ' 16' ' ' VAL . 54.8 t -60.22 -41.17 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.259 -0.9 . . . . 0.0 110.056 179.826 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -64.79 -33.01 74.98 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.364 -0.835 . . . . 0.0 110.143 179.994 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.36 -49.98 75.71 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.206 -0.934 . . . . 0.0 110.027 179.881 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.42 -40.42 97.13 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.253 -0.905 . . . . 0.0 109.993 179.805 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 2.4 ttp85 . . . . . 0 N--CA 1.492 1.627 0 O-C-N 121.37 -0.831 . . . . 0.0 110.316 -179.966 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.558 HG21 ' CZ ' ' A' ' 68' ' ' TYR . 7.4 m . . . . . 0 N--CA 1.492 1.641 0 CA-C-O 121.096 0.474 . . . . 0.0 110.248 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -68.41 -36.2 78.75 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.158 -0.964 . . . . 0.0 109.561 179.702 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.69 -36.49 73.32 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.401 -0.812 . . . . 0.0 109.812 179.474 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.57 -42.62 99.11 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.33 -0.856 . . . . 0.0 110.081 179.9 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.464 HG11 ' CD2' ' A' ' 14' ' ' PHE . 96.0 t -60.61 -46.44 95.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.224 -0.922 . . . . 0.0 109.829 179.643 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 56.8 mt -54.73 -45.78 73.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.328 -0.858 . . . . 0.0 109.393 179.471 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.72 -41.07 81.03 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.22 -0.925 . . . . 0.0 108.635 178.859 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.4 m -68.21 -37.95 81.42 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 178.718 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.561 ' HB3' ' CD1' ' A' ' 60' ' ' TYR . 1.9 m-85 -68.39 -41.95 79.77 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.452 -0.78 . . . . 0.0 109.387 179.033 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -54.15 -46.42 72.27 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.407 -0.808 . . . . 0.0 109.393 179.355 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 53.2 mt -58.13 -43.69 85.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.389 -0.819 . . . . 0.0 109.501 179.336 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.444 HD12 HG21 ' B' ' 13' ' ' VAL . 2.5 mp -65.0 -40.13 94.49 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.397 -0.814 . . . . 0.0 109.748 179.485 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.476 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -77.19 -1.35 29.02 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.374 -0.829 . . . . 0.0 110.246 179.739 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.3 OUTLIER 68.71 63.87 0.32 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.226 -0.922 . . . . 0.0 110.308 179.965 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 51.68 59.02 4.87 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.19 -0.944 . . . . 0.0 110.141 179.937 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.457 ' HG3' ' O ' ' A' ' 19' ' ' SER . 9.0 mttt -145.46 142.92 18.75 Favored Pre-proline 0 N--CA 1.49 1.525 0 O-C-N 121.248 -0.908 . . . . 0.0 110.071 179.985 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -69.63 -4.84 14.76 Favored 'Trans proline' 0 C--N 1.305 -1.723 0 O-C-N 123.973 1.512 . . . . 0.0 109.907 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.434 ' C ' ' CD1' ' A' ' 23' ' ' TYR . 19.6 p90 -144.77 161.9 38.09 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.349 -0.844 . . . . 0.0 109.884 179.866 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.424 HD12 HG22 ' A' ' 24' ' ' ILE . 11.3 tt -139.32 153.14 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.137 -0.977 . . . . 0.0 110.311 -179.823 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.2 mp -89.24 156.24 18.89 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.309 -0.87 . . . . 0.0 109.964 179.798 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.38 -42.23 92.92 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.172 -0.955 . . . . 0.0 110.256 -179.825 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -56.45 -40.48 74.87 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.28 -0.887 . . . . 0.0 110.152 179.931 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.474 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 1.9 mt-10 -68.32 -41.12 81.31 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.212 -0.93 . . . . 0.0 108.771 179.215 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.473 ' O ' ' HB2' ' A' ' 33' ' ' LEU . 3.3 tp -66.83 -38.84 87.19 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 179.012 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.5 ttm180 -66.96 -34.58 78.08 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.559 -0.713 . . . . 0.0 110.587 -179.923 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.08 -20.26 22.24 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.21 -0.931 . . . . 0.0 111.04 -179.391 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.474 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 86.2 mt-10 -94.87 -19.26 20.44 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.012 -1.055 . . . . 0.0 110.814 -179.447 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.53 HD21 ' CB ' ' A' ' 37' ' ' GLN . 5.7 mt -120.92 162.06 37.03 Favored Pre-proline 0 N--CA 1.489 1.498 0 O-C-N 121.079 -1.013 . . . . 0.0 110.303 -179.857 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.458 ' HD2' HD21 ' A' ' 33' ' ' LEU . 32.5 Cg_exo -67.76 148.43 77.27 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 124.032 1.543 . . . . 0.0 110.246 179.914 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.402 ' C ' ' O ' ' A' ' 34' ' ' PRO . 16.6 Cg_exo -41.78 -40.59 5.73 Favored 'Trans proline' 0 C--N 1.303 -1.864 0 O-C-N 124.116 1.588 . . . . 0.0 110.496 -179.823 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -63.58 -47.25 82.27 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.223 -0.923 . . . . 0.0 110.37 -179.705 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.53 ' CB ' HD21 ' A' ' 33' ' ' LEU . 14.5 mp0 -69.58 -40.85 76.47 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.192 -0.943 . . . . 0.0 110.267 179.957 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.424 ' O ' ' CD1' ' A' ' 42' ' ' ILE . . . -58.88 -47.84 83.51 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.303 -0.873 . . . . 0.0 110.299 -179.921 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 48.7 tp60 -61.63 -48.83 79.12 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.309 -0.869 . . . . 0.0 110.378 -179.906 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.19 -42.22 89.15 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.235 -0.916 . . . . 0.0 110.228 179.991 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.459 ' HB3' HD23 ' A' ' 29' ' ' LEU . 13.7 m -63.65 -48.24 78.03 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.305 -0.872 . . . . 0.0 110.15 179.885 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.445 HG13 ' CD2' ' A' ' 29' ' ' LEU . 1.2 mt -61.23 -21.24 24.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.274 -0.891 . . . . 0.0 110.071 -179.993 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -81.56 -39.79 24.08 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.15 -0.969 . . . . 0.0 110.144 179.794 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.576 ' HB2' ' CD2' ' A' ' 63' ' ' PHE . 40.4 mmt-85 -77.11 -66.09 0.87 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.273 -0.892 . . . . 0.0 109.97 179.805 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.549 ' HE2' ' CB ' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -29.91 114.92 0.31 Allowed Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.9 -0.5 . . . . 0.0 111.471 179.648 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.524 ' CD ' ' HB1' ' A' ' 62' ' ' ALA . 18.5 Cg_endo . . . . . 0 C--N 1.305 -1.743 0 O-C-N 124.003 1.528 . . . . 0.0 109.932 179.649 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.33 0.586 . . . . 0.0 110.143 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.582 ' CD2' ' N ' ' A' ' 58' ' ' LEU . 3.1 mm? -113.66 160.49 18.55 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.361 -0.837 . . . . 0.0 110.021 179.962 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.505 ' OD1' ' CB ' ' A' ' 61' ' ' ALA . 6.9 t70 -109.38 110.23 21.31 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.993 -1.067 . . . . 0.0 111.008 -179.915 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.561 ' CD1' ' HB3' ' A' ' 14' ' ' PHE . 26.4 p90 -73.1 -23.61 60.53 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 178.192 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.519 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.29 -40.68 74.67 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.702 -0.624 . . . . 0.0 109.71 179.667 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.524 ' HB1' ' CD ' ' A' ' 46' ' ' PRO . . . -56.4 -32.17 64.57 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.241 -0.912 . . . . 0.0 109.619 179.532 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.576 ' CD2' ' HB2' ' A' ' 44' ' ' ARG . 1.7 t80 -65.78 -47.6 74.63 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.6 -0.688 . . . . 0.0 110.559 179.976 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.0 t -55.81 -47.53 77.0 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.168 -0.958 . . . . 0.0 110.759 -179.288 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.32 -39.19 92.13 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.14 -0.975 . . . . 0.0 110.521 -179.721 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.26 -30.53 57.89 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.149 -0.969 . . . . 0.0 110.556 -179.656 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.461 ' HB3' ' O ' ' A' ' 63' ' ' PHE . 0.6 OUTLIER -78.59 -45.2 22.24 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.119 -0.988 . . . . 0.0 109.603 -179.955 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.558 ' CZ ' HG21 ' A' ' 6' ' ' THR . 17.1 m-85 . . . . . 0 N--CA 1.491 1.607 0 O-C-N 121.535 -0.728 . . . . 0.0 110.316 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.155 0.503 . . . . 0.0 110.161 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 2.4 ttmt -57.84 -50.04 74.62 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.2 -0.938 . . . . 0.0 109.926 179.863 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.0 -38.36 67.79 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.184 -0.948 . . . . 0.0 109.706 179.66 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -67.79 -41.03 83.82 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.407 -0.808 . . . . 0.0 109.874 179.684 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.53 -37.67 88.36 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.315 -0.865 . . . . 0.0 109.902 179.718 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.444 HG21 HD12 ' A' ' 17' ' ' LEU . 46.5 t -61.1 -41.51 89.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.266 -0.896 . . . . 0.0 109.998 179.732 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.95 -42.94 99.97 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.264 -0.897 . . . . 0.0 110.022 179.778 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 90.6 m -61.29 -43.2 99.26 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.22 -0.925 . . . . 0.0 110.159 179.88 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 98.2 t -64.81 -41.27 91.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.177 -0.952 . . . . 0.0 110.053 179.86 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.432 HG11 ' NE2' ' A' ' 37' ' ' GLN . 86.5 t -59.87 -46.31 93.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.295 -0.878 . . . . 0.0 110.271 -179.964 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.17 -39.63 94.41 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.247 -0.908 . . . . 0.0 110.27 -179.948 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.42 -41.49 96.58 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.257 -0.902 . . . . 0.0 110.399 -179.855 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 61.4 t -67.01 -41.67 87.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.225 -0.922 . . . . 0.0 110.367 -179.807 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.86 -40.14 91.8 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.269 -0.894 . . . . 0.0 110.303 -179.964 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.21 -49.03 72.99 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.251 -0.905 . . . . 0.0 110.287 -179.977 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.02 -37.44 87.18 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.277 -0.889 . . . . 0.0 110.233 179.997 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 9.9 ttp180 . . . . . 0 N--CA 1.492 1.639 0 O-C-N 121.271 -0.893 . . . . 0.0 110.05 179.925 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.351 0.596 . . . . 0.0 110.134 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -66.16 -46.82 76.09 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.262 -0.899 . . . . 0.0 109.725 179.826 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -54.52 -36.78 64.6 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.358 -0.839 . . . . 0.0 109.82 179.633 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.445 ' OE1' HG22 ' B' ' 15' ' ' THR . 0.4 OUTLIER -62.02 -48.39 80.49 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.29 -0.881 . . . . 0.0 109.91 179.92 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.439 ' O ' ' OG ' ' A' ' 13' ' ' SER . 77.7 t -58.92 -43.25 88.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.251 -0.906 . . . . 0.0 109.773 179.657 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 45.0 mt -62.0 -47.07 94.92 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.305 -0.872 . . . . 0.0 109.545 179.433 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.56 -42.13 82.41 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.324 -0.86 . . . . 0.0 108.944 179.175 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.458 ' O ' HD11 ' A' ' 17' ' ' LEU . 0.8 OUTLIER -68.43 -40.39 81.19 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.416 -0.802 . . . . 0.0 109.277 179.004 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.553 ' CB ' ' CD1' ' A' ' 60' ' ' TYR . 1.7 m-85 -65.26 -42.94 92.73 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.242 -0.911 . . . . 0.0 109.587 179.396 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 35.8 ttm-85 -55.96 -47.08 78.27 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.302 -0.873 . . . . 0.0 109.579 179.388 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.464 HG22 HD11 ' A' ' 16' ' ' ILE . 30.1 mt -60.73 -41.14 87.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.398 -0.814 . . . . 0.0 109.649 179.403 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.479 ' CD2' ' OE2' ' A' ' 32' ' ' GLU . 5.5 mp -64.86 -40.5 95.24 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.419 -0.8 . . . . 0.0 109.781 179.602 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.461 ' HA ' ' OE2' ' A' ' 28' ' ' GLU . . . -73.65 -4.89 37.04 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.405 -0.809 . . . . 0.0 110.103 179.842 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.458 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.1 OUTLIER 67.46 59.42 0.5 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.298 -0.876 . . . . 0.0 110.158 -179.948 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.423 ' CB ' ' O ' ' A' ' 19' ' ' SER . 0.2 OUTLIER 63.96 64.66 0.74 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.276 -0.89 . . . . 0.0 110.295 179.939 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.43 ' HB2' ' HB2' ' A' ' 18' ' ' ALA . 73.4 mttt -153.02 143.6 15.67 Favored Pre-proline 0 N--CA 1.489 1.491 0 O-C-N 121.212 -0.93 . . . . 0.0 110.093 -179.979 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -75.69 2.0 7.44 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 O-C-N 123.957 1.504 . . . . 0.0 110.011 179.539 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.549 ' N ' ' CD1' ' A' ' 23' ' ' TYR . 14.7 p90 -142.48 169.7 17.09 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.326 -0.858 . . . . 0.0 109.952 179.949 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.486 HG21 HD11 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -137.27 141.63 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.104 -0.998 . . . . 0.0 110.165 -179.897 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.441 ' O ' HD11 ' A' ' 24' ' ' ILE . 1.4 mp -81.54 153.6 26.69 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.21 -0.931 . . . . 0.0 110.127 -179.925 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.482 ' HA ' HD22 ' A' ' 29' ' ' LEU . . . -68.27 -38.53 81.82 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.366 -0.834 . . . . 0.0 110.403 -179.775 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -69.25 -34.2 74.43 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.252 -0.905 . . . . 0.0 109.937 179.852 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.461 ' OE2' ' HA ' ' A' ' 18' ' ' ALA . 14.5 tt0 -65.5 -50.97 63.29 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.23 -0.919 . . . . 0.0 109.951 -179.98 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.524 ' HA ' ' CG ' ' A' ' 32' ' ' GLU . 1.2 pp -67.3 -33.74 75.91 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.187 -0.945 . . . . 0.0 109.716 179.378 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.534 ' HA ' ' CB ' ' A' ' 38' ' ' ALA . 10.3 mtt-85 -63.73 -34.1 77.13 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.427 -0.796 . . . . 0.0 110.381 179.974 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.14 -16.33 29.78 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.205 -0.934 . . . . 0.0 111.255 -179.174 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.524 ' CG ' ' HA ' ' A' ' 29' ' ' LEU . 0.8 OUTLIER -99.51 -23.77 14.99 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.807 -1.183 . . . . 0.0 110.726 -179.667 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.538 HD21 ' CB ' ' A' ' 37' ' ' GLN . 4.3 mt -108.89 139.86 21.31 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.229 -0.919 . . . . 0.0 110.44 -179.994 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.459 ' HD2' HD21 ' A' ' 33' ' ' LEU . 37.5 Cg_exo -44.36 139.47 6.61 Favored 'Trans proline' 0 C--N 1.306 -1.693 0 O-C-N 123.962 1.506 . . . . 0.0 109.87 179.676 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.438 ' C ' ' O ' ' A' ' 34' ' ' PRO . 24.9 Cg_exo -39.92 -39.01 2.13 Favored 'Trans proline' 0 C--N 1.306 -1.693 0 O-C-N 124.027 1.541 . . . . 0.0 110.574 -179.563 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.16 -45.98 79.03 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.244 -0.91 . . . . 0.0 110.805 -179.891 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.538 ' CB ' HD21 ' A' ' 33' ' ' LEU . 98.3 mm-40 -69.64 -44.34 70.8 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.032 -1.043 . . . . 0.0 110.413 -179.664 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.534 ' CB ' ' HA ' ' A' ' 30' ' ' ARG . . . -58.16 -49.24 77.71 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.315 -0.866 . . . . 0.0 110.56 -179.553 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -58.97 -40.85 86.0 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.152 -0.967 . . . . 0.0 110.412 -179.887 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.29 -47.97 71.91 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.254 -0.904 . . . . 0.0 110.356 -179.88 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.573 ' HA ' ' CE1' ' A' ' 63' ' ' PHE . 48.1 m -63.02 -48.33 79.23 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.236 -0.915 . . . . 0.0 110.371 -179.863 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.522 ' CD1' HD23 ' A' ' 29' ' ' LEU . 12.4 mm -47.1 -19.3 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.303 -0.873 . . . . 0.0 111.225 -179.854 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.28 -24.12 30.04 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.969 -1.082 . . . . 0.0 111.527 -179.072 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.632 ' CD ' ' CE1' ' A' ' 63' ' ' PHE . 36.7 mtt180 -95.79 -69.91 0.73 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 120.862 -1.149 . . . . 0.0 110.862 -179.419 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.567 ' C ' ' O ' ' A' ' 44' ' ' ARG . 2.1 mtp -14.99 84.13 0.03 OUTLIER Pre-proline 0 N--CA 1.507 2.399 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -179.477 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.516 ' HG2' ' CB ' ' A' ' 62' ' ' ALA . 35.4 Cg_exo . . . . . 0 C--N 1.307 -1.64 0 O-C-N 124.053 1.554 . . . . 0.0 110.28 -179.923 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.332 0.587 . . . . 0.0 110.274 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 79.1 mt -121.06 157.44 30.04 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.195 -0.941 . . . . 0.0 109.962 179.813 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -104.54 112.07 25.0 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.209 -0.932 . . . . 0.0 110.527 -179.911 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.553 ' CD1' ' CB ' ' A' ' 14' ' ' PHE . 23.2 p90 -81.19 -19.43 43.33 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.298 -0.876 . . . . 0.0 109.353 179.483 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.427 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.86 -40.83 73.46 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.326 -0.859 . . . . 0.0 109.264 179.575 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.516 ' CB ' ' HG2' ' A' ' 46' ' ' PRO . . . -58.36 -32.31 68.45 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.328 -0.858 . . . . 0.0 108.981 179.083 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.632 ' CE1' ' CD ' ' A' ' 44' ' ' ARG . 6.1 t80 -58.65 -45.45 89.3 Favored 'General case' 0 C--N 1.3 -1.558 0 CA-C-O 121.278 0.561 . . . . 0.0 110.219 179.607 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 81.2 p -72.44 -45.02 61.5 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.191 -0.943 . . . . 0.0 110.554 -179.78 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 47.2 t -68.42 -41.04 80.97 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.255 -0.903 . . . . 0.0 110.576 -179.642 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.25 -35.44 71.42 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.209 -0.932 . . . . 0.0 110.594 -179.683 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.593 ' CD1' ' CD2' ' A' ' 63' ' ' PHE . 11.2 mt -74.94 -41.14 60.21 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.172 -0.955 . . . . 0.0 110.556 -179.705 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 . . . . . 0 N--CA 1.491 1.59 0 O-C-N 121.154 -0.966 . . . . 0.0 110.307 -179.783 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 121.284 0.564 . . . . 0.0 110.279 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.451 ' O ' HG22 ' B' ' 13' ' ' VAL . 0.0 OUTLIER -60.36 -44.05 95.95 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.302 -0.873 . . . . 0.0 110.241 -179.997 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.16 -35.95 74.42 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.195 -0.94 . . . . 0.0 110.067 179.993 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -65.42 -40.62 93.56 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.268 -0.895 . . . . 0.0 109.91 179.855 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.17 -44.32 92.42 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.292 -0.88 . . . . 0.0 110.234 179.96 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.451 HG22 ' O ' ' B' ' 9' ' ' LYS . 47.5 t -62.25 -46.25 96.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.229 -0.919 . . . . 0.0 110.042 -179.914 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.49 -35.42 72.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.281 -0.887 . . . . 0.0 110.038 179.905 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 15' ' ' THR . . . . . 0.445 HG22 ' OE1' ' A' ' 9' ' ' GLN . 8.8 m -66.2 -42.87 88.22 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.267 -0.895 . . . . 0.0 109.97 179.737 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 53.3 t -67.16 -43.3 88.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.21 -0.931 . . . . 0.0 110.103 179.907 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 59.2 t -61.4 -44.92 99.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.354 -0.841 . . . . 0.0 110.315 -179.905 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.14 -43.54 94.92 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.222 -0.924 . . . . 0.0 110.213 179.865 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.37 -40.59 96.14 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.28 -0.887 . . . . 0.0 110.213 -179.898 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 65.6 t -67.49 -42.52 87.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.153 -0.967 . . . . 0.0 110.101 179.993 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -63.17 -40.13 96.65 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.274 -0.891 . . . . 0.0 110.132 179.919 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -54.21 -49.96 68.2 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.288 -0.883 . . . . 0.0 109.846 179.908 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -58.27 -42.41 86.47 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.192 -0.942 . . . . 0.0 109.795 179.632 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 5.0 ttp180 . . . . . 0 N--CA 1.49 1.535 0 O-C-N 121.303 -0.873 . . . . 0.0 109.99 179.837 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.1 m . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.262 0.553 . . . . 0.0 110.271 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.598 ' HA ' ' CZ ' ' A' ' 68' ' ' TYR . . . -65.22 -46.55 80.17 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.193 -0.942 . . . . 0.0 109.948 179.925 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.78 -36.54 69.98 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.28 -0.888 . . . . 0.0 109.831 179.485 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.57 -43.36 99.01 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.341 -0.849 . . . . 0.0 110.181 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.526 ' CG2' ' OH ' ' A' ' 68' ' ' TYR . 65.6 t -59.07 -44.87 92.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.09 -1.006 . . . . 0.0 109.777 179.732 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 44.4 mt -57.1 -49.72 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.404 -0.81 . . . . 0.0 109.465 179.574 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.78 -39.24 84.23 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.309 -0.869 . . . . 0.0 108.829 178.901 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.463 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 70.8 m -65.41 -40.54 93.52 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.465 -0.772 . . . . 0.0 109.099 178.898 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -66.82 -43.88 82.65 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.343 -0.848 . . . . 0.0 109.366 179.102 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -53.35 -41.21 65.58 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.353 -0.842 . . . . 0.0 109.153 179.049 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.412 ' CD1' ' HB2' ' B' ' 12' ' ' ALA . 49.3 mt -59.18 -45.09 93.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.426 -0.796 . . . . 0.0 109.687 179.326 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 13' ' ' SER . 15.4 mt -65.09 -41.83 94.63 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.185 -0.947 . . . . 0.0 109.41 179.386 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.486 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -71.12 -7.27 45.44 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.527 -0.733 . . . . 0.0 110.123 179.826 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.486 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 1.5 t 68.38 64.3 0.34 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.24 -0.912 . . . . 0.0 110.199 -179.971 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 58.2 66.35 1.12 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.257 -0.902 . . . . 0.0 110.312 179.969 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.415 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 64.5 mttt -153.15 143.22 15.31 Favored Pre-proline 0 N--CA 1.49 1.537 0 O-C-N 121.248 -0.908 . . . . 0.0 110.023 179.992 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -75.28 2.17 7.06 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 O-C-N 123.983 1.517 . . . . 0.0 110.156 179.703 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.469 ' O ' ' HB2' ' A' ' 18' ' ' ALA . 23.7 p90 -141.66 160.65 39.72 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.202 -0.936 . . . . 0.0 110.075 179.951 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.524 HD11 HG22 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -130.31 140.79 47.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.228 -0.92 . . . . 0.0 109.937 179.916 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.403 ' N ' ' CD1' ' A' ' 24' ' ' ILE . 1.1 mt -81.85 148.32 28.89 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.223 -0.923 . . . . 0.0 110.45 -179.733 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.77 -44.84 95.14 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.373 -0.829 . . . . 0.0 109.953 179.818 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -56.52 -36.28 69.02 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.276 -0.89 . . . . 0.0 109.869 179.744 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.517 ' O ' ' N ' ' A' ' 32' ' ' GLU . 0.6 OUTLIER -62.73 -42.22 99.56 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.416 -0.803 . . . . 0.0 109.681 179.742 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.418 HD11 HG13 ' A' ' 42' ' ' ILE . 17.5 mt -58.32 -34.2 70.33 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.272 -0.892 . . . . 0.0 109.532 179.634 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 9.6 mtm-85 -66.92 -38.68 86.65 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.343 -0.848 . . . . 0.0 109.828 179.597 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.76 -12.16 24.06 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.297 -0.877 . . . . 0.0 110.665 -179.754 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.517 ' N ' ' O ' ' A' ' 28' ' ' GLU . 11.3 mm-40 -96.76 -23.55 16.36 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.095 -1.003 . . . . 0.0 110.451 -179.819 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.532 ' CD2' ' CG2' ' B' ' 17' ' ' VAL . 1.4 mt -136.75 157.03 75.72 Favored Pre-proline 0 C--N 1.306 -1.317 0 O-C-N 121.166 -0.959 . . . . 0.0 110.102 -179.769 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.468 ' HD2' HD21 ' A' ' 33' ' ' LEU . 32.7 Cg_exo -46.25 171.21 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.735 0 O-C-N 123.861 1.453 . . . . 0.0 110.075 179.777 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_endo -64.77 -41.92 16.96 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 O-C-N 123.921 1.485 . . . . 0.0 110.305 -179.89 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.95 -40.89 91.73 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.34 -0.85 . . . . 0.0 110.548 -179.795 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.523 ' CB ' HD21 ' A' ' 33' ' ' LEU . 12.9 mp0 -69.33 -37.94 77.95 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.142 -0.974 . . . . 0.0 110.394 -179.739 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.79 -45.96 90.69 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.264 -0.898 . . . . 0.0 110.33 -179.94 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.465 ' O ' ' HB2' ' A' ' 43' ' ' LYS . 14.1 tt0 -66.1 -43.76 86.32 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.142 -0.974 . . . . 0.0 110.51 -179.873 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.8 -42.2 95.2 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.26 -0.9 . . . . 0.0 110.401 -179.766 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 31.1 m -63.09 -46.89 85.28 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.298 -0.876 . . . . 0.0 110.578 -179.666 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.418 HG13 HD11 ' A' ' 29' ' ' LEU . 74.5 mt -72.98 -13.72 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.126 -0.984 . . . . 0.0 110.519 -179.644 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 39' ' ' GLN . 0.1 OUTLIER -76.29 -21.19 56.56 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.163 -0.961 . . . . 0.0 110.461 -179.707 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.58 ' HB3' ' CG ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -113.0 -48.99 2.95 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.123 -0.986 . . . . 0.0 110.344 -180.0 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.519 ' SD ' ' CG2' ' A' ' 24' ' ' ILE . 2.0 ttm -34.62 96.77 0.11 Allowed Pre-proline 0 N--CA 1.494 1.764 0 O-C-N 121.695 -0.628 . . . . 0.0 111.071 -179.975 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.478 ' O ' HD11 ' A' ' 58' ' ' LEU . 27.1 Cg_exo . . . . . 0 C--N 1.305 -1.716 0 O-C-N 123.995 1.524 . . . . 0.0 110.026 179.765 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.621 0 CA-C-O 121.34 0.59 . . . . 0.0 110.217 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.583 ' CD2' ' N ' ' A' ' 58' ' ' LEU . 2.3 mm? -116.2 160.19 20.75 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.305 -0.872 . . . . 0.0 109.936 179.996 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.457 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.6 OUTLIER -106.8 110.41 22.58 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.041 -1.037 . . . . 0.0 110.445 -179.98 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.624 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 17.2 p90 -75.91 -26.31 56.86 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.259 -0.9 . . . . 0.0 109.966 179.601 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.624 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.15 -39.59 72.54 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.327 -0.858 . . . . 0.0 110.023 -179.806 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.453 ' CB ' ' HG2' ' A' ' 46' ' ' PRO . . . -65.56 -39.55 91.81 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.177 -0.952 . . . . 0.0 109.831 179.667 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.58 ' CG ' ' HB3' ' A' ' 44' ' ' ARG . 2.0 t80 -71.9 -35.05 69.59 Favored 'General case' 0 C--N 1.298 -1.647 0 O-C-N 121.572 -0.705 . . . . 0.0 110.137 179.68 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.579 ' O ' ' CD2' ' A' ' 68' ' ' TYR . 17.4 m -56.19 -49.9 72.73 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.343 -0.848 . . . . 0.0 110.554 -179.692 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.5 p -55.65 -44.42 77.16 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.211 -0.931 . . . . 0.0 110.461 -179.754 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.16 -39.08 74.54 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.149 -0.97 . . . . 0.0 110.481 -179.802 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.528 HD13 ' CZ ' ' A' ' 63' ' ' PHE . 18.3 mt -60.25 -38.52 83.72 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.188 -0.945 . . . . 0.0 110.292 -179.894 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.598 ' CZ ' ' HA ' ' A' ' 7' ' ' ALA . 10.3 m-85 . . . . . 0 N--CA 1.489 1.52 0 O-C-N 121.315 -0.866 . . . . 0.0 110.215 -179.641 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 11.4 ptpt . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 121.321 0.581 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 15.8 ttmt -58.55 -41.87 86.6 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.221 -0.925 . . . . 0.0 110.161 -179.969 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.16 -35.74 77.94 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.235 -0.916 . . . . 0.0 110.011 179.927 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.86 -42.62 94.72 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.343 -0.848 . . . . 0.0 110.128 179.998 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . 0.412 ' HB2' ' CD1' ' A' ' 16' ' ' ILE . . . -63.17 -35.78 81.44 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.141 -0.974 . . . . 0.0 110.018 179.83 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.434 ' O ' HG21 ' B' ' 17' ' ' VAL . 72.8 t -61.61 -42.34 93.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.28 -0.887 . . . . 0.0 110.075 179.892 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.51 -44.26 93.16 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.309 -0.87 . . . . 0.0 110.234 179.955 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 37.0 m -64.57 -49.12 72.43 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.301 -0.875 . . . . 0.0 110.33 -180.0 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 86.2 t -60.99 -43.98 97.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.183 -0.948 . . . . 0.0 110.298 -179.966 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.532 ' CG2' ' CD2' ' A' ' 33' ' ' LEU . 90.2 t -63.18 -47.17 93.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.327 -0.858 . . . . 0.0 110.2 -179.886 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.54 -43.25 75.65 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.25 -0.906 . . . . 0.0 110.165 -179.975 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.5 -44.09 83.53 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.309 -0.869 . . . . 0.0 110.161 179.989 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 75.1 t -66.07 -44.96 91.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.226 -0.921 . . . . 0.0 110.192 179.956 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -57.16 -34.81 68.81 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.276 -0.89 . . . . 0.0 110.24 -179.96 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.9 tm0? -61.18 -49.83 75.62 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.2 -0.938 . . . . 0.0 110.162 -179.914 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.81 -35.4 76.4 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.291 -0.881 . . . . 0.0 110.353 -179.922 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 21.5 ttp85 . . . . . 0 N--CA 1.493 1.684 0 O-C-N 121.15 -0.968 . . . . 0.0 110.487 179.979 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.621 ' CG2' ' CZ ' ' A' ' 68' ' ' TYR . 3.3 m . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 121.191 0.52 . . . . 0.0 110.196 . . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -66.94 -45.53 77.53 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.22 -0.925 . . . . 0.0 109.823 179.774 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -57.02 -36.65 70.69 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.32 -0.863 . . . . 0.0 109.883 179.694 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -61.38 -47.37 86.15 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.333 -0.854 . . . . 0.0 110.185 -179.853 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 41.6 t -58.26 -41.3 80.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.164 -0.96 . . . . 0.0 109.871 179.755 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 29.8 mt -63.33 -47.92 89.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.354 -0.841 . . . . 0.0 109.487 179.547 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.43 -39.01 75.32 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.334 -0.853 . . . . 0.0 108.722 179.018 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.467 ' HA ' ' HB3' ' B' ' 12' ' ' ALA . 10.6 m -66.91 -40.34 87.65 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 178.71 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.564 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 6.6 m-85 -68.28 -41.23 81.33 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.464 -0.772 . . . . 0.0 109.525 179.219 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -53.1 -44.26 67.49 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.348 -0.845 . . . . 0.0 109.456 179.363 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 48.3 mt -59.74 -43.6 91.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.479 -0.763 . . . . 0.0 109.882 179.467 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 13' ' ' SER . 48.3 mt -65.12 -41.75 94.57 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.289 -0.882 . . . . 0.0 109.949 179.792 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.469 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -83.75 13.97 4.32 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.456 -0.778 . . . . 0.0 110.337 -179.879 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 57.73 70.58 0.64 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.245 -0.91 . . . . 0.0 110.465 179.932 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.8 t70 44.99 54.96 6.51 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.332 -0.855 . . . . 0.0 110.514 179.777 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.527 ' HD2' ' CZ ' ' A' ' 23' ' ' TYR . 7.1 mttm -133.55 141.83 41.71 Favored Pre-proline 0 N--CA 1.491 1.575 0 O-C-N 121.143 -0.973 . . . . 0.0 109.901 179.89 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -68.13 -4.4 12.55 Favored 'Trans proline' 0 C--N 1.305 -1.729 0 O-C-N 124.02 1.537 . . . . 0.0 110.388 179.973 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.527 ' CZ ' ' HD2' ' A' ' 21' ' ' LYS . 51.8 p90 -139.18 157.41 45.98 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.213 -0.93 . . . . 0.0 110.306 -179.913 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.525 ' CG2' ' SD ' ' A' ' 45' ' ' MET . 0.2 OUTLIER -132.91 138.25 52.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.286 -0.884 . . . . 0.0 109.467 179.581 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -82.15 139.48 34.32 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.13 -0.981 . . . . 0.0 110.369 -179.48 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -54.99 -35.22 64.11 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.39 -0.819 . . . . 0.0 110.175 179.945 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 87.6 mt-10 -61.12 -38.56 86.77 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.224 -0.922 . . . . 0.0 109.991 179.9 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -65.87 -40.48 91.69 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.329 -0.857 . . . . 0.0 109.565 179.627 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.448 HD22 HD13 ' A' ' 24' ' ' ILE . 63.6 mt -59.24 -34.03 71.72 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.433 -0.792 . . . . 0.0 109.476 179.446 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.4 ' HA ' ' CB ' ' A' ' 38' ' ' ALA . 27.8 mtp180 -68.48 -34.56 76.14 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.388 -0.82 . . . . 0.0 110.047 179.754 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.22 -31.48 13.47 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.3 -0.875 . . . . 0.0 110.499 -179.665 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -83.48 -23.36 32.23 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.074 -1.017 . . . . 0.0 110.431 -179.773 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.531 HD21 ' CB ' ' A' ' 37' ' ' GLN . 1.5 mt -129.85 147.84 67.1 Favored Pre-proline 0 N--CA 1.488 1.461 0 O-C-N 121.082 -1.011 . . . . 0.0 110.329 -179.749 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.484 ' HD2' ' CD2' ' A' ' 33' ' ' LEU . 1.0 OUTLIER -46.45 167.11 0.07 OUTLIER 'Trans proline' 0 C--N 1.305 -1.76 0 O-C-N 124.021 1.537 . . . . 0.0 110.095 179.665 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -62.44 -36.02 68.57 Favored 'Trans proline' 0 C--N 1.304 -1.794 0 O-C-N 124.03 1.542 . . . . 0.0 110.484 -179.768 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.521 ' OD1' ' N ' ' A' ' 37' ' ' GLN . 1.7 p30 -65.61 -46.4 79.46 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.25 -0.906 . . . . 0.0 110.462 -179.78 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.531 ' CB ' HD21 ' A' ' 33' ' ' LEU . 0.3 OUTLIER -69.45 -40.17 77.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.121 -0.987 . . . . 0.0 110.153 -179.962 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.432 ' O ' HG13 ' A' ' 42' ' ' ILE . . . -58.64 -48.14 82.02 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.289 -0.882 . . . . 0.0 110.185 179.917 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 66.7 tp60 -62.91 -47.52 82.9 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.266 -0.896 . . . . 0.0 110.14 179.888 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -66.21 -46.56 76.84 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.339 -0.851 . . . . 0.0 110.045 179.962 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 89.6 m -64.92 -45.97 83.61 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.356 -0.84 . . . . 0.0 110.332 -179.998 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 38' ' ' ALA . 66.2 mt -68.73 -12.46 15.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.245 -0.909 . . . . 0.0 110.424 -179.853 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 19.7 tttm -83.12 -40.23 20.05 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.209 -0.932 . . . . 0.0 110.487 -179.783 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.511 ' O ' ' C ' ' A' ' 45' ' ' MET . 3.2 mtp85 -85.27 -61.61 1.73 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.204 -0.935 . . . . 0.0 110.55 -179.656 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.525 ' SD ' ' CG2' ' A' ' 24' ' ' ILE . 5.8 ttm -28.0 103.32 0.16 Allowed Pre-proline 0 N--CA 1.497 1.919 0 O-C-N 121.84 -0.537 . . . . 0.0 111.598 -179.886 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.469 ' O ' HD13 ' A' ' 58' ' ' LEU . 11.4 Cg_endo . . . . . 0 C--N 1.305 -1.713 0 O-C-N 124.058 1.557 . . . . 0.0 110.028 179.691 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . 0.419 ' O ' HD11 ' A' ' 58' ' ' LEU . . . . . . . . 0 N--CA 1.494 1.749 0 CA-C-O 121.284 0.564 . . . . 0.0 110.032 . . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.59 ' CD2' ' N ' ' A' ' 58' ' ' LEU . 1.6 mm? -110.41 154.51 23.47 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.25 -0.906 . . . . 0.0 110.129 -179.846 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.461 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.4 OUTLIER -106.27 110.64 22.94 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.166 -0.959 . . . . 0.0 110.354 179.837 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.564 ' HB2' ' CD2' ' A' ' 14' ' ' PHE . 17.4 p90 -72.56 -18.02 61.66 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.242 -0.911 . . . . 0.0 109.164 179.223 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.434 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.79 -35.47 66.33 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.451 -0.781 . . . . 0.0 109.104 179.571 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.456 ' CB ' ' CD ' ' A' ' 46' ' ' PRO . . . -60.15 -32.68 71.26 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.368 -0.832 . . . . 0.0 109.174 179.185 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.554 ' CD2' HD13 ' A' ' 67' ' ' LEU . 2.6 t80 -63.14 -48.79 76.96 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.785 -0.572 . . . . 0.0 110.203 179.756 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.453 ' O ' ' HB2' ' A' ' 68' ' ' TYR . 41.3 p -63.92 -45.74 87.91 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.216 -0.928 . . . . 0.0 110.401 -179.862 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 54.0 m -67.06 -39.25 86.86 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.236 -0.915 . . . . 0.0 110.285 -179.897 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.19 -43.86 69.89 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.231 -0.918 . . . . 0.0 110.35 -179.851 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.554 HD13 ' CD2' ' A' ' 63' ' ' PHE . 22.5 mt -73.6 -44.6 56.73 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.175 -0.953 . . . . 0.0 110.357 -179.868 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.621 ' CZ ' ' CG2' ' A' ' 6' ' ' THR . 11.7 m-85 . . . . . 0 N--CA 1.491 1.583 0 O-C-N 121.222 -0.924 . . . . 0.0 110.286 -179.935 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 14.3 ptmt . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.164 0.507 . . . . 0.0 110.226 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.435 ' O ' HG22 ' B' ' 13' ' ' VAL . 7.3 ttpt -65.2 -45.74 83.55 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.174 -0.954 . . . . 0.0 110.228 -179.879 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.45 -41.94 73.57 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.284 -0.885 . . . . 0.0 110.099 179.859 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -61.07 -41.28 96.34 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.231 -0.918 . . . . 0.0 110.115 179.872 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . 0.467 ' HB3' ' HA ' ' A' ' 13' ' ' SER . . . -62.97 -36.43 83.45 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.309 -0.869 . . . . 0.0 110.142 179.94 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.435 HG22 ' O ' ' B' ' 9' ' ' LYS . 55.0 t -65.96 -45.12 91.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.255 -0.903 . . . . 0.0 110.163 179.758 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.04 -39.69 79.06 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.262 -0.899 . . . . 0.0 110.207 179.973 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 15.9 m -70.04 -40.79 74.95 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.317 -0.864 . . . . 0.0 110.21 179.916 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.446 HG13 HD12 ' A' ' 33' ' ' LEU . 92.4 t -67.08 -45.47 86.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.265 -0.897 . . . . 0.0 110.247 179.986 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.402 ' CG1' ' NE2' ' A' ' 37' ' ' GLN . 55.0 t -62.77 -44.33 99.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.199 -0.938 . . . . 0.0 110.098 179.935 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.06 -39.19 77.85 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.311 -0.868 . . . . 0.0 110.236 -179.988 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.25 -40.77 86.29 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.194 -0.941 . . . . 0.0 110.221 -179.905 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . 0.41 HG23 ' CE2' ' A' ' 63' ' ' PHE . 91.0 t -66.05 -41.04 88.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.293 -0.879 . . . . 0.0 110.355 -179.982 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 48.6 t0 -61.6 -31.86 71.95 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.245 -0.909 . . . . 0.0 110.247 -179.883 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -39.43 94.19 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.249 -0.907 . . . . 0.0 110.175 -179.9 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . 0.481 ' CB ' ' CD2' ' A' ' 67' ' ' LEU . . . -65.91 -38.35 88.48 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.188 -0.945 . . . . 0.0 110.334 -179.851 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.675 0 O-C-N 121.174 -0.954 . . . . 0.0 110.398 -179.867 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.213 0.53 . . . . 0.0 110.27 . . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.436 ' O ' HG13 ' A' ' 11' ' ' ILE . . . -62.01 -45.26 94.36 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.224 -0.923 . . . . 0.0 109.453 179.754 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -56.06 -36.59 68.23 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.437 -0.789 . . . . 0.0 109.682 179.333 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -61.96 -48.41 80.53 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.354 -0.841 . . . . 0.0 110.04 179.866 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 44.0 t -59.44 -46.42 92.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.339 -0.851 . . . . 0.0 109.673 179.695 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.436 HG13 ' O ' ' A' ' 7' ' ' ALA . 44.7 mt -57.49 -48.49 82.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.293 -0.879 . . . . 0.0 109.431 179.536 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.76 -43.36 85.4 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.223 -0.923 . . . . 0.0 108.811 178.979 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.45 ' HB2' ' HA ' ' B' ' 12' ' ' ALA . 6.7 p -63.07 -39.19 93.98 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 178.6 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -68.57 -41.21 80.02 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.512 -0.742 . . . . 0.0 109.576 179.112 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.638 ' NH2' ' CE2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -54.47 -42.61 70.88 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.276 -0.89 . . . . 0.0 109.62 179.486 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.412 HG22 HD11 ' A' ' 16' ' ' ILE . 38.0 mt -57.64 -45.05 86.5 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 O-C-N 121.155 -0.965 . . . . 0.0 108.72 179.032 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.473 HD13 ' HB3' ' A' ' 32' ' ' GLU . 4.1 mm? -65.97 -41.7 90.82 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.449 -0.782 . . . . 0.0 109.717 178.905 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.461 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -72.15 -11.96 60.97 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.475 -0.766 . . . . 0.0 110.091 -179.958 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.461 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 1.7 t 66.32 64.59 0.51 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.339 -0.851 . . . . 0.0 110.249 -179.987 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 51.45 62.36 2.75 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.213 -0.93 . . . . 0.0 110.377 179.902 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.525 ' O ' ' NE ' ' A' ' 15' ' ' ARG . 14.9 mttt -141.76 140.77 20.58 Favored Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.316 -0.865 . . . . 0.0 109.881 179.847 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.584 ' O ' ' CD1' ' A' ' 23' ' ' TYR . 18.5 Cg_endo -62.24 -10.65 19.09 Favored 'Trans proline' 0 C--N 1.303 -1.835 0 O-C-N 123.926 1.488 . . . . 0.0 110.178 179.938 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.584 ' CD1' ' O ' ' A' ' 22' ' ' PRO . 32.0 m-85 -143.06 -173.5 3.93 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.265 -0.897 . . . . 0.0 110.255 -179.974 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.7 tt -143.66 139.37 25.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.376 -0.828 . . . . 0.0 109.993 179.863 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.8 mt -80.17 143.35 33.91 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.276 -0.89 . . . . 0.0 109.95 -179.932 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.523 ' HA ' ' CD2' ' A' ' 29' ' ' LEU . . . -62.52 -36.49 82.75 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.38 -0.825 . . . . 0.0 110.606 -179.534 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -65.48 -36.44 83.88 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.134 -0.979 . . . . 0.0 110.128 -179.892 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.471 ' O ' ' CG ' ' A' ' 32' ' ' GLU . 28.8 mt-10 -69.1 -51.11 41.97 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.12 -0.988 . . . . 0.0 110.131 -179.876 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.523 ' CD2' ' HA ' ' A' ' 26' ' ' ALA . 2.4 pp -67.62 -33.21 74.53 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.254 -0.904 . . . . 0.0 109.779 179.387 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.529 ' HA ' ' CB ' ' A' ' 38' ' ' ALA . 10.8 tpt180 -64.71 -34.84 79.26 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.261 -0.9 . . . . 0.0 110.526 -179.846 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.4 ttp85 -93.98 -9.05 38.21 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.218 -0.926 . . . . 0.0 110.63 -179.576 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.473 ' HB3' HD13 ' A' ' 17' ' ' LEU . 8.0 mm-40 -100.13 -23.44 14.85 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.11 -0.994 . . . . 0.0 111.171 -179.313 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.53 ' CD2' ' HB3' ' A' ' 37' ' ' GLN . 0.3 OUTLIER -110.87 150.43 41.82 Favored Pre-proline 0 N--CA 1.489 1.486 0 O-C-N 120.907 -1.121 . . . . 0.0 110.3 -179.753 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.44 ' HG2' ' HB2' ' A' ' 37' ' ' GLN . 6.3 Cg_exo -47.36 144.44 9.73 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 O-C-N 124.031 1.542 . . . . 0.0 109.879 179.783 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.432 ' C ' ' O ' ' A' ' 34' ' ' PRO . 35.3 Cg_endo -38.1 -47.79 2.25 Favored 'Trans proline' 0 C--N 1.304 -1.78 0 O-C-N 124.192 1.628 . . . . 0.0 110.569 -179.72 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.409 ' OD1' ' HG2' ' A' ' 35' ' ' PRO . 2.4 m-20 -66.31 -47.02 74.9 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.24 -0.912 . . . . 0.0 111.185 -179.563 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.53 ' HB3' ' CD2' ' A' ' 33' ' ' LEU . 0.9 OUTLIER -69.82 -44.43 70.0 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.062 -1.024 . . . . 0.0 110.575 -179.42 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.529 ' CB ' ' HA ' ' A' ' 30' ' ' ARG . . . -59.16 -44.46 92.11 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.28 -0.888 . . . . 0.0 110.624 -179.534 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -66.09 -43.43 87.31 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.099 -1.001 . . . . 0.0 110.712 -179.643 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -61.31 -43.74 98.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.161 -0.962 . . . . 0.0 110.5 -179.805 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.457 ' O ' ' SD ' ' A' ' 45' ' ' MET . 79.1 m -58.09 -42.41 85.54 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.165 -0.959 . . . . 0.0 110.477 -179.771 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.45 HG12 ' HB2' ' A' ' 26' ' ' ALA . 36.4 mt -65.49 -21.82 29.88 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.14 -0.975 . . . . 0.0 110.362 -179.854 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.66 -34.5 23.02 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.18 -0.95 . . . . 0.0 110.817 -179.569 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.505 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 2.0 mmp_? -74.72 -69.45 0.46 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.107 -0.996 . . . . 0.0 110.589 -179.521 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.559 ' HE1' ' CB ' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -36.28 118.14 0.69 Allowed Pre-proline 0 N--CA 1.488 1.467 0 O-C-N 121.53 -0.731 . . . . 0.0 111.412 -179.756 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.431 ' CD ' ' HB1' ' A' ' 62' ' ' ALA . 9.3 Cg_endo . . . . . 0 C--N 1.304 -1.771 0 O-C-N 124.197 1.63 . . . . 0.0 109.342 179.117 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.358 0.599 . . . . 0.0 110.479 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 62.3 mt -124.88 159.75 30.41 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.298 -0.876 . . . . 0.0 109.613 179.499 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.437 ' C ' ' HG2' ' A' ' 45' ' ' MET . 3.7 m-20 -106.18 110.76 23.11 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.005 -1.06 . . . . 0.0 111.234 -179.52 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.638 ' CE2' ' NH2' ' A' ' 15' ' ' ARG . 39.7 p90 -81.49 -29.77 33.55 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.425 -0.797 . . . . 0.0 110.08 179.307 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.528 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.5 -36.65 66.92 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.283 -0.886 . . . . 0.0 109.522 -179.943 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.431 ' HB1' ' CD ' ' A' ' 46' ' ' PRO . . . -68.16 -35.81 78.65 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.344 -0.848 . . . . 0.0 109.862 179.539 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.507 ' O ' ' CD1' ' A' ' 63' ' ' PHE . 2.6 t80 -72.05 -31.44 66.14 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.576 -0.703 . . . . 0.0 110.303 179.66 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 20.1 m -71.43 -48.5 49.2 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.285 -0.884 . . . . 0.0 110.409 -179.704 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.43 -43.28 97.89 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.199 -0.938 . . . . 0.0 110.37 -179.779 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -61.83 -40.78 96.48 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.196 -0.94 . . . . 0.0 110.404 -179.789 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.86 -40.03 75.39 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.152 -0.968 . . . . 0.0 110.346 -179.804 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 . . . . . 0 N--CA 1.491 1.616 0 O-C-N 121.127 -0.983 . . . . 0.0 110.263 -179.995 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 2.1 tptp . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.199 0.523 . . . . 0.0 110.264 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.448 ' CE ' ' OE1' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -59.96 -51.14 70.96 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.217 -0.927 . . . . 0.0 110.153 179.942 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.8 -35.54 68.85 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.216 -0.927 . . . . 0.0 110.059 179.935 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -62.84 -42.55 99.78 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.216 -0.928 . . . . 0.0 110.207 179.932 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . 0.45 ' HA ' ' HB2' ' A' ' 13' ' ' SER . . . -67.04 -40.96 87.28 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.294 -0.879 . . . . 0.0 110.073 179.916 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 75.1 t -61.24 -44.62 98.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.204 -0.935 . . . . 0.0 109.952 179.895 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.52 -44.33 89.5 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.19 -0.943 . . . . 0.0 110.053 179.809 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 54.3 m -63.55 -43.25 97.63 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.241 -0.912 . . . . 0.0 110.085 179.858 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 76.7 t -64.22 -41.99 94.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.298 -0.876 . . . . 0.0 110.054 179.864 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 77.6 t -61.04 -44.33 98.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.272 -0.892 . . . . 0.0 110.071 179.84 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.8 -45.97 92.33 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.162 -0.961 . . . . 0.0 110.034 179.939 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.32 -45.44 87.91 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.201 -0.937 . . . . 0.0 110.087 179.826 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 66.5 t -68.04 -40.52 83.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.231 -0.918 . . . . 0.0 110.191 179.937 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -61.87 -31.5 71.78 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.345 -0.847 . . . . 0.0 110.133 179.934 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -55.82 -50.93 69.19 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.26 -0.9 . . . . 0.0 110.078 -179.995 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.87 -39.66 90.01 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.199 -0.938 . . . . 0.0 110.091 179.785 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 10.6 ttp180 . . . . . 0 N--CA 1.492 1.646 0 O-C-N 121.406 -0.809 . . . . 0.0 110.128 179.857 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 27.8 m . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.347 0.594 . . . . 0.0 109.989 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.636 ' CB ' ' CE2' ' A' ' 68' ' ' TYR . . . -66.52 -45.78 78.39 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.282 -0.886 . . . . 0.0 109.793 179.644 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -54.69 -36.48 64.7 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.358 -0.838 . . . . 0.0 109.758 179.552 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -61.56 -40.08 93.44 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.34 -0.85 . . . . 0.0 110.047 179.995 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.433 HG13 ' HB2' ' A' ' 64' ' ' SER . 88.3 t -58.2 -52.35 59.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.178 -0.951 . . . . 0.0 109.935 179.698 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.411 HD12 HG22 ' A' ' 11' ' ' ILE . 59.0 mt -55.47 -49.49 72.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.254 -0.904 . . . . 0.0 109.49 179.612 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.83 -40.38 79.91 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.315 -0.866 . . . . 0.0 108.876 179.119 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.0 p -66.8 -37.78 85.2 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.418 -0.801 . . . . 0.0 109.122 178.941 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.489 ' CE1' ' HE3' ' A' ' 45' ' ' MET . 3.3 m-85 -68.27 -43.66 77.28 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.317 -0.864 . . . . 0.0 109.706 179.363 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -53.35 -47.99 68.92 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.327 -0.858 . . . . 0.0 109.389 179.515 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.443 ' CG2' ' HA ' ' B' ' 9' ' ' LYS . 71.3 mt -59.09 -42.36 86.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.403 -0.811 . . . . 0.0 109.607 179.281 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.49 ' CD1' ' HB3' ' A' ' 32' ' ' GLU . 2.6 mm? -64.79 -39.13 93.09 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.414 -0.804 . . . . 0.0 109.982 179.727 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.45 ' O ' ' HG3' ' A' ' 21' ' ' LYS . . . -82.95 10.58 7.59 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.319 -0.863 . . . . 0.0 110.249 -179.974 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 61.46 56.35 2.61 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.311 -0.868 . . . . 0.0 110.239 -179.948 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.6 t0 56.85 59.31 3.56 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.225 -0.922 . . . . 0.0 110.225 179.925 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.45 ' HG3' ' O ' ' A' ' 18' ' ' ALA . 18.8 mttm -140.62 144.34 35.96 Favored Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.25 -0.906 . . . . 0.0 110.173 -179.975 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -75.03 1.06 8.17 Favored 'Trans proline' 0 C--N 1.304 -1.792 0 O-C-N 124.091 1.574 . . . . 0.0 109.998 179.562 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.455 ' O ' ' CD1' ' A' ' 23' ' ' TYR . 8.4 p90 -141.69 150.42 41.85 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.219 -0.925 . . . . 0.0 110.179 179.963 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.504 HD11 HG22 ' A' ' 24' ' ' ILE . 0.4 OUTLIER -121.38 144.09 31.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.188 -0.945 . . . . 0.0 110.002 -179.973 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.524 ' CD2' ' N ' ' A' ' 25' ' ' LEU . 4.4 mm? -85.73 145.24 27.35 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.22 -0.925 . . . . 0.0 110.302 -179.894 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.63 -45.43 94.11 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.279 -0.888 . . . . 0.0 110.181 179.894 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -61.42 -35.72 78.35 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.22 -0.925 . . . . 0.0 109.85 179.889 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.462 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -62.4 -47.2 85.17 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.264 -0.897 . . . . 0.0 109.075 179.329 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.458 HD22 HD13 ' A' ' 24' ' ' ILE . 41.8 mt -58.75 -33.46 70.29 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.424 -0.798 . . . . 0.0 109.229 178.971 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.518 ' HA ' ' CB ' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -65.73 -34.68 78.76 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.359 -0.838 . . . . 0.0 110.236 179.999 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -96.68 -31.93 12.44 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.086 -1.009 . . . . 0.0 110.832 -179.745 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.49 ' HB3' ' CD1' ' A' ' 17' ' ' LEU . 0.4 OUTLIER -76.02 -23.33 55.18 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.058 -1.026 . . . . 0.0 110.587 -179.726 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.433 HD21 ' CB ' ' A' ' 37' ' ' GLN . 0.2 OUTLIER -133.05 158.44 75.81 Favored Pre-proline 0 C--N 1.305 -1.334 0 O-C-N 121.096 -1.003 . . . . 0.0 110.403 -179.627 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.519 ' HG2' ' CG ' ' A' ' 37' ' ' GLN . 6.3 Cg_exo -50.58 134.02 39.12 Favored 'Trans proline' 0 C--N 1.305 -1.739 0 O-C-N 124.053 1.554 . . . . 0.0 110.056 179.769 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.42 ' C ' ' O ' ' A' ' 34' ' ' PRO . 33.9 Cg_endo -39.24 -35.23 0.66 Allowed 'Trans proline' 0 C--N 1.306 -1.701 0 O-C-N 124.133 1.596 . . . . 0.0 110.723 -179.636 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -65.31 -44.67 87.12 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.164 -0.96 . . . . 0.0 110.585 -179.73 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.519 ' CG ' ' HG2' ' A' ' 34' ' ' PRO . 28.6 mm100 -69.33 -38.11 78.03 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.157 -0.965 . . . . 0.0 110.549 -179.66 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.518 ' CB ' ' HA ' ' A' ' 30' ' ' ARG . . . -56.38 -42.55 78.06 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.212 -0.93 . . . . 0.0 110.549 -179.902 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 40.0 tt0 -64.27 -45.01 89.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.116 -0.99 . . . . 0.0 110.383 -179.759 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.09 -48.33 71.32 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.141 -0.974 . . . . 0.0 110.401 -179.86 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.445 ' O ' ' HG3' ' A' ' 45' ' ' MET . 54.8 m -65.75 -43.59 88.5 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.328 -0.857 . . . . 0.0 110.518 -179.846 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.454 ' CG1' ' O ' ' A' ' 38' ' ' ALA . 61.1 mt -60.26 -22.9 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.236 -0.915 . . . . 0.0 110.782 -179.56 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.96 -31.21 23.7 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.119 -0.988 . . . . 0.0 110.834 -179.509 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.566 ' HG3' ' CE1' ' A' ' 63' ' ' PHE . 0.2 OUTLIER -76.3 -65.15 0.96 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.224 -0.922 . . . . 0.0 110.589 -179.704 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.601 ' CE ' ' CB ' ' A' ' 60' ' ' TYR . 12.0 mtt -39.44 111.12 0.66 Allowed Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.379 -0.825 . . . . 0.0 110.863 -179.737 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo . . . . . 0 C--N 1.304 -1.775 0 O-C-N 124.018 1.536 . . . . 0.0 109.865 179.497 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.296 0.57 . . . . 0.0 110.151 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.514 ' HB3' ' CB ' ' A' ' 45' ' ' MET . 80.3 mt -104.11 155.72 18.47 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.211 -0.931 . . . . 0.0 110.266 179.974 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -98.97 111.14 23.62 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.249 -0.907 . . . . 0.0 110.546 -179.852 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.601 ' CB ' ' CE ' ' A' ' 45' ' ' MET . 31.7 p90 -76.22 -28.79 57.33 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.276 -0.89 . . . . 0.0 110.268 179.708 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.571 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.06 -41.41 75.02 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.233 -0.917 . . . . 0.0 110.135 -179.67 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.61 -35.56 81.17 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.238 -0.913 . . . . 0.0 109.791 179.823 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.566 ' CE1' ' HG3' ' A' ' 44' ' ' ARG . 1.5 t80 -72.28 -36.34 68.95 Favored 'General case' 0 C--N 1.298 -1.659 0 O-C-N 121.607 -0.683 . . . . 0.0 110.242 179.807 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.567 ' O ' ' CE2' ' A' ' 68' ' ' TYR . 2.7 p -63.67 -49.85 71.59 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.211 -0.93 . . . . 0.0 110.455 -179.683 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.574 ' HA ' ' CD2' ' A' ' 68' ' ' TYR . 43.3 m -60.11 -47.56 85.39 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.168 -0.957 . . . . 0.0 110.264 -179.869 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -55.98 -36.68 68.15 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.189 -0.944 . . . . 0.0 110.204 -179.971 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.527 ' CD2' ' O ' ' B' ' 19' ' ' ALA . 0.2 OUTLIER -54.73 -32.54 59.84 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.288 -0.882 . . . . 0.0 110.232 -179.952 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.636 ' CE2' ' CB ' ' A' ' 7' ' ' ALA . 1.5 m-85 . . . . . 0 N--CA 1.491 1.605 0 O-C-N 121.238 -0.914 . . . . 0.0 110.205 -179.692 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 1.8 pttt . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.234 0.54 . . . . 0.0 110.185 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.443 ' HA ' ' CG2' ' A' ' 16' ' ' ILE . 0.4 OUTLIER -63.26 -48.88 76.3 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.249 -0.907 . . . . 0.0 110.172 -179.99 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.34 -39.42 69.99 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.198 -0.939 . . . . 0.0 110.009 179.91 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -63.45 -39.78 95.39 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.314 -0.867 . . . . 0.0 110.14 179.836 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.28 -42.39 99.3 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.181 -0.949 . . . . 0.0 109.95 -179.985 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.424 ' O ' HG22 ' B' ' 17' ' ' VAL . 98.4 t -59.6 -40.4 82.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.164 -0.96 . . . . 0.0 109.712 179.5 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.41 -36.84 76.61 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.279 -0.888 . . . . 0.0 109.898 179.746 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 25.0 m -67.62 -42.77 81.85 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.275 -0.89 . . . . 0.0 110.14 179.914 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.463 ' O ' ' CG2' ' B' ' 20' ' ' VAL . 94.0 t -64.52 -40.42 88.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.299 -0.876 . . . . 0.0 110.28 179.968 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.424 HG22 ' O ' ' B' ' 13' ' ' VAL . 67.8 t -63.07 -50.19 80.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.295 -0.878 . . . . 0.0 110.51 -179.684 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.33 -39.89 94.81 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.2 -0.938 . . . . 0.0 110.716 -179.598 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.527 ' O ' ' CD2' ' A' ' 67' ' ' LEU . . . -67.28 -41.57 85.26 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.187 -0.946 . . . . 0.0 110.613 -179.509 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . 0.463 ' CG2' ' O ' ' B' ' 16' ' ' VAL . 63.7 t -67.45 -39.0 81.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.23 -0.919 . . . . 0.0 110.681 -179.526 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.02 -33.01 75.03 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.234 -0.916 . . . . 0.0 110.495 -179.744 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -56.3 -45.52 80.2 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.261 -0.899 . . . . 0.0 110.459 -179.702 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.87 -38.4 88.7 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.196 -0.94 . . . . 0.0 110.422 -179.768 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 8.4 ttt-85 . . . . . 0 N--CA 1.492 1.669 0 O-C-N 121.193 -0.942 . . . . 0.0 110.21 -179.867 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.29 0.567 . . . . 0.0 110.128 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -66.59 -44.51 81.98 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.279 -0.888 . . . . 0.0 109.703 179.627 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -55.74 -36.92 67.8 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.314 -0.866 . . . . 0.0 109.702 179.618 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.42 ' O ' ' OG ' ' A' ' 13' ' ' SER . 2.9 tt0 -62.12 -48.33 80.64 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.261 -0.899 . . . . 0.0 110.08 179.957 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 73.1 t -59.86 -46.83 93.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.159 -0.963 . . . . 0.0 109.89 179.864 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 79.0 mt -56.92 -48.34 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.366 -0.834 . . . . 0.0 109.607 179.586 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.428 ' O ' HG13 ' A' ' 16' ' ' ILE . . . -57.49 -39.55 76.7 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.316 -0.865 . . . . 0.0 109.095 179.172 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.457 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 1.1 m -68.79 -39.06 80.33 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.481 -0.762 . . . . 0.0 109.124 178.955 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.578 ' CE1' ' HE2' ' A' ' 45' ' ' MET . 4.9 m-85 -68.55 -45.24 72.68 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.43 -0.794 . . . . 0.0 109.793 179.425 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.3 ttt-85 -53.02 -41.09 64.36 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.299 -0.876 . . . . 0.0 109.495 179.496 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.532 HG22 HD11 ' A' ' 16' ' ' ILE . 42.0 mt -63.47 -43.79 98.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.272 -0.892 . . . . 0.0 109.985 179.723 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 13' ' ' SER . 75.8 mt -62.98 -41.71 99.63 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.109 -0.995 . . . . 0.0 109.691 179.561 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.466 ' HB2' ' O ' ' A' ' 23' ' ' TYR . . . -75.77 1.14 15.6 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.342 -0.849 . . . . 0.0 110.132 179.757 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.463 ' O ' ' CB ' ' A' ' 20' ' ' ASP . 0.1 OUTLIER 66.69 55.16 0.79 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.177 -0.952 . . . . 0.0 110.099 -179.897 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.463 ' CB ' ' O ' ' A' ' 19' ' ' SER . 13.6 t0 65.82 65.02 0.54 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.241 -0.912 . . . . 0.0 110.14 -179.97 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.402 ' HG2' ' O ' ' A' ' 20' ' ' ASP . 26.8 mttt -148.79 143.76 17.52 Favored Pre-proline 0 N--CA 1.49 1.537 0 O-C-N 121.255 -0.903 . . . . 0.0 110.145 -179.968 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.546 ' O ' ' CD1' ' A' ' 23' ' ' TYR . 11.3 Cg_endo -73.32 -0.73 9.6 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 O-C-N 124.083 1.57 . . . . 0.0 110.068 179.495 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.546 ' CD1' ' O ' ' A' ' 22' ' ' PRO . 25.9 m-85 -139.98 158.85 43.41 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.247 -0.908 . . . . 0.0 109.842 179.863 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.523 ' CG2' HD12 ' A' ' 58' ' ' LEU . 0.4 OUTLIER -124.39 150.77 29.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.115 -0.991 . . . . 0.0 109.942 179.984 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.515 ' N ' HD11 ' A' ' 24' ' ' ILE . 15.6 mt -92.74 145.61 24.28 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.067 -1.021 . . . . 0.0 110.26 -179.842 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.45 -45.39 80.84 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.221 -0.924 . . . . 0.0 110.278 -179.862 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -61.14 -35.7 77.79 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.208 -0.932 . . . . 0.0 109.917 179.871 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 25' ' ' LEU . 21.9 mm-40 -60.15 -45.2 93.86 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.344 -0.847 . . . . 0.0 109.796 179.795 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 26.2 mt -63.15 -34.27 77.26 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.359 -0.838 . . . . 0.0 109.827 179.68 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.497 ' HA ' ' CB ' ' A' ' 38' ' ' ALA . 24.3 mtt-85 -68.88 -38.26 79.58 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.356 -0.84 . . . . 0.0 110.219 -179.927 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.5 -26.24 18.04 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.291 -0.881 . . . . 0.0 110.831 -179.568 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -89.88 -23.74 21.56 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.098 -1.001 . . . . 0.0 110.658 -179.69 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.559 ' CD2' ' CG2' ' B' ' 17' ' ' VAL . 1.3 mt -128.73 155.85 78.53 Favored Pre-proline 0 N--CA 1.488 1.451 0 O-C-N 121.19 -0.944 . . . . 0.0 110.056 -179.797 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.457 ' HD2' ' CD2' ' A' ' 33' ' ' LEU . 47.9 Cg_exo -52.56 144.4 41.86 Favored 'Trans proline' 0 C--N 1.304 -1.793 0 O-C-N 124.009 1.531 . . . . 0.0 110.302 179.972 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -41.87 -45.13 6.92 Favored 'Trans proline' 0 C--N 1.305 -1.744 0 O-C-N 124.003 1.528 . . . . 0.0 110.589 -179.842 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -58.36 -43.66 88.49 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.196 -0.94 . . . . 0.0 110.434 -179.771 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.525 ' CB ' HD21 ' A' ' 33' ' ' LEU . 75.3 mm-40 -68.97 -40.75 78.65 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.213 -0.929 . . . . 0.0 110.16 -179.959 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.497 ' CB ' ' HA ' ' A' ' 30' ' ' ARG . . . -56.54 -47.13 80.08 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.299 -0.876 . . . . 0.0 110.39 -179.956 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.2 tp60 -65.85 -46.72 77.43 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.159 -0.963 . . . . 0.0 110.252 -179.858 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -64.04 -48.01 77.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.28 -0.887 . . . . 0.0 110.209 -179.96 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.419 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 77.5 m -65.13 -47.7 76.19 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.219 -0.926 . . . . 0.0 110.159 -179.946 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 54.5 mt -58.34 -23.49 22.34 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.255 -0.903 . . . . 0.0 110.234 179.935 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.48 -41.31 16.7 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.242 -0.912 . . . . 0.0 110.33 -179.809 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.63 ' CB ' ' CD2' ' A' ' 63' ' ' PHE . 1.0 OUTLIER -64.11 -73.93 0.11 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.109 -0.994 . . . . 0.0 109.975 -179.916 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.606 ' CG ' ' HA ' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -38.47 117.21 0.96 Allowed Pre-proline 0 N--CA 1.488 1.427 0 O-C-N 121.382 -0.824 . . . . 0.0 111.473 179.847 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_endo . . . . . 0 C--N 1.302 -1.871 0 O-C-N 123.829 1.436 . . . . 0.0 108.51 178.33 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.348 0.594 . . . . 0.0 110.207 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.523 HD12 ' CG2' ' A' ' 24' ' ' ILE . 0.6 OUTLIER -114.89 160.87 19.0 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.318 -0.864 . . . . 0.0 110.131 179.874 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -99.47 115.86 30.27 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.306 -0.871 . . . . 0.0 111.45 -179.17 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.606 ' HA ' ' CG ' ' A' ' 45' ' ' MET . 9.1 p90 -78.43 -21.66 48.87 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.429 -0.794 . . . . 0.0 110.145 179.114 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.564 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.85 -33.11 64.23 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.212 -0.93 . . . . 0.0 109.753 179.973 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.434 ' O ' ' CB ' ' A' ' 66' ' ' ALA . . . -65.2 -32.36 74.0 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.284 -0.885 . . . . 0.0 109.486 179.451 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.63 ' CD2' ' CB ' ' A' ' 44' ' ' ARG . 5.9 t80 -65.89 -41.94 90.92 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.742 -0.599 . . . . 0.0 110.223 179.884 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 70.1 p -68.52 -49.58 58.54 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.269 -0.895 . . . . 0.0 110.37 -179.854 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.9 m -68.51 -35.5 77.58 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.273 -0.892 . . . . 0.0 110.381 -179.881 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.434 ' CB ' ' O ' ' A' ' 62' ' ' ALA . . . -67.08 -44.01 81.14 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.241 -0.912 . . . . 0.0 110.386 -179.838 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.472 ' N ' HD21 ' A' ' 67' ' ' LEU . 3.6 mm? -68.39 -41.93 79.81 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.179 -0.951 . . . . 0.0 110.633 -179.745 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 . . . . . 0 N--CA 1.491 1.588 0 O-C-N 121.068 -1.02 . . . . 0.0 110.56 -179.759 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 4.0 tptp . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.266 0.555 . . . . 0.0 110.16 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 7.7 ttmt -66.87 -37.51 84.56 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.251 -0.906 . . . . 0.0 110.184 179.993 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.65 -37.24 80.85 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.249 -0.907 . . . . 0.0 110.09 179.855 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -66.02 -41.77 90.52 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.295 -0.878 . . . . 0.0 109.97 179.895 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . 0.438 ' HB1' HD13 ' A' ' 16' ' ' ILE . . . -65.59 -40.03 92.24 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.402 -0.811 . . . . 0.0 109.958 179.752 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 57.5 t -59.72 -44.83 94.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.352 -0.843 . . . . 0.0 110.077 179.751 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.62 -39.23 93.14 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.147 -0.971 . . . . 0.0 109.946 179.875 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.71 -47.61 80.41 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.357 -0.839 . . . . 0.0 110.07 179.864 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 58.8 t -63.65 -45.51 97.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.285 -0.884 . . . . 0.0 110.028 179.884 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.559 ' CG2' ' CD2' ' A' ' 33' ' ' LEU . 24.2 t -60.74 -50.87 78.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.3 -0.875 . . . . 0.0 110.003 179.891 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.96 -40.91 67.24 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.271 -0.893 . . . . 0.0 110.091 179.815 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.79 -45.54 78.09 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.266 -0.896 . . . . 0.0 110.023 179.853 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 42.5 t -67.21 -43.1 88.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.287 -0.883 . . . . 0.0 110.049 179.855 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -57.3 -37.38 72.35 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.278 -0.888 . . . . 0.0 110.053 179.966 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -49.03 76.89 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.29 -0.881 . . . . 0.0 110.143 -179.987 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.04 -36.06 74.38 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.221 -0.924 . . . . 0.0 110.11 -179.927 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.534 0 O-C-N 121.319 -0.863 . . . . 0.0 110.08 179.849 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.512 ' CG2' ' CZ ' ' A' ' 68' ' ' TYR . 2.5 m . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.231 0.538 . . . . 0.0 110.304 . . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.38 -47.4 76.5 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.239 -0.913 . . . . 0.0 109.867 179.896 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -56.02 -35.54 66.95 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.402 -0.811 . . . . 0.0 109.993 179.626 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 16.7 tp60 -60.62 -38.94 86.4 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.191 -0.943 . . . . 0.0 109.841 -179.931 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.564 HG11 ' CD2' ' A' ' 14' ' ' PHE . 53.9 t -61.16 -41.03 87.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.162 -0.961 . . . . 0.0 109.192 179.242 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 11.9 mm -55.26 -49.78 69.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.351 -0.843 . . . . 0.0 109.615 179.452 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.83 -43.61 94.48 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.362 -0.836 . . . . 0.0 109.324 179.331 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.7 m -66.69 -40.56 88.57 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.383 -0.823 . . . . 0.0 109.314 179.215 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.565 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 1.2 m-85 -68.38 -40.92 81.24 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.333 -0.855 . . . . 0.0 109.587 179.323 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.08 -50.19 64.9 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.362 -0.836 . . . . 0.0 109.561 179.538 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.434 HG23 ' HA ' ' B' ' 9' ' ' LYS . 68.1 mt -60.06 -40.88 84.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.295 -0.878 . . . . 0.0 109.711 179.424 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.06 -36.2 83.6 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.396 -0.815 . . . . 0.0 109.894 179.684 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.474 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -89.67 8.22 32.66 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.344 -0.847 . . . . 0.0 110.172 -179.912 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.474 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.4 OUTLIER 67.75 55.66 0.59 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.196 -0.94 . . . . 0.0 110.254 179.991 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.425 ' N ' ' OD1' ' A' ' 20' ' ' ASP . 5.8 m-20 52.28 56.67 7.39 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.285 -0.884 . . . . 0.0 110.397 179.733 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.436 ' HG3' ' O ' ' A' ' 19' ' ' SER . 68.2 mttt -138.52 140.39 27.76 Favored Pre-proline 0 N--CA 1.49 1.551 0 O-C-N 121.19 -0.944 . . . . 0.0 109.951 179.777 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.61 -11.76 18.48 Favored 'Trans proline' 0 C--N 1.305 -1.749 0 O-C-N 124.051 1.553 . . . . 0.0 110.11 179.901 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.427 ' O ' ' HB2' ' A' ' 18' ' ' ALA . 47.8 p90 -135.46 171.25 14.71 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.264 -0.897 . . . . 0.0 110.05 179.805 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.454 ' HB ' ' HB2' ' A' ' 18' ' ' ALA . 8.9 tt -146.72 158.01 10.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.231 -0.918 . . . . 0.0 110.241 -179.917 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.5 mp -91.25 145.14 24.91 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.226 -0.921 . . . . 0.0 110.197 -179.939 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.522 ' HA ' ' CD2' ' A' ' 29' ' ' LEU . . . -59.7 -39.52 84.86 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.303 -0.873 . . . . 0.0 110.328 -179.955 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.73 -35.88 81.14 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.183 -0.948 . . . . 0.0 109.921 179.742 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -69.61 -51.17 37.52 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.338 -0.851 . . . . 0.0 109.554 179.65 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.522 ' CD2' ' HA ' ' A' ' 26' ' ' ALA . 1.7 pp -67.75 -33.53 75.04 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.31 -0.869 . . . . 0.0 109.595 179.192 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.532 ' HA ' ' CB ' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -62.89 -34.47 77.48 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.352 -0.842 . . . . 0.0 110.132 179.79 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -83.68 -31.38 26.16 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.252 -0.905 . . . . 0.0 110.173 179.93 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -76.4 -23.6 54.03 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.266 -0.896 . . . . 0.0 110.287 -179.944 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.542 ' CD2' ' HB3' ' A' ' 37' ' ' GLN . 1.4 mt -112.92 151.3 43.96 Favored Pre-proline 0 C--N 1.305 -1.357 0 O-C-N 121.197 -0.939 . . . . 0.0 110.061 -179.929 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.457 ' CB ' ' HD2' ' A' ' 35' ' ' PRO . 35.2 Cg_exo -55.0 172.28 0.39 Allowed 'Trans proline' 0 C--N 1.304 -1.815 0 O-C-N 124.033 1.544 . . . . 0.0 110.232 179.946 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.457 ' HD2' ' CB ' ' A' ' 34' ' ' PRO . 30.8 Cg_endo -59.02 -45.8 26.14 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 123.952 1.501 . . . . 0.0 110.311 -179.83 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -66.3 -43.02 87.45 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.323 -0.861 . . . . 0.0 110.77 -179.807 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.542 ' HB3' ' CD2' ' A' ' 33' ' ' LEU . 4.1 mp0 -69.63 -42.64 74.05 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.156 -0.965 . . . . 0.0 110.381 -179.616 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.532 ' CB ' ' HA ' ' A' ' 30' ' ' ARG . . . -57.26 -48.66 78.29 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.297 -0.877 . . . . 0.0 110.36 -179.726 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 14.2 tm0? -66.82 -43.32 84.06 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.261 -0.899 . . . . 0.0 110.777 -179.78 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -64.91 -42.32 94.82 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.104 -0.997 . . . . 0.0 110.503 -179.521 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.481 ' O ' ' HG2' ' A' ' 45' ' ' MET . 73.6 m -65.22 -51.32 61.68 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.111 -0.993 . . . . 0.0 110.709 -179.687 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.411 HG13 HD12 ' A' ' 29' ' ' LEU . 50.6 mt -53.72 -23.6 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.181 -0.95 . . . . 0.0 110.757 -179.588 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.36 -19.14 31.89 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.117 -0.989 . . . . 0.0 110.649 -179.65 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.594 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 18.4 mmt180 -89.56 -69.99 0.69 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.228 -0.92 . . . . 0.0 110.834 -179.495 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.517 ' CB ' ' O ' ' A' ' 59' ' ' ASP . 9.4 ptp -46.89 110.02 1.18 Allowed Pre-proline 0 N--CA 1.488 1.464 0 O-C-N 121.136 -0.978 . . . . 0.0 110.639 -179.408 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.526 ' HD2' ' CB ' ' A' ' 62' ' ' ALA . 9.6 Cg_endo . . . . . 0 C--N 1.307 -1.622 0 O-C-N 124.132 1.596 . . . . 0.0 110.184 179.882 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.714 0 CA-C-O 121.388 0.614 . . . . 0.0 110.575 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.3 mt -129.88 160.39 33.67 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.374 -0.829 . . . . 0.0 109.81 179.582 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.517 ' O ' ' CB ' ' A' ' 45' ' ' MET . 1.3 t70 -110.39 110.76 21.66 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.063 -1.023 . . . . 0.0 110.673 -179.789 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.565 ' HB2' ' CD2' ' A' ' 14' ' ' PHE . 40.6 p90 -75.86 -24.24 55.73 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.211 -0.931 . . . . 0.0 109.33 179.231 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.404 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -62.54 -44.4 96.45 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.469 -0.769 . . . . 0.0 109.617 179.67 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.526 ' CB ' ' HD2' ' A' ' 46' ' ' PRO . . . -61.56 -32.81 72.91 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.254 -0.904 . . . . 0.0 109.917 179.682 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.594 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 1.2 t80 -71.4 -39.78 70.94 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.52 -0.737 . . . . 0.0 110.241 179.881 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.466 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 3.6 t -61.05 -50.1 74.7 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.264 -0.898 . . . . 0.0 110.609 -179.69 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.43 -35.3 77.41 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.216 -0.928 . . . . 0.0 110.447 -179.783 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.0 -46.3 68.35 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.208 -0.933 . . . . 0.0 110.786 -179.542 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.564 HD13 ' CG ' ' A' ' 68' ' ' TYR . 2.5 pp -70.84 -33.01 70.21 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.097 -1.002 . . . . 0.0 110.752 -179.477 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.564 ' CG ' HD13 ' A' ' 67' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.26 -0.9 . . . . 0.0 110.391 179.975 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 121.24 0.543 . . . . 0.0 110.139 . . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.434 ' HA ' HG23 ' A' ' 16' ' ' ILE . 1.5 tttp -62.26 -48.84 78.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.244 -0.91 . . . . 0.0 110.089 179.892 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.67 -45.55 77.71 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.329 -0.857 . . . . 0.0 110.213 179.881 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -63.45 -41.13 98.65 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.317 -0.864 . . . . 0.0 110.068 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.25 -33.7 76.07 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.309 -0.869 . . . . 0.0 110.167 -179.965 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 58.6 t -64.36 -41.96 93.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.278 -0.889 . . . . 0.0 110.093 -179.973 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.04 -35.65 79.23 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.228 -0.92 . . . . 0.0 110.415 -179.974 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 28.7 m -62.31 -44.01 97.5 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.175 -0.953 . . . . 0.0 110.522 -179.862 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 84.2 t -68.74 -42.54 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.201 -0.937 . . . . 0.0 110.578 -179.728 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 89.9 t -58.28 -44.83 88.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.098 -1.001 . . . . 0.0 110.503 -179.86 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.91 -38.49 91.27 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.316 -0.865 . . . . 0.0 110.285 -179.823 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.99 -46.06 82.99 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.169 -0.957 . . . . 0.0 110.39 -179.935 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 76.1 t -65.45 -42.33 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.239 -0.913 . . . . 0.0 110.309 -179.86 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -58.48 -41.62 85.68 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.25 -0.906 . . . . 0.0 110.202 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 3.5 tm0? -60.49 -47.84 84.38 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.219 -0.925 . . . . 0.0 110.005 -179.944 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.88 -35.09 80.01 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.296 -0.877 . . . . 0.0 110.195 179.875 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . 0.449 ' NH1' ' HG2' ' B' ' 24' ' ' ARG . 17.8 ttp85 . . . . . 0 N--CA 1.492 1.669 0 O-C-N 121.233 -0.917 . . . . 0.0 110.456 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.239 0.542 . . . . 0.0 110.207 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -76.91 0.42 21.03 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.238 -0.914 . . . . 0.0 110.214 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -152.0 149.93 29.42 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.262 -0.899 . . . . 0.0 110.172 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.407 ' O ' ' CB ' ' A' ' 5' ' ' ASP . 1.0 OUTLIER -164.84 124.9 1.94 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.171 -0.956 . . . . 0.0 110.264 -179.959 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.511 ' O ' ' N ' ' A' ' 7' ' ' ALA . 0.1 OUTLIER 175.46 33.81 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.236 -0.915 . . . . 0.0 110.176 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.529 HG21 ' CZ ' ' A' ' 68' ' ' TYR . 1.6 m 63.16 -71.58 0.05 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.251 -0.906 . . . . 0.0 110.107 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.511 ' N ' ' O ' ' A' ' 5' ' ' ASP . . . -70.28 -44.23 68.81 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.074 -1.017 . . . . 0.0 109.476 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -62.02 -36.09 80.51 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.471 -0.768 . . . . 0.0 109.906 179.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -60.79 -43.08 98.58 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.33 -0.856 . . . . 0.0 110.097 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 62.0 t -66.06 -42.81 92.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.116 -0.99 . . . . 0.0 109.631 179.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 61.9 mt -61.45 -49.67 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.298 -0.876 . . . . 0.0 109.318 179.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.65 -39.09 92.79 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.377 -0.827 . . . . 0.0 109.228 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.2 m -68.18 -44.18 76.47 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.41 -0.806 . . . . 0.0 109.479 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.556 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 0.6 OUTLIER -65.7 -42.59 91.01 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.307 -0.87 . . . . 0.0 109.497 179.386 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.19 -42.91 70.22 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.343 -0.848 . . . . 0.0 109.416 179.308 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.435 HD11 HG23 ' A' ' 16' ' ' ILE . 17.0 mt -60.55 -44.85 97.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.35 -0.843 . . . . 0.0 109.583 179.509 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.527 ' CD1' ' HB3' ' A' ' 32' ' ' GLU . 2.5 mm? -65.09 -40.67 94.94 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.359 -0.838 . . . . 0.0 109.966 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.478 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -75.51 1.3 14.53 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.298 -0.876 . . . . 0.0 110.311 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.478 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.1 OUTLIER 67.0 69.18 0.4 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.209 -0.932 . . . . 0.0 110.303 179.866 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 47.04 56.21 7.07 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.243 -0.911 . . . . 0.0 110.28 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.516 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 18.5 mttp -134.34 143.49 47.12 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.16 -0.963 . . . . 0.0 110.023 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -73.83 -0.05 8.91 Favored 'Trans proline' 0 C--N 1.304 -1.815 0 O-C-N 124.04 1.547 . . . . 0.0 110.122 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.516 ' CZ ' ' HD3' ' A' ' 21' ' ' LYS . 23.1 p90 -145.94 163.18 35.96 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.237 -0.914 . . . . 0.0 110.22 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.472 HD13 ' HB3' ' A' ' 28' ' ' GLU . 0.3 OUTLIER -127.07 142.14 44.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.301 -0.874 . . . . 0.0 109.735 179.89 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 44.1 mt -88.59 152.26 21.95 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.242 -0.911 . . . . 0.0 110.352 -179.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.26 -44.32 95.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.36 -0.837 . . . . 0.0 110.069 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -60.19 -34.97 74.35 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.365 -0.834 . . . . 0.0 110.242 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.472 ' HB3' HD13 ' A' ' 24' ' ' ILE . 9.0 mm-40 -61.87 -49.59 75.65 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.23 -0.919 . . . . 0.0 109.931 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.442 HD23 HG13 ' A' ' 24' ' ' ILE . 9.1 mt -59.53 -34.17 72.3 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.264 -0.898 . . . . 0.0 109.814 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.17 -42.26 93.86 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.329 -0.857 . . . . 0.0 110.174 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -91.33 -20.36 21.94 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.198 -0.938 . . . . 0.0 110.456 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.527 ' HB3' ' CD1' ' A' ' 17' ' ' LEU . 17.0 mm-40 -98.68 -23.76 15.32 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.08 -1.012 . . . . 0.0 110.409 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.448 HD21 ' HB3' ' A' ' 37' ' ' GLN . 0.3 OUTLIER -128.16 147.72 64.65 Favored Pre-proline 0 N--CA 1.487 1.393 0 O-C-N 121.165 -0.959 . . . . 0.0 110.066 179.962 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.497 ' O ' ' N ' ' A' ' 37' ' ' GLN . 5.9 Cg_exo -43.59 131.03 7.32 Favored 'Trans proline' 0 C--N 1.304 -1.782 0 O-C-N 123.89 1.469 . . . . 0.0 109.679 179.402 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.429 ' C ' ' O ' ' A' ' 34' ' ' PRO . 12.0 Cg_exo -36.8 -42.38 0.77 Allowed 'Trans proline' 0 C--N 1.306 -1.67 0 O-C-N 124.254 1.66 . . . . 0.0 110.619 -179.392 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -65.94 -36.64 83.89 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.352 -0.843 . . . . 0.0 110.857 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.497 ' N ' ' O ' ' A' ' 34' ' ' PRO . 1.8 mp0 -69.09 -44.5 72.35 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.064 -1.023 . . . . 0.0 110.784 -179.262 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.519 ' O ' ' CD1' ' A' ' 42' ' ' ILE . . . -58.66 -47.24 85.14 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.195 -0.94 . . . . 0.0 110.707 -179.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.4 tp60 -60.3 -49.43 77.63 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.227 -0.92 . . . . 0.0 110.995 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 51.6 t80 -61.84 -48.0 82.55 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.009 -1.057 . . . . 0.0 110.436 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.447 ' O ' ' SD ' ' A' ' 45' ' ' MET . 69.8 m -65.35 -49.51 69.08 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.256 -0.902 . . . . 0.0 110.64 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.519 ' CD1' ' O ' ' A' ' 38' ' ' ALA . 18.6 mt -44.45 -24.66 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.12 -0.988 . . . . 0.0 110.535 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -84.15 -41.28 17.22 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.173 -0.955 . . . . 0.0 110.743 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.519 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 1.5 mmt-85 -64.11 -72.62 0.14 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.12 -0.987 . . . . 0.0 110.59 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.468 ' CB ' ' O ' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -48.01 116.9 5.1 Favored Pre-proline 0 N--CA 1.489 1.475 0 O-C-N 121.14 -0.975 . . . . 0.0 110.394 -179.841 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -59.55 -157.58 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.728 0 O-C-N 124.14 1.6 . . . . 0.0 110.45 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.601 ' O ' ' CD1' ' A' ' 48' ' ' TYR . . . -88.8 71.13 8.71 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.311 -0.868 . . . . 0.0 110.404 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.626 ' CE2' ' CB ' ' A' ' 53' ' ' SER . 27.0 p90 32.73 -156.46 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.017 0 CA-C-O 121.375 0.607 . . . . 0.0 111.337 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.536 ' N ' ' CD2' ' A' ' 48' ' ' TYR . 0.4 OUTLIER 169.35 72.34 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.142 -0.974 . . . . 0.0 110.249 -179.751 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -134.14 177.01 19.47 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.544 -1.423 . . . . 0.0 109.544 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -81.74 -53.73 0.04 OUTLIER 'Trans proline' 0 C--N 1.304 -1.767 0 O-C-N 124.005 1.529 . . . . 0.0 110.214 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.486 ' O ' ' O ' ' A' ' 53' ' ' SER . . . -96.24 35.77 4.2 Favored Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.437 -1.465 . . . . 0.0 109.437 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.626 ' CB ' ' CE2' ' A' ' 48' ' ' TYR . 69.1 m -53.71 -162.74 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.304 0 O-C-N 121.402 -1.058 . . . . 0.0 110.717 -179.6 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.51 ' CG2' ' HB3' ' A' ' 57' ' ' ALA . 10.5 m -136.0 172.16 7.57 Favored Pre-proline 0 N--CA 1.492 1.65 0 O-C-N 121.264 -0.897 . . . . 0.0 110.137 179.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -79.51 72.79 6.34 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 124.042 1.549 . . . . 0.0 110.17 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 130.68 50.96 0.1 Allowed Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.51 ' HB3' ' CG2' ' A' ' 54' ' ' VAL . . . -108.15 158.85 17.07 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.291 -1.123 . . . . 0.0 110.194 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 25.1 mt -135.88 147.54 48.23 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.197 -0.94 . . . . 0.0 110.147 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.468 ' O ' ' CB ' ' A' ' 45' ' ' MET . 0.7 OUTLIER -103.37 111.83 24.43 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.19 -0.944 . . . . 0.0 110.291 179.916 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.556 ' HB2' ' CD2' ' A' ' 14' ' ' PHE . 8.0 p90 -81.66 -19.81 40.9 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.275 -0.89 . . . . 0.0 109.63 179.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.53 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -61.48 -40.76 95.73 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.415 -0.803 . . . . 0.0 109.853 179.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.53 -36.21 82.13 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.211 -0.931 . . . . 0.0 109.662 179.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.519 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 2.4 t80 -72.07 -34.75 68.95 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.722 -0.611 . . . . 0.0 110.18 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.3 p -60.91 -42.4 97.98 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.331 -0.856 . . . . 0.0 110.38 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 8.5 t -64.14 -36.86 85.43 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.218 -0.926 . . . . 0.0 110.486 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.455 ' HA ' ' O ' ' A' ' 69' ' ' GLY . . . -67.7 -41.0 84.28 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.211 -0.931 . . . . 0.0 110.473 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.436 HD23 ' O ' ' B' ' 19' ' ' ALA . 0.4 OUTLIER -58.5 -44.07 89.32 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.208 -0.933 . . . . 0.0 110.187 -179.911 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.529 ' CZ ' HG21 ' A' ' 6' ' ' THR . 39.4 m-85 -99.38 13.68 32.35 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.237 -0.914 . . . . 0.0 110.473 -179.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.455 ' O ' ' HA ' ' A' ' 66' ' ' ALA . . . -174.77 102.11 0.17 Allowed Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.766 -1.334 . . . . 0.0 109.766 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.445 ' O ' ' CB ' ' A' ' 71' ' ' SER . 0.1 OUTLIER -131.61 107.9 9.15 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.257 -1.143 . . . . 0.0 110.117 179.798 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.445 ' CB ' ' O ' ' A' ' 70' ' ' GLU . 0.3 OUTLIER 65.47 146.69 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.261 -0.9 . . . . 0.0 110.207 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -78.33 138.01 38.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.285 -0.884 . . . . 0.0 110.222 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.626 0 O-C-N 121.276 -0.89 . . . . 0.0 110.226 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.281 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 5.6 tttt -75.12 -43.69 51.29 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.264 -1.139 . . . . 0.0 110.072 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 14.5 tttt -67.86 -46.71 70.96 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.297 -0.877 . . . . 0.0 110.148 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.1 -41.08 71.18 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.259 -0.901 . . . . 0.0 109.816 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -60.55 -40.3 91.09 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.299 -0.876 . . . . 0.0 109.71 179.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.19 -42.12 99.28 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.425 -0.797 . . . . 0.0 110.028 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.412 ' O ' ' CG2' ' B' ' 17' ' ' VAL . 46.6 t -61.28 -40.59 86.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.212 -0.93 . . . . 0.0 109.703 179.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . 0.457 ' O ' ' HB1' ' B' ' 18' ' ' ALA . . . -58.0 -39.24 77.78 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.259 -0.901 . . . . 0.0 109.499 179.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.7 m -68.82 -47.21 66.63 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.384 -0.822 . . . . 0.0 109.576 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 26.4 t -63.46 -45.54 97.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.316 -0.865 . . . . 0.0 109.595 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.412 ' CG2' ' O ' ' B' ' 13' ' ' VAL . 49.4 t -62.45 -49.68 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.263 -0.898 . . . . 0.0 109.437 179.283 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . 0.457 ' HB1' ' O ' ' B' ' 14' ' ' ALA . . . -56.1 -43.07 77.74 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.363 -0.836 . . . . 0.0 109.924 179.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.436 ' O ' HD23 ' A' ' 67' ' ' LEU . . . -67.18 -36.75 82.45 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.278 -0.888 . . . . 0.0 109.906 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . 0.449 HG12 ' HG3' ' A' ' 37' ' ' GLN . 55.4 t -65.29 -41.43 91.39 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 121.187 -0.946 . . . . 0.0 109.713 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.3 -31.66 72.29 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.349 -0.844 . . . . 0.0 110.129 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.25 -51.23 70.84 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.232 -0.917 . . . . 0.0 110.087 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.26 -34.36 77.83 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.223 -0.923 . . . . 0.0 109.858 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.3 ttt180 -63.78 -36.46 83.96 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.405 -0.809 . . . . 0.0 110.474 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -53.61 -22.23 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 O-C-N 121.134 -0.979 . . . . 0.0 109.911 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -87.07 18.49 3.58 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.55 -0.719 . . . . 0.0 110.385 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . 0.461 ' O ' ' O ' ' B' ' 28' ' ' PRO . 0.0 OUTLIER -108.73 114.63 58.51 Favored Pre-proline 0 N--CA 1.492 1.629 0 O-C-N 121.281 -0.887 . . . . 0.0 110.049 179.88 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . 0.461 ' O ' ' O ' ' B' ' 27' ' ' GLU . 18.7 Cg_endo -54.51 -163.74 0.01 OUTLIER 'Trans proline' 0 C--N 1.303 -1.819 0 O-C-N 124.12 1.59 . . . . 0.0 110.431 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.588 0 O-C-N 121.28 -0.888 . . . . 0.0 110.325 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 38.0 tpp . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.187 0.518 . . . . 0.0 110.17 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -173.15 127.22 0.45 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.212 -0.93 . . . . 0.0 110.205 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -140.38 176.85 8.43 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.253 -0.904 . . . . 0.0 110.232 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.424 ' O ' ' OD1' ' A' ' 5' ' ' ASP . 12.7 t -81.97 -179.51 7.42 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.321 -0.862 . . . . 0.0 110.21 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.424 ' OD1' ' O ' ' A' ' 4' ' ' THR . 0.1 OUTLIER 176.6 170.36 0.47 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.251 -0.906 . . . . 0.0 110.388 179.972 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.58 ' CG2' ' CE1' ' A' ' 68' ' ' TYR . 0.6 OUTLIER -52.97 -50.3 64.4 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.379 -0.825 . . . . 0.0 110.245 -179.971 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.33 -47.45 76.48 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.287 -0.883 . . . . 0.0 109.866 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -54.59 -36.34 64.31 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.382 -0.824 . . . . 0.0 109.828 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.415 ' O ' ' OG ' ' A' ' 13' ' ' SER . 4.2 tp60 -61.63 -48.05 82.63 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.322 -0.861 . . . . 0.0 110.151 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 12.6 t -64.3 -43.08 97.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.139 -0.975 . . . . 0.0 109.9 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 30.6 mt -62.0 -48.31 89.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 121.273 -0.892 . . . . 0.0 109.621 179.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.51 -41.01 79.95 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.223 -0.923 . . . . 0.0 109.006 179.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.415 ' OG ' ' O ' ' A' ' 9' ' ' GLN . 3.7 m -68.16 -39.09 82.68 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.431 -0.793 . . . . 0.0 109.371 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.486 ' CG ' ' HB2' ' A' ' 60' ' ' TYR . 2.6 m-85 -68.58 -45.35 72.29 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.386 -0.822 . . . . 0.0 109.73 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 11.3 tpp85 -53.72 -41.18 66.74 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.345 -0.847 . . . . 0.0 109.55 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 42.5 mt -62.37 -44.54 99.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.401 -0.812 . . . . 0.0 109.922 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 56.8 mt -64.84 -41.75 95.48 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.344 -0.848 . . . . 0.0 109.861 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.454 ' O ' ' HE3' ' A' ' 21' ' ' LYS . . . -67.86 -7.88 31.74 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.304 -0.872 . . . . 0.0 110.106 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.8 t 62.43 68.79 0.64 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.268 -0.895 . . . . 0.0 110.302 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 58.36 53.79 6.12 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.245 -0.909 . . . . 0.0 110.189 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.454 ' HE3' ' O ' ' A' ' 18' ' ' ALA . 18.8 mtmt -141.9 143.36 28.23 Favored Pre-proline 0 N--CA 1.489 1.51 0 O-C-N 121.209 -0.932 . . . . 0.0 110.078 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -78.58 5.39 5.59 Favored 'Trans proline' 0 C--N 1.304 -1.787 0 O-C-N 124.078 1.568 . . . . 0.0 109.96 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.475 ' N ' ' CD1' ' A' ' 23' ' ' TYR . 28.9 p90 -145.3 159.83 42.43 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.279 -0.888 . . . . 0.0 109.963 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.541 ' CD1' ' CD2' ' A' ' 29' ' ' LEU . 0.3 OUTLIER -126.71 143.21 40.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.154 -0.966 . . . . 0.0 109.882 179.816 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -100.66 150.64 22.53 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.29 -0.881 . . . . 0.0 110.407 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.0 -33.12 66.83 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.283 -0.886 . . . . 0.0 109.74 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -61.53 -40.07 93.32 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.335 -0.853 . . . . 0.0 109.67 179.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.441 ' HB3' HD13 ' A' ' 24' ' ' ILE . 0.6 OUTLIER -68.56 -48.44 64.27 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.389 -0.819 . . . . 0.0 109.794 179.568 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.541 ' CD2' ' CD1' ' A' ' 24' ' ' ILE . 4.3 mm? -60.78 -34.24 74.2 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.198 -0.939 . . . . 0.0 109.738 179.612 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.0 mmm-85 -68.96 -34.72 75.8 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.36 -0.837 . . . . 0.0 110.109 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.64 -14.6 27.92 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.344 -0.847 . . . . 0.0 110.579 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -106.7 -23.53 12.4 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.078 -1.014 . . . . 0.0 110.693 -179.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.459 HD21 ' CD ' ' A' ' 34' ' ' PRO . 6.4 mt -122.61 164.6 25.6 Favored Pre-proline 0 N--CA 1.488 1.431 0 O-C-N 121.073 -1.017 . . . . 0.0 110.249 -179.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.459 ' CD ' HD21 ' A' ' 33' ' ' LEU . 33.8 Cg_exo -66.11 144.81 76.95 Favored 'Trans proline' 0 C--N 1.305 -1.761 0 O-C-N 124.036 1.545 . . . . 0.0 109.908 179.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.433 ' C ' ' O ' ' A' ' 34' ' ' PRO . 19.4 Cg_endo -40.48 -44.96 4.44 Favored 'Trans proline' 0 C--N 1.304 -1.802 0 O-C-N 124.032 1.543 . . . . 0.0 110.414 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.72 -37.49 86.57 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.244 -0.91 . . . . 0.0 110.729 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.45 ' O ' ' SG ' ' A' ' 41' ' ' CYS . 0.0 OUTLIER -69.26 -45.83 68.76 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.137 -0.977 . . . . 0.0 110.554 -179.579 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.55 -44.21 96.39 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.156 -0.965 . . . . 0.0 110.582 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.9 tp60 -66.1 -46.53 77.3 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.096 -1.003 . . . . 0.0 110.473 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -63.28 -45.99 88.87 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.239 -0.913 . . . . 0.0 110.342 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.45 ' SG ' ' O ' ' A' ' 37' ' ' GLN . 74.9 m -60.93 -44.34 97.34 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.253 -0.904 . . . . 0.0 110.54 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 25.5 mt -53.88 -24.2 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.2 -0.937 . . . . 0.0 110.305 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.9 tttm -81.06 -19.43 43.79 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.127 -0.983 . . . . 0.0 110.227 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.576 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 26.4 mmt180 -92.24 -68.5 0.79 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.277 -0.889 . . . . 0.0 110.304 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.454 ' HE2' ' HA ' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -55.55 109.6 1.73 Allowed Pre-proline 0 N--CA 1.489 1.489 0 O-C-N 121.186 -0.946 . . . . 0.0 110.324 179.907 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.425 ' HD3' ' O ' ' A' ' 44' ' ' ARG . 19.7 Cg_exo -66.63 -159.11 0.04 OUTLIER 'Trans proline' 0 C--N 1.304 -1.791 0 O-C-N 124.076 1.566 . . . . 0.0 110.217 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.27 152.8 43.79 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.27 -0.894 . . . . 0.0 110.42 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.622 ' CE2' ' HB2' ' A' ' 53' ' ' SER . 0.0 OUTLIER -58.68 -177.93 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.351 -0.843 . . . . 0.0 110.735 179.962 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 89.7 p -157.89 39.7 0.27 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.234 -0.916 . . . . 0.0 110.347 -179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -91.08 -162.93 38.49 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.424 -1.47 . . . . 0.0 109.424 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo -93.49 -50.24 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.736 0 O-C-N 124.069 1.563 . . . . 0.0 110.061 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.523 ' O ' ' C ' ' A' ' 53' ' ' SER . . . -112.96 -42.26 0.94 Allowed Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.622 ' HB2' ' CE2' ' A' ' 48' ' ' TYR . 0.7 OUTLIER 25.98 -143.25 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.311 0 CA-C-O 121.518 0.675 . . . . 0.0 111.642 179.537 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.44 ' CG1' ' C ' ' A' ' 53' ' ' SER . 24.5 m -153.32 157.22 32.88 Favored Pre-proline 0 C--N 1.294 -1.814 0 O-C-N 121.491 -0.755 . . . . 0.0 110.567 -179.661 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -68.18 123.51 10.69 Favored 'Trans proline' 0 C--N 1.306 -1.683 0 O-C-N 124.152 1.607 . . . . 0.0 110.223 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 111.02 -20.5 23.91 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.22 140.45 58.74 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.31 -1.112 . . . . 0.0 110.284 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.1 mt -121.66 160.15 25.05 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.24 -0.912 . . . . 0.0 110.015 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.451 ' O ' ' HB2' ' A' ' 45' ' ' MET . 6.2 t0 -97.6 111.61 23.81 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.252 -0.905 . . . . 0.0 110.349 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.605 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 11.2 p90 -79.6 -23.42 42.69 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.27 -0.894 . . . . 0.0 109.279 179.354 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.605 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -60.01 -42.96 95.41 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.395 -0.816 . . . . 0.0 109.657 179.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.79 -32.83 72.16 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.247 -0.908 . . . . 0.0 109.868 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.576 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 1.3 t80 -71.63 -36.77 70.86 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.687 -0.633 . . . . 0.0 110.372 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.2 m -61.47 -38.89 88.89 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.147 -0.971 . . . . 0.0 110.457 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.455 ' O ' ' O ' ' A' ' 69' ' ' GLY . 44.8 p -68.37 -42.36 79.26 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.205 -0.934 . . . . 0.0 110.418 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -63.65 -38.11 89.87 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.216 -0.928 . . . . 0.0 110.619 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.77 -42.3 88.65 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.146 -0.971 . . . . 0.0 110.529 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.58 ' CE1' ' CG2' ' A' ' 6' ' ' THR . 28.3 m-85 -97.78 -34.23 10.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.181 -0.949 . . . . 0.0 110.431 -179.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.455 ' O ' ' O ' ' A' ' 65' ' ' SER . . . 133.66 -124.54 3.68 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' A' ' 70' ' ' GLU . 36.3 tt0 50.72 60.19 4.05 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.199 -1.177 . . . . 0.0 110.198 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.0 t -145.23 114.34 6.99 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.212 -0.93 . . . . 0.0 110.179 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -84.03 127.17 33.7 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.213 -0.929 . . . . 0.0 110.239 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.2 mp . . . . . 0 N--CA 1.491 1.62 0 O-C-N 121.241 -0.912 . . . . 0.0 110.24 -179.942 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.47 -52.6 60.71 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.242 -1.152 . . . . 0.0 110.176 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.95 -48.49 71.16 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.276 -0.89 . . . . 0.0 110.035 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.15 -37.43 66.95 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.28 -0.887 . . . . 0.0 109.883 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -66.23 -40.2 90.09 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.274 -0.891 . . . . 0.0 109.804 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.42 -43.78 98.01 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.259 -0.901 . . . . 0.0 109.649 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 76.6 t -58.78 -40.34 79.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.193 -0.942 . . . . 0.0 109.485 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.06 -38.85 92.82 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.46 -0.775 . . . . 0.0 109.966 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 57.2 m -69.12 -45.53 69.95 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.396 -0.815 . . . . 0.0 110.172 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 70.3 t -62.47 -46.95 95.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.214 -0.928 . . . . 0.0 109.983 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.439 HG21 HD22 ' A' ' 33' ' ' LEU . 77.3 t -60.56 -49.15 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.182 -0.949 . . . . 0.0 110.009 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.5 -39.39 76.38 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.303 -0.873 . . . . 0.0 110.107 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.86 -45.39 78.32 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.309 -0.869 . . . . 0.0 110.116 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 53.3 t -61.85 -41.68 91.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.306 -0.871 . . . . 0.0 110.132 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.07 -38.51 91.48 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.299 -0.875 . . . . 0.0 110.169 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -55.83 -41.35 74.14 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.193 -0.942 . . . . 0.0 110.295 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.5 -42.53 95.76 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.214 -0.929 . . . . 0.0 110.282 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.2 mmm-85 -70.39 -49.12 52.34 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.3 -0.875 . . . . 0.0 110.317 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 3.5 p -66.86 -24.86 33.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.35 -0.844 . . . . 0.0 110.532 -179.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 20.8 ttt-85 60.58 66.42 0.93 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.471 -0.768 . . . . 0.0 110.215 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -106.44 130.93 22.17 Favored Pre-proline 0 N--CA 1.493 1.682 0 O-C-N 121.198 -0.939 . . . . 0.0 110.249 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -80.06 163.54 22.82 Favored 'Trans proline' 0 C--N 1.307 -1.638 0 O-C-N 124.046 1.55 . . . . 0.0 110.369 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.565 0 O-C-N 121.188 -0.945 . . . . 0.0 110.175 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.203 0.525 . . . . 0.0 110.186 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 57.28 175.95 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.284 -0.885 . . . . 0.0 110.175 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.432 ' HB3' ' OE2' ' A' ' 8' ' ' GLU . 0.1 OUTLIER -178.62 150.94 0.55 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.187 -0.946 . . . . 0.0 110.284 179.992 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.432 ' O ' ' CB ' ' A' ' 5' ' ' ASP . 4.9 t -169.99 150.64 3.85 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.222 -0.924 . . . . 0.0 110.138 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.432 ' CB ' ' O ' ' A' ' 4' ' ' THR . 0.1 OUTLIER 173.58 -179.72 0.09 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.188 -0.945 . . . . 0.0 110.276 -179.943 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.443 ' HB ' ' CZ ' ' A' ' 68' ' ' TYR . 9.5 p -67.89 -61.54 1.82 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.304 -0.873 . . . . 0.0 110.1 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.02 -44.82 83.22 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.201 -0.937 . . . . 0.0 109.431 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.432 ' OE2' ' HB3' ' A' ' 3' ' ' ASP . 18.0 tt0 -60.49 -36.2 77.74 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.407 -0.808 . . . . 0.0 109.591 179.314 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -61.8 -48.56 80.07 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.3 -0.875 . . . . 0.0 110.322 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.48 ' CG1' ' CE2' ' A' ' 14' ' ' PHE . 46.6 t -58.54 -41.22 81.32 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.08 -1.012 . . . . 0.0 109.589 179.574 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 64.8 mt -61.3 -45.66 98.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.412 -0.805 . . . . 0.0 109.472 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.22 -47.2 83.51 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.32 -0.863 . . . . 0.0 109.144 179.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.457 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 14.2 m -62.92 -39.26 94.03 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.284 -0.885 . . . . 0.0 109.009 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.48 ' CE2' ' CG1' ' A' ' 10' ' ' VAL . 1.2 m-85 -66.98 -43.29 83.38 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.434 -0.791 . . . . 0.0 109.41 179.23 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.52 ' CD ' ' HA ' ' A' ' 20' ' ' ASP . 0.0 OUTLIER -53.18 -43.11 66.85 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.29 -0.881 . . . . 0.0 109.009 179.184 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 39.7 mt -58.89 -44.81 91.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.463 -0.773 . . . . 0.0 109.432 179.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 13' ' ' SER . 33.2 mt -65.05 -41.99 94.66 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.232 -0.917 . . . . 0.0 109.779 179.567 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.459 ' O ' ' HB2' ' A' ' 21' ' ' LYS . . . -76.33 -2.07 29.9 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.421 -0.799 . . . . 0.0 110.195 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.455 ' O ' ' C ' ' A' ' 20' ' ' ASP . 0.4 OUTLIER 64.93 77.37 0.31 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.317 -0.864 . . . . 0.0 110.328 179.783 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.52 ' HA ' ' CD ' ' A' ' 15' ' ' ARG . 4.6 p-10 37.44 45.36 0.56 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.593 -0.692 . . . . 0.0 110.517 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.459 ' HB2' ' O ' ' A' ' 18' ' ' ALA . 10.7 mmtt -122.08 144.89 42.5 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.351 -0.843 . . . . 0.0 110.116 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -65.5 -8.2 18.4 Favored 'Trans proline' 0 C--N 1.304 -1.783 0 O-C-N 124.218 1.641 . . . . 0.0 110.209 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.542 ' N ' ' CD1' ' A' ' 23' ' ' TYR . 19.5 p90 -143.85 167.53 22.1 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.315 -0.866 . . . . 0.0 110.288 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.508 HD11 HG22 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -123.19 140.66 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.303 -0.873 . . . . 0.0 109.767 179.797 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 mp -81.47 149.96 28.51 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.142 -0.974 . . . . 0.0 110.216 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.458 ' HA ' HD12 ' A' ' 42' ' ' ILE . . . -61.47 -40.03 93.06 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.368 -0.832 . . . . 0.0 110.268 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -63.59 -36.28 83.29 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.219 -0.926 . . . . 0.0 109.899 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.47 ' O ' ' CG ' ' A' ' 32' ' ' GLU . 2.6 mm-40 -60.62 -37.53 81.73 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.248 -0.907 . . . . 0.0 109.3 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 22.9 mt -66.53 -36.33 82.42 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.394 -0.816 . . . . 0.0 109.606 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.0 mtt85 -68.81 -34.53 75.68 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.331 -0.856 . . . . 0.0 110.116 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.9 -18.67 21.71 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.293 -0.88 . . . . 0.0 110.773 -179.499 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.47 ' CG ' ' O ' ' A' ' 28' ' ' GLU . 12.6 mm-40 -99.55 -23.61 15.03 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.025 -1.047 . . . . 0.0 110.745 -179.616 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.483 HD21 ' HD2' ' A' ' 34' ' ' PRO . 2.3 mt -128.63 141.83 42.86 Favored Pre-proline 0 N--CA 1.488 1.475 0 O-C-N 121.055 -1.028 . . . . 0.0 110.12 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.483 ' HD2' HD21 ' A' ' 33' ' ' LEU . 31.6 Cg_exo -43.58 130.91 7.28 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.825 1.434 . . . . 0.0 109.634 179.51 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.458 ' C ' ' O ' ' A' ' 34' ' ' PRO . 32.3 Cg_exo -35.18 -38.95 0.2 Allowed 'Trans proline' 0 C--N 1.308 -1.598 0 O-C-N 124.274 1.671 . . . . 0.0 110.904 -179.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.15 -43.9 85.7 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.35 -0.843 . . . . 0.0 110.954 -179.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.474 ' HB3' HD21 ' A' ' 33' ' ' LEU . 2.5 mp0 -70.02 -42.02 73.52 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.081 -1.012 . . . . 0.0 110.99 -179.301 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.48 ' O ' HG12 ' A' ' 42' ' ' ILE . . . -55.87 -45.83 78.44 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.245 -0.909 . . . . 0.0 110.662 -179.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -54.53 -46.86 73.64 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.111 -0.993 . . . . 0.0 110.68 -179.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -63.16 -47.01 84.48 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.094 -1.004 . . . . 0.0 110.551 -179.638 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.469 ' O ' ' HG2' ' A' ' 45' ' ' MET . 84.3 m -65.33 -48.36 73.3 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.15 -0.969 . . . . 0.0 110.681 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.48 HG12 ' O ' ' A' ' 38' ' ' ALA . 15.9 mm -47.58 -31.06 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.127 -0.983 . . . . 0.0 110.876 -179.529 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 10.2 tttt -85.01 -36.7 21.11 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.105 -0.997 . . . . 0.0 110.374 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.582 ' HG3' ' CE1' ' A' ' 63' ' ' PHE . 9.3 mmp_? -60.13 -73.42 0.09 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.34 -0.85 . . . . 0.0 110.271 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.5 ' HE3' ' HB3' ' A' ' 60' ' ' TYR . 21.2 ptp -56.73 138.97 77.24 Favored Pre-proline 0 N--CA 1.488 1.453 0 O-C-N 121.213 -0.929 . . . . 0.0 110.301 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -88.25 -170.19 0.5 Allowed 'Trans proline' 0 C--N 1.306 -1.694 0 O-C-N 123.963 1.507 . . . . 0.0 110.504 -179.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -77.0 131.78 38.64 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.216 -0.928 . . . . 0.0 110.176 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.432 ' CE2' ' HB2' ' A' ' 53' ' ' SER . 20.2 t80 -72.12 92.83 1.37 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.275 -0.89 . . . . 0.0 110.159 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -104.07 73.33 1.14 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.203 -0.936 . . . . 0.0 110.357 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -101.45 -161.57 27.15 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -68.8 60.27 1.21 Allowed 'Trans proline' 0 C--N 1.307 -1.656 0 O-C-N 123.898 1.473 . . . . 0.0 110.197 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.462 ' O ' ' HB3' ' A' ' 53' ' ' SER . . . 138.51 -86.85 0.21 Allowed Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.462 ' HB3' ' O ' ' A' ' 52' ' ' GLY . 10.8 t 56.06 -179.25 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.34 0 O-C-N 121.244 -1.151 . . . . 0.0 110.257 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 34.4 m -138.35 154.04 73.37 Favored Pre-proline 0 C--N 1.294 -1.833 0 O-C-N 121.762 -0.587 . . . . 0.0 110.119 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -59.55 117.99 4.8 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 124.132 1.596 . . . . 0.0 110.307 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 103.73 17.92 15.58 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -102.34 125.77 49.15 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.171 -1.194 . . . . 0.0 110.335 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.2 mp -114.95 159.54 20.61 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.306 -0.871 . . . . 0.0 109.725 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.458 ' O ' ' HB2' ' A' ' 45' ' ' MET . 4.9 m-20 -108.39 110.61 22.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.024 -1.048 . . . . 0.0 110.479 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.558 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 15.0 p90 -73.35 -26.7 61.13 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.336 -0.852 . . . . 0.0 110.14 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.558 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.13 -36.36 68.16 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.273 -0.892 . . . . 0.0 109.983 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.12 -34.41 76.33 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.248 -0.907 . . . . 0.0 109.885 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.582 ' CE1' ' HG3' ' A' ' 44' ' ' ARG . 2.7 t80 -71.77 -33.44 68.61 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.591 -0.693 . . . . 0.0 110.246 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.7 p -58.26 -48.19 81.2 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.302 -0.874 . . . . 0.0 110.383 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.403 ' O ' ' N ' ' A' ' 69' ' ' GLY . 3.3 t -68.55 -38.65 80.97 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.223 -0.923 . . . . 0.0 110.324 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.16 -31.03 71.63 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.235 -0.916 . . . . 0.0 110.367 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.462 ' HG ' ' CE1' ' A' ' 63' ' ' PHE . 0.5 OUTLIER -69.25 -43.27 74.31 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.243 -0.911 . . . . 0.0 110.326 -179.823 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.443 ' CZ ' ' HB ' ' A' ' 6' ' ' THR . 29.5 m-85 -91.81 -25.32 19.05 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.185 -0.947 . . . . 0.0 110.236 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.403 ' N ' ' O ' ' A' ' 65' ' ' SER . . . 65.35 109.96 0.01 OUTLIER Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.435 ' O ' ' CB ' ' A' ' 71' ' ' SER . 3.7 tp10 -155.65 49.59 0.53 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.237 -1.155 . . . . 0.0 110.231 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.435 ' CB ' ' O ' ' A' ' 70' ' ' GLU . 0.9 OUTLIER 65.43 105.33 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.171 -0.956 . . . . 0.0 110.183 -179.962 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -61.47 114.49 3.26 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.254 -0.904 . . . . 0.0 110.263 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.59 0 O-C-N 121.255 -0.903 . . . . 0.0 110.251 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.253 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -107.36 -52.3 2.78 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.211 -1.17 . . . . 0.0 110.231 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 8.6 ttpt -58.19 -47.29 83.87 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.183 -0.948 . . . . 0.0 110.101 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.69 -37.8 74.11 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.197 -0.939 . . . . 0.0 110.128 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -63.65 -40.21 96.28 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.183 -0.948 . . . . 0.0 110.217 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . 0.433 ' HB1' ' HA ' ' A' ' 13' ' ' SER . . . -62.43 -43.07 99.69 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.284 -0.885 . . . . 0.0 110.036 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 87.4 t -62.71 -40.36 88.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.176 -0.952 . . . . 0.0 109.753 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.64 -36.3 82.38 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.421 -0.799 . . . . 0.0 110.182 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 34.8 m -69.85 -40.22 75.92 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.269 -0.894 . . . . 0.0 110.252 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.445 ' O ' HG21 ' B' ' 20' ' ' VAL . 57.6 t -69.01 -41.74 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.254 -0.904 . . . . 0.0 110.243 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 18.6 t -60.9 -44.41 97.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.286 -0.884 . . . . 0.0 110.101 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.35 -44.77 93.89 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.235 -0.915 . . . . 0.0 110.197 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.93 -45.76 87.78 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.237 -0.914 . . . . 0.0 110.082 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . 0.445 HG21 ' O ' ' B' ' 16' ' ' VAL . 88.3 t -61.45 -47.23 94.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.349 -0.844 . . . . 0.0 110.16 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . 0.453 ' HA ' ' HD3' ' B' ' 24' ' ' ARG . 15.0 t70 -55.72 -31.89 62.88 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.124 -0.985 . . . . 0.0 109.709 179.718 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -64.35 -36.49 84.3 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.422 -0.799 . . . . 0.0 110.353 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.33 -40.38 90.42 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.33 -0.856 . . . . 0.0 110.451 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . 0.453 ' HD3' ' HA ' ' B' ' 21' ' ' ASP . 0.2 OUTLIER -69.89 -47.27 63.19 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.082 -1.011 . . . . 0.0 109.726 179.903 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 55.2 t -52.45 -20.44 2.04 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.433 0 O-C-N 121.572 -0.705 . . . . 0.0 110.442 -179.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 2.8 ttp180 -79.36 12.67 2.29 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.361 -0.837 . . . . 0.0 110.996 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . 0.448 ' O ' ' N ' ' B' ' 29' ' ' ARG . 34.0 tt0 -102.96 136.68 19.2 Favored Pre-proline 0 N--CA 1.49 1.559 0 O-C-N 121.203 -0.936 . . . . 0.0 109.944 179.658 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -62.45 79.83 0.1 Allowed 'Trans proline' 0 C--N 1.304 -1.786 0 O-C-N 124.015 1.534 . . . . 0.0 110.308 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . 0.448 ' N ' ' O ' ' B' ' 27' ' ' GLU . 9.3 mmm180 . . . . . 0 N--CA 1.491 1.584 0 O-C-N 121.285 -0.884 . . . . 0.0 110.254 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.7 mpp? . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.253 0.549 . . . . 0.0 110.219 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -153.76 93.24 1.64 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.261 -0.9 . . . . 0.0 110.199 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -128.0 -171.23 2.4 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.211 -0.931 . . . . 0.0 110.208 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 44.5 p -115.32 -173.7 2.37 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.266 -0.896 . . . . 0.0 110.16 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.49 ' O ' ' N ' ' A' ' 7' ' ' ALA . 53.4 m-20 -144.51 -49.4 0.27 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.293 -0.88 . . . . 0.0 110.282 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.454 HG23 ' OH ' ' A' ' 68' ' ' TYR . 1.2 m 66.19 -61.5 0.29 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.27 -0.893 . . . . 0.0 110.171 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.49 ' N ' ' O ' ' A' ' 5' ' ' ASP . . . -62.74 -40.39 97.07 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.267 -0.896 . . . . 0.0 109.264 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -54.31 -34.44 60.96 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.541 -0.724 . . . . 0.0 109.459 179.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -60.08 -40.86 91.02 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.428 -0.795 . . . . 0.0 110.213 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.479 HG11 ' CD2' ' A' ' 14' ' ' PHE . 96.3 t -58.16 -42.42 83.2 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.052 -1.03 . . . . 0.0 109.453 179.514 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 75.3 mt -62.42 -49.29 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.394 -0.816 . . . . 0.0 109.368 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.09 -46.68 87.66 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.425 -0.797 . . . . 0.0 109.259 179.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 45.4 m -63.35 -40.41 97.2 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.339 -0.851 . . . . 0.0 109.223 179.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.497 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 1.6 m-85 -68.5 -41.2 80.38 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.396 -0.815 . . . . 0.0 109.569 179.221 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.18 -45.95 68.73 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.287 -0.883 . . . . 0.0 109.425 179.477 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.6 mt -58.24 -44.58 88.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.314 -0.866 . . . . 0.0 109.286 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.5 mp -64.97 -39.0 92.82 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.374 -0.829 . . . . 0.0 109.796 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.427 ' HB3' ' HB ' ' A' ' 24' ' ' ILE . . . -81.62 9.66 7.3 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.327 -0.858 . . . . 0.0 110.254 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 60.72 50.02 5.84 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.155 -0.966 . . . . 0.0 110.278 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.1 t70 59.38 58.76 2.88 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.334 -0.854 . . . . 0.0 110.43 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.9 mttp -139.68 141.67 28.82 Favored Pre-proline 0 N--CA 1.49 1.541 0 O-C-N 121.299 -0.876 . . . . 0.0 109.9 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -61.64 -11.79 21.97 Favored 'Trans proline' 0 C--N 1.304 -1.778 0 O-C-N 124.076 1.566 . . . . 0.0 109.913 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.407 ' O ' ' HB2' ' A' ' 18' ' ' ALA . 43.4 p90 -138.92 167.45 22.0 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.35 -0.844 . . . . 0.0 110.094 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.52 HD12 ' CD2' ' A' ' 29' ' ' LEU . 9.2 tt -144.67 158.78 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.267 -0.896 . . . . 0.0 110.214 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 16.1 mt -88.14 141.36 28.62 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.277 -0.89 . . . . 0.0 110.099 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.57 -33.7 70.24 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.247 -0.908 . . . . 0.0 110.343 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -62.71 -38.81 91.93 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.205 -0.935 . . . . 0.0 110.134 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -58.59 -40.76 84.07 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.215 -0.928 . . . . 0.0 109.489 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.52 ' CD2' HD12 ' A' ' 24' ' ' ILE . 2.1 mm? -59.37 -36.06 75.06 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.319 -0.863 . . . . 0.0 109.6 179.432 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 44.0 mtt180 -69.14 -34.72 75.45 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.381 -0.824 . . . . 0.0 110.506 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.0 ttt180 -87.26 -18.01 31.21 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.289 -0.882 . . . . 0.0 111.032 -179.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -101.73 -23.66 14.19 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.98 -1.075 . . . . 0.0 110.967 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.488 ' CD2' ' HB3' ' A' ' 37' ' ' GLN . 0.1 OUTLIER -126.93 164.87 32.39 Favored Pre-proline 0 C--N 1.303 -1.455 0 O-C-N 121.019 -1.05 . . . . 0.0 110.365 -179.805 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.455 ' HD2' HD21 ' A' ' 33' ' ' LEU . 30.9 Cg_exo -58.08 138.57 86.61 Favored 'Trans proline' 0 C--N 1.302 -1.904 0 O-C-N 124.173 1.617 . . . . 0.0 109.882 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.422 ' C ' ' O ' ' A' ' 34' ' ' PRO . 16.0 Cg_exo -40.11 -40.67 2.86 Favored 'Trans proline' 0 C--N 1.303 -1.817 0 O-C-N 124.052 1.554 . . . . 0.0 110.438 -179.643 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.426 ' OD1' ' CD ' ' A' ' 37' ' ' GLN . 1.4 p30 -65.94 -41.77 90.86 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.242 -0.911 . . . . 0.0 110.896 -179.578 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.488 ' HB3' ' CD2' ' A' ' 33' ' ' LEU . 0.4 OUTLIER -69.35 -39.51 78.08 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.021 -1.049 . . . . 0.0 110.763 -179.382 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.32 -43.53 98.71 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.135 -0.978 . . . . 0.0 110.871 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -64.22 -47.67 78.81 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.064 -1.023 . . . . 0.0 110.818 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.61 -43.15 97.73 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.126 -0.984 . . . . 0.0 110.511 -179.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.443 ' SG ' ' O ' ' A' ' 37' ' ' GLN . 72.7 m -65.05 -49.64 69.33 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.257 -0.902 . . . . 0.0 110.579 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 27.5 mt -61.44 -17.6 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.156 -0.965 . . . . 0.0 110.279 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -84.64 -19.67 32.55 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.103 -0.998 . . . . 0.0 110.293 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.419 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 5.1 mmt85 -88.99 -69.69 0.69 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.179 -0.95 . . . . 0.0 110.096 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.464 ' HE3' ' CA ' ' A' ' 60' ' ' TYR . 13.7 ptp -45.65 135.35 6.1 Favored Pre-proline 0 N--CA 1.488 1.43 0 O-C-N 121.243 -0.911 . . . . 0.0 110.248 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo -85.24 -146.69 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.75 0 O-C-N 123.968 1.509 . . . . 0.0 110.308 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -93.62 131.78 38.58 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.232 -0.917 . . . . 0.0 110.294 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -48.21 -65.94 0.48 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.242 -0.911 . . . . 0.0 110.037 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -133.26 41.87 3.07 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.172 -0.955 . . . . 0.0 110.244 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.88 -174.42 48.9 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.621 -1.391 . . . . 0.0 109.621 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -70.72 62.85 2.33 Favored 'Trans proline' 0 C--N 1.305 -1.76 0 O-C-N 124.047 1.551 . . . . 0.0 110.299 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.468 ' O ' ' O ' ' A' ' 53' ' ' SER . . . -134.3 -48.52 0.09 OUTLIER Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.631 -1.387 . . . . 0.0 109.631 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.468 ' O ' ' O ' ' A' ' 52' ' ' GLY . 1.5 t -56.76 -152.07 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.268 0 O-C-N 121.279 -1.13 . . . . 0.0 110.879 -179.543 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 16.9 m -60.88 -168.12 0.02 OUTLIER Pre-proline 0 N--CA 1.491 1.599 0 O-C-N 121.246 -0.909 . . . . 0.0 110.212 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -92.02 34.69 0.26 Allowed 'Trans proline' 0 C--N 1.305 -1.723 0 O-C-N 123.999 1.526 . . . . 0.0 110.367 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 167.26 38.88 0.02 OUTLIER Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.661 -1.376 . . . . 0.0 109.661 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -84.53 116.89 23.37 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.246 -1.149 . . . . 0.0 110.091 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.433 ' HB3' ' SD ' ' A' ' 45' ' ' MET . 1.5 mt -119.42 159.93 23.28 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.21 -0.931 . . . . 0.0 110.337 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.42 ' O ' ' HB2' ' A' ' 45' ' ' MET . 3.4 m-20 -114.44 113.58 24.68 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.29 -0.881 . . . . 0.0 110.047 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.497 ' HB2' ' CD2' ' A' ' 14' ' ' PHE . 18.7 p90 -77.7 -22.08 51.02 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.247 -0.908 . . . . 0.0 110.205 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.446 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.26 -36.54 68.68 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.244 -0.91 . . . . 0.0 109.958 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.02 -34.68 76.96 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.277 -0.889 . . . . 0.0 109.865 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.45 ' O ' ' HB2' ' A' ' 67' ' ' LEU . 3.3 t80 -72.06 -29.2 63.9 Favored 'General case' 0 C--N 1.298 -1.674 0 O-C-N 121.578 -0.701 . . . . 0.0 109.938 179.579 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.2 p -65.39 -46.73 78.93 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.355 -0.841 . . . . 0.0 110.115 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 47.5 m -66.36 -43.82 84.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.338 -0.851 . . . . 0.0 109.994 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.95 -31.91 73.38 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.341 -0.849 . . . . 0.0 110.154 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.45 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.5 OUTLIER -63.4 -41.06 98.73 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.215 -0.928 . . . . 0.0 110.248 -179.966 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.454 ' OH ' HG23 ' A' ' 6' ' ' THR . 35.0 m-85 -97.19 -9.1 28.46 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.289 -0.882 . . . . 0.0 110.369 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -155.25 91.67 0.12 Allowed Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -83.6 91.41 7.43 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.335 -1.097 . . . . 0.0 110.3 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.1 p -148.0 -42.94 0.16 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.257 -0.902 . . . . 0.0 110.147 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.91 140.7 29.17 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.211 -0.931 . . . . 0.0 110.2 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.598 ' N ' ' CD1' ' A' ' 73' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 O-C-N 121.157 -0.964 . . . . 0.0 110.458 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.303 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 8.2 mmtt -96.76 -52.64 3.83 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.298 -1.119 . . . . 0.0 110.295 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 3.0 tttt -63.67 -33.51 75.79 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.271 -0.893 . . . . 0.0 110.213 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.53 -42.73 99.71 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.258 -0.901 . . . . 0.0 110.14 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -61.16 -41.03 96.04 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.214 -0.929 . . . . 0.0 110.085 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.51 -45.21 91.72 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.287 -0.883 . . . . 0.0 110.189 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 71.3 t -60.82 -42.47 92.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.297 -0.877 . . . . 0.0 110.207 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.1 -38.71 80.16 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.249 -0.907 . . . . 0.0 110.182 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 65.3 m -66.49 -38.51 87.44 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.27 -0.894 . . . . 0.0 110.075 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.468 ' O ' ' CG2' ' B' ' 20' ' ' VAL . 74.0 t -69.91 -46.48 73.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.332 -0.855 . . . . 0.0 110.18 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 80.2 t -58.35 -46.55 89.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.278 -0.889 . . . . 0.0 110.093 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.34 -43.68 98.26 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.268 -0.895 . . . . 0.0 110.071 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.02 -45.63 84.71 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.277 -0.89 . . . . 0.0 110.174 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . 0.468 ' CG2' ' O ' ' B' ' 16' ' ' VAL . 43.2 t -59.21 -45.32 92.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.328 -0.858 . . . . 0.0 110.165 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . 0.492 ' O ' ' CG2' ' B' ' 25' ' ' VAL . 12.8 t70 -60.52 -32.92 71.93 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.274 -0.891 . . . . 0.0 110.238 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -66.82 -40.82 88.16 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.206 -0.934 . . . . 0.0 110.478 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . 0.438 ' HB2' HD23 ' A' ' 67' ' ' LEU . . . -65.98 -42.65 89.56 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.247 -0.908 . . . . 0.0 110.961 -179.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . 0.567 ' HG3' ' N ' ' B' ' 25' ' ' VAL . 3.0 ptp180 -69.76 -31.3 69.18 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.048 -1.032 . . . . 0.0 110.76 -179.505 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . 0.567 ' N ' ' HG3' ' B' ' 24' ' ' ARG . 84.7 t -67.37 -25.16 32.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 120.852 -1.155 . . . . 0.0 109.995 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -106.6 18.96 21.19 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.589 -0.694 . . . . 0.0 109.724 179.674 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -103.59 128.92 26.38 Favored Pre-proline 0 N--CA 1.491 1.592 0 O-C-N 121.433 -0.792 . . . . 0.0 110.161 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -76.77 67.99 7.24 Favored 'Trans proline' 0 C--N 1.304 -1.773 0 O-C-N 124.104 1.581 . . . . 0.0 110.26 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? . . . . . 0 N--CA 1.492 1.633 0 O-C-N 121.258 -0.901 . . . . 0.0 110.112 179.978 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.272 0.558 . . . . 0.0 110.31 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -94.61 177.21 6.0 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.273 -0.892 . . . . 0.0 110.157 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.454 ' O ' ' O ' ' A' ' 4' ' ' THR . 1.8 m-20 -160.38 -38.2 0.05 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.281 -0.887 . . . . 0.0 110.179 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.454 ' O ' ' O ' ' A' ' 3' ' ' ASP . 0.5 OUTLIER 49.06 98.65 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.265 -0.897 . . . . 0.0 110.228 179.983 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.512 ' HB3' ' CB ' ' A' ' 8' ' ' GLU . 0.4 OUTLIER -163.73 144.39 8.75 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.194 -0.941 . . . . 0.0 110.253 -179.892 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.529 HG23 ' CE2' ' A' ' 68' ' ' TYR . 2.1 m -44.76 -62.85 1.06 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.198 -0.939 . . . . 0.0 110.213 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.82 -44.53 85.34 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.22 -0.925 . . . . 0.0 109.582 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.512 ' CB ' ' HB3' ' A' ' 5' ' ' ASP . 29.1 tp10 -54.56 -35.93 63.81 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.384 -0.822 . . . . 0.0 109.889 179.396 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -60.91 -43.02 99.16 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.376 -0.828 . . . . 0.0 110.26 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 45.0 t -59.98 -49.76 82.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.148 -0.97 . . . . 0.0 109.915 179.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 46.2 mt -55.08 -49.15 74.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.322 -0.861 . . . . 0.0 109.44 179.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.29 -43.26 83.02 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.297 -0.877 . . . . 0.0 109.096 179.123 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.2 m -66.7 -38.92 87.72 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.374 -0.829 . . . . 0.0 109.308 179.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.57 ' HB3' ' CE1' ' A' ' 60' ' ' TYR . 1.2 m-85 -67.83 -40.79 83.71 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.311 -0.868 . . . . 0.0 109.412 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -55.47 -48.9 73.8 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.315 -0.865 . . . . 0.0 109.526 179.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 37.7 mt -57.99 -42.2 82.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.391 -0.818 . . . . 0.0 109.917 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.49 ' CD1' ' HB3' ' A' ' 32' ' ' GLU . 2.7 mm? -65.09 -41.63 94.81 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.337 -0.852 . . . . 0.0 110.074 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.505 ' CB ' HG12 ' A' ' 24' ' ' ILE . . . -78.76 0.24 27.65 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.41 -0.806 . . . . 0.0 110.151 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.493 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 68.65 60.43 0.37 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.332 -0.855 . . . . 0.0 110.502 179.801 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.9 t70 59.04 52.34 6.38 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.202 -0.936 . . . . 0.0 110.42 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.408 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 32.8 mmtt -134.64 143.1 45.1 Favored Pre-proline 0 N--CA 1.489 1.503 0 O-C-N 121.198 -0.939 . . . . 0.0 110.07 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_endo -72.49 -1.68 10.62 Favored 'Trans proline' 0 C--N 1.305 -1.722 0 O-C-N 124.032 1.543 . . . . 0.0 109.988 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.443 ' O ' ' HB2' ' A' ' 18' ' ' ALA . 46.9 p90 -143.92 164.38 30.73 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.276 -0.89 . . . . 0.0 110.142 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.505 HG12 ' CB ' ' A' ' 18' ' ' ALA . 0.4 OUTLIER -129.08 149.44 33.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.211 -0.931 . . . . 0.0 110.034 -179.816 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.427 ' N ' HD11 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -91.68 143.95 26.02 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.225 -0.922 . . . . 0.0 110.205 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.47 -45.44 84.81 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.29 -0.881 . . . . 0.0 110.268 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -59.42 -36.0 75.05 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.323 -0.861 . . . . 0.0 110.395 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.438 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 4.7 tt0 -65.17 -42.82 93.3 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.298 -0.876 . . . . 0.0 110.166 -179.775 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 25.3 mt -64.01 -35.7 81.58 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.201 -0.937 . . . . 0.0 109.914 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.446 ' HA ' ' HB3' ' A' ' 38' ' ' ALA . 5.4 ttm-85 -67.99 -34.8 77.23 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.417 -0.802 . . . . 0.0 110.104 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 22.7 ttt-85 -90.84 -26.21 19.51 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.346 -0.846 . . . . 0.0 110.661 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.49 ' HB3' ' CD1' ' A' ' 17' ' ' LEU . 3.5 mm-40 -92.33 -23.58 19.21 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.226 -0.921 . . . . 0.0 111.235 -179.157 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.535 HD21 ' CB ' ' A' ' 37' ' ' GLN . 0.3 OUTLIER -124.26 164.78 27.88 Favored Pre-proline 0 N--CA 1.49 1.563 0 O-C-N 120.899 -1.126 . . . . 0.0 110.526 -179.562 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.468 ' HD2' HD21 ' A' ' 33' ' ' LEU . 34.3 Cg_exo -63.44 145.46 92.37 Favored 'Trans proline' 0 C--N 1.307 -1.652 0 O-C-N 124.072 1.564 . . . . 0.0 110.178 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -43.87 -35.75 7.32 Favored 'Trans proline' 0 C--N 1.302 -1.876 0 O-C-N 124.081 1.569 . . . . 0.0 110.472 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.97 -47.38 74.79 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.089 -1.007 . . . . 0.0 110.725 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.535 ' CB ' HD21 ' A' ' 33' ' ' LEU . 1.4 mp0 -69.81 -42.96 72.99 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.112 -0.993 . . . . 0.0 110.455 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.466 ' O ' ' CG1' ' A' ' 42' ' ' ILE . . . -56.64 -44.13 80.96 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.248 -0.908 . . . . 0.0 110.476 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -63.38 -49.12 75.1 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.185 -0.947 . . . . 0.0 110.321 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -66.44 -47.93 71.59 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.232 -0.918 . . . . 0.0 110.2 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.405 ' SG ' HG23 ' B' ' 20' ' ' VAL . 71.1 m -63.95 -43.6 95.36 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.207 -0.933 . . . . 0.0 110.147 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.466 ' CG1' ' O ' ' A' ' 38' ' ' ALA . 48.6 mt -61.4 -24.01 32.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.246 -0.908 . . . . 0.0 109.998 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.62 -41.94 15.87 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.212 -0.93 . . . . 0.0 110.224 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.579 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 2.4 mmp_? -66.99 -64.3 0.88 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.193 -0.942 . . . . 0.0 110.106 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.492 ' SD ' ' CG2' ' A' ' 24' ' ' ILE . 1.9 ttm -36.04 101.59 0.22 Allowed Pre-proline 0 N--CA 1.494 1.743 0 O-C-N 121.581 -0.699 . . . . 0.0 111.029 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.446 ' HD3' ' O ' ' A' ' 44' ' ' ARG . 12.7 Cg_endo -68.37 -166.01 0.14 Allowed 'Trans proline' 0 C--N 1.305 -1.746 0 O-C-N 124.0 1.526 . . . . 0.0 109.781 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -81.82 136.37 35.39 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.161 -0.962 . . . . 0.0 110.093 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -85.36 -8.24 58.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.245 -0.909 . . . . 0.0 110.258 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 178.35 177.14 0.45 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.258 -0.902 . . . . 0.0 110.212 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -128.18 -61.23 0.12 Allowed Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -83.9 -4.36 10.54 Favored 'Trans proline' 0 C--N 1.305 -1.757 0 O-C-N 124.128 1.594 . . . . 0.0 110.2 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.466 ' O ' ' HB3' ' A' ' 53' ' ' SER . . . -124.47 -155.98 9.3 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.466 ' HB3' ' O ' ' A' ' 52' ' ' GLY . 9.0 t 56.6 -177.72 0.05 Allowed 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.318 -1.107 . . . . 0.0 110.197 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.42 ' N ' ' OG ' ' A' ' 53' ' ' SER . 17.2 m -108.58 176.4 1.6 Allowed Pre-proline 0 C--N 1.295 -1.781 0 O-C-N 121.667 -0.645 . . . . 0.0 110.154 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_exo -77.01 65.48 7.78 Favored 'Trans proline' 0 C--N 1.305 -1.711 0 O-C-N 123.963 1.507 . . . . 0.0 110.46 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 150.19 41.09 0.03 OUTLIER Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.769 -1.332 . . . . 0.0 109.769 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -120.87 120.05 34.42 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.164 -1.197 . . . . 0.0 110.15 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.422 ' HB3' ' HG2' ' A' ' 45' ' ' MET . 58.3 mt -122.11 156.75 32.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.253 -0.904 . . . . 0.0 110.159 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.468 ' OD2' ' N ' ' A' ' 62' ' ' ALA . 7.3 t70 -103.91 110.98 23.32 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.135 -0.978 . . . . 0.0 110.583 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.581 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 20.5 p90 -71.36 -25.93 62.59 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.208 -0.933 . . . . 0.0 109.09 179.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.581 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.16 -41.48 75.49 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.493 -0.755 . . . . 0.0 109.563 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.468 ' N ' ' OD2' ' A' ' 59' ' ' ASP . . . -62.1 -37.5 85.3 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.301 -0.875 . . . . 0.0 109.611 179.378 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.579 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 2.6 t80 -71.87 -38.87 69.96 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.643 -0.661 . . . . 0.0 110.008 179.561 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.7 p -60.11 -47.13 87.18 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.339 -0.851 . . . . 0.0 110.294 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.401 ' C ' ' HB3' ' A' ' 70' ' ' GLU . 0.2 OUTLIER -65.41 -35.73 81.8 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.328 -0.858 . . . . 0.0 110.227 -179.814 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.01 -32.74 59.54 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.289 -0.882 . . . . 0.0 110.179 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.522 HD13 ' CZ ' ' A' ' 63' ' ' PHE . 0.4 OUTLIER -55.16 -38.0 67.72 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.204 -0.935 . . . . 0.0 110.278 179.962 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.529 ' CE2' HG23 ' A' ' 6' ' ' THR . 16.3 m-85 -95.22 -35.18 11.94 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.197 -0.939 . . . . 0.0 110.357 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 157.01 96.58 0.12 Allowed Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.454 ' CD ' ' N ' ' A' ' 71' ' ' SER . 12.4 tm-20 -174.73 160.13 2.93 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.262 -1.14 . . . . 0.0 110.205 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.454 ' N ' ' CD ' ' A' ' 70' ' ' GLU . 81.5 p -146.47 90.95 1.98 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.223 -0.923 . . . . 0.0 110.242 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -68.41 141.85 55.57 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.221 -0.925 . . . . 0.0 110.16 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.489 ' O ' ' CD1' ' A' ' 73' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 O-C-N 121.381 -0.824 . . . . 0.0 110.201 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.239 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.07 -20.27 63.23 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.275 -1.133 . . . . 0.0 110.261 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 7.5 ttmt -68.14 -33.14 73.94 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.246 -0.909 . . . . 0.0 110.188 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.7 96.96 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.255 -0.903 . . . . 0.0 110.072 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -63.5 -40.48 97.18 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.201 -0.937 . . . . 0.0 110.03 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.7 -43.53 84.12 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.285 -0.885 . . . . 0.0 110.032 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 59.3 t -63.08 -44.14 99.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.433 -0.792 . . . . 0.0 110.108 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.05 -41.61 92.68 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.268 -0.895 . . . . 0.0 109.921 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 99.9 m -62.6 -42.91 99.85 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.211 -0.931 . . . . 0.0 109.932 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 56.7 t -65.17 -45.34 94.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.389 -0.819 . . . . 0.0 109.974 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.46 HG21 ' CD2' ' A' ' 33' ' ' LEU . 76.1 t -60.28 -47.01 94.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.302 -0.874 . . . . 0.0 109.883 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.3 -42.83 82.5 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.288 -0.882 . . . . 0.0 110.04 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.25 -40.63 86.27 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.348 -0.845 . . . . 0.0 109.859 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . 0.405 HG23 ' SG ' ' A' ' 41' ' ' CYS . 98.6 t -64.9 -47.28 88.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.308 -0.87 . . . . 0.0 110.113 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 54.2 t0 -64.9 -32.51 74.26 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.262 -0.899 . . . . 0.0 110.087 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . 0.466 ' O ' HG11 ' B' ' 25' ' ' VAL . 2.8 tp-100 -58.21 -48.32 80.71 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.233 -0.917 . . . . 0.0 110.123 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.92 -38.89 87.36 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.318 -0.864 . . . . 0.0 110.37 -179.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -68.22 -32.3 72.42 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.169 -0.957 . . . . 0.0 110.318 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . 0.466 HG11 ' O ' ' B' ' 22' ' ' GLN . 0.3 OUTLIER -65.35 -20.55 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.293 -0.88 . . . . 0.0 110.281 -179.834 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 62.9 mtp85 -83.82 28.06 0.61 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.417 -0.802 . . . . 0.0 110.788 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.57 138.94 20.38 Favored Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 120.989 -1.069 . . . . 0.0 110.226 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -63.87 92.34 0.17 Allowed 'Trans proline' 0 C--N 1.306 -1.7 0 O-C-N 123.943 1.496 . . . . 0.0 110.369 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.657 0 O-C-N 121.262 -0.899 . . . . 0.0 110.212 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 mtp . . . . . 0 N--CA 1.491 1.625 0 CA-C-O 121.225 0.535 . . . . 0.0 110.204 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -123.04 46.77 2.1 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.249 -0.907 . . . . 0.0 110.207 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.487 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 20.1 p-10 -152.62 98.6 2.38 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.223 -0.923 . . . . 0.0 110.197 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 10.2 t -166.96 -170.13 1.47 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.203 -0.936 . . . . 0.0 110.301 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 48.32 -172.18 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.248 -0.907 . . . . 0.0 110.224 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.2 p -113.69 -53.56 2.68 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.239 -0.913 . . . . 0.0 110.17 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.73 -48.83 73.16 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.208 -0.932 . . . . 0.0 109.874 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -54.75 -36.16 64.52 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.402 -0.811 . . . . 0.0 110.055 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -61.19 -43.98 98.02 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.272 -0.892 . . . . 0.0 110.226 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 73.2 t -58.07 -45.64 88.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.14 -0.975 . . . . 0.0 109.686 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 36.8 mt -58.05 -47.2 87.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.404 -0.81 . . . . 0.0 109.335 179.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.56 -44.01 84.92 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.324 -0.86 . . . . 0.0 108.907 179.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.452 ' HA ' ' HB1' ' B' ' 12' ' ' ALA . 46.5 m -65.23 -40.13 93.66 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.373 -0.829 . . . . 0.0 108.976 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.471 ' HB3' ' CE2' ' A' ' 60' ' ' TYR . 3.1 m-85 -68.53 -41.34 80.05 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.432 -0.793 . . . . 0.0 109.509 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.0 ttt180 -53.5 -45.37 69.64 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.39 -0.819 . . . . 0.0 109.547 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.411 HG22 HD11 ' A' ' 16' ' ' ILE . 56.0 mt -61.53 -42.98 96.07 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 O-C-N 121.285 -0.884 . . . . 0.0 109.784 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.7 mp -63.68 -40.47 96.9 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.34 -0.85 . . . . 0.0 109.9 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.465 ' HB2' ' O ' ' A' ' 23' ' ' TYR . . . -79.53 4.72 14.93 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.377 -0.827 . . . . 0.0 110.218 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.433 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.4 OUTLIER 65.21 58.91 0.85 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.219 -0.926 . . . . 0.0 110.243 -179.986 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 54.51 63.99 1.97 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.263 -0.898 . . . . 0.0 110.345 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.1 mttp -144.86 143.12 19.87 Favored Pre-proline 0 N--CA 1.49 1.542 0 O-C-N 121.266 -0.896 . . . . 0.0 110.007 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -69.89 -4.41 14.05 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 O-C-N 124.037 1.546 . . . . 0.0 110.082 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.465 ' O ' ' HB2' ' A' ' 18' ' ' ALA . 50.1 p90 -138.66 165.39 27.04 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.276 -0.89 . . . . 0.0 109.873 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.539 HD12 ' N ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -139.86 138.53 38.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.165 -0.959 . . . . 0.0 110.277 -179.773 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.539 ' N ' HD12 ' A' ' 24' ' ' ILE . 5.4 tp -80.3 147.98 30.92 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.281 -0.887 . . . . 0.0 109.911 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.451 ' HA ' HD22 ' A' ' 29' ' ' LEU . . . -62.05 -26.85 68.5 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.233 -0.917 . . . . 0.0 110.143 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -70.56 -36.21 73.51 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.334 -0.854 . . . . 0.0 110.318 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.48 ' HB2' ' CD1' ' A' ' 24' ' ' ILE . 10.6 mt-10 -67.91 -50.18 57.66 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.232 -0.917 . . . . 0.0 110.254 -179.623 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.517 HD22 ' CD1' ' A' ' 42' ' ' ILE . 1.2 pp -66.54 -33.81 76.5 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.196 -0.94 . . . . 0.0 109.703 179.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.487 ' N ' HD13 ' A' ' 29' ' ' LEU . 0.0 OUTLIER -62.37 -35.73 80.05 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.36 -0.838 . . . . 0.0 109.977 179.908 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.82 -8.53 30.82 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.416 -0.802 . . . . 0.0 110.472 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -98.38 -23.27 15.67 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.1 -1.0 . . . . 0.0 110.673 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.477 ' CD2' ' CG2' ' B' ' 17' ' ' VAL . 2.9 mt -120.07 155.77 55.27 Favored Pre-proline 0 N--CA 1.488 1.453 0 O-C-N 121.159 -0.963 . . . . 0.0 110.464 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.441 ' HD2' HD22 ' A' ' 33' ' ' LEU . 51.4 Cg_exo -54.92 144.06 69.22 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 O-C-N 124.022 1.538 . . . . 0.0 110.271 179.702 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.409 ' C ' ' O ' ' A' ' 34' ' ' PRO . 26.5 Cg_endo -39.81 -42.41 3.04 Favored 'Trans proline' 0 C--N 1.304 -1.788 0 O-C-N 124.104 1.581 . . . . 0.0 110.59 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.07 -46.88 76.15 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.293 -0.88 . . . . 0.0 111.102 -179.433 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.467 ' HB3' HD21 ' A' ' 33' ' ' LEU . 33.3 mm-40 -69.53 -41.42 76.01 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.021 -1.05 . . . . 0.0 110.741 -179.291 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.454 ' HB2' ' HA ' ' A' ' 30' ' ' ARG . . . -56.08 -42.01 76.02 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.165 -0.96 . . . . 0.0 110.678 -179.513 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -60.11 -47.9 83.97 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.11 -0.994 . . . . 0.0 110.743 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -58.56 -44.23 89.65 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.189 -0.945 . . . . 0.0 110.559 -179.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 72.0 m -65.26 -42.54 93.14 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.173 -0.954 . . . . 0.0 110.358 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.517 ' CD1' HD22 ' A' ' 29' ' ' LEU . 1.1 mm -67.67 -21.64 27.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 O-C-N 121.259 -0.901 . . . . 0.0 110.474 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.81 -30.28 28.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.272 -0.892 . . . . 0.0 111.068 -179.303 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.564 ' HG2' ' CE1' ' A' ' 63' ' ' PHE . 1.1 mpt_? -94.32 -64.14 1.11 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.982 -1.074 . . . . 0.0 111.082 -179.229 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.543 ' CE ' ' HB3' ' A' ' 60' ' ' TYR . 5.5 ttm -30.0 112.15 0.29 Allowed Pre-proline 0 N--CA 1.497 1.886 0 O-C-N 121.796 -0.565 . . . . 0.0 111.305 -179.615 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -81.77 -158.17 0.09 OUTLIER 'Trans proline' 0 C--N 1.308 -1.595 0 O-C-N 124.232 1.648 . . . . 0.0 110.395 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -79.23 143.04 35.71 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.174 -0.954 . . . . 0.0 110.314 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.584 ' CE2' ' HB2' ' A' ' 53' ' ' SER . 0.6 OUTLIER -58.77 -32.49 69.33 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.247 -0.908 . . . . 0.0 110.163 179.992 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 176.45 -49.5 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.155 -0.966 . . . . 0.0 110.189 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . 0.423 ' HA2' ' HD3' ' A' ' 51' ' ' PRO . . . 152.29 -109.28 0.41 Allowed Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.357 -1.497 . . . . 0.0 109.357 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.423 ' HD3' ' HA2' ' A' ' 50' ' ' GLY . 6.4 Cg_exo -67.7 -14.5 42.04 Favored 'Trans proline' 0 C--N 1.307 -1.637 0 O-C-N 123.906 1.477 . . . . 0.0 109.958 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.428 ' O ' ' C ' ' A' ' 53' ' ' SER . . . -64.23 168.29 25.62 Favored Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.584 ' HB2' ' CE2' ' A' ' 48' ' ' TYR . 9.1 t 40.68 -142.52 0.06 Allowed 'General case' 0 C--N 1.306 -1.316 0 O-C-N 121.448 -1.03 . . . . 0.0 110.301 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 21.5 m -124.73 179.49 1.09 Allowed Pre-proline 0 C--N 1.294 -1.816 0 O-C-N 121.741 -0.6 . . . . 0.0 110.12 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -71.31 108.68 2.41 Favored 'Trans proline' 0 C--N 1.305 -1.747 0 O-C-N 123.915 1.482 . . . . 0.0 110.362 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 131.39 -20.68 4.65 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.444 -1.462 . . . . 0.0 109.444 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.34 126.06 26.2 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.243 -1.151 . . . . 0.0 110.251 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.455 ' HB3' ' HG2' ' A' ' 45' ' ' MET . 1.4 mt -124.17 160.33 28.1 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.322 -0.861 . . . . 0.0 110.054 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.445 ' C ' ' HG3' ' A' ' 45' ' ' MET . 2.1 m-20 -113.91 112.03 22.68 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.144 -0.973 . . . . 0.0 110.694 -179.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.543 ' HB3' ' CE ' ' A' ' 45' ' ' MET . 14.2 p90 -73.67 -21.16 60.35 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.402 -0.811 . . . . 0.0 109.784 179.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.533 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.64 -36.73 67.34 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.36 -0.838 . . . . 0.0 109.466 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.45 -36.37 78.91 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.352 -0.842 . . . . 0.0 109.424 179.271 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.564 ' CE1' ' HG2' ' A' ' 44' ' ' ARG . 6.5 t80 -71.83 -35.42 69.9 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.787 -0.571 . . . . 0.0 110.06 179.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 32.1 t -58.35 -47.51 83.54 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.249 -0.907 . . . . 0.0 109.974 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 11.2 m -62.62 -36.9 84.26 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.197 -0.939 . . . . 0.0 109.901 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.461 ' HA ' ' O ' ' A' ' 69' ' ' GLY . . . -60.63 -37.84 82.78 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.261 -0.899 . . . . 0.0 109.959 179.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.455 HD12 ' O ' ' B' ' 19' ' ' ALA . 0.5 OUTLIER -58.96 -42.7 90.52 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.27 -0.894 . . . . 0.0 110.123 179.885 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -98.61 4.98 48.11 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.204 -0.935 . . . . 0.0 110.27 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.461 ' O ' ' HA ' ' A' ' 66' ' ' ALA . . . -174.43 98.81 0.13 Allowed Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -111.94 106.44 15.14 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.26 -1.141 . . . . 0.0 110.282 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 43.7 t -121.45 166.56 13.95 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.298 -0.876 . . . . 0.0 109.994 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -105.26 140.23 38.72 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.242 -0.912 . . . . 0.0 110.238 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.2 pp . . . . . 0 N--CA 1.491 1.62 0 O-C-N 121.247 -0.908 . . . . 0.0 110.211 179.979 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.279 0 N-CA-C 109.569 -1.413 . . . . 0.0 109.569 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 31.7 mttp -89.45 -37.41 14.81 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.232 -1.158 . . . . 0.0 110.131 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 5.4 ttpt -57.95 -49.48 76.64 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.245 -0.909 . . . . 0.0 110.121 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.88 -38.27 78.44 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.322 -0.861 . . . . 0.0 110.116 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -64.85 -40.71 95.59 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.25 -0.906 . . . . 0.0 110.102 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . 0.452 ' HB1' ' HA ' ' A' ' 13' ' ' SER . . . -66.43 -41.9 88.48 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.251 -0.906 . . . . 0.0 110.136 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 93.2 t -61.4 -42.18 92.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.204 -0.935 . . . . 0.0 110.135 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.75 -40.87 96.65 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.262 -0.899 . . . . 0.0 110.172 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 14.6 m -62.79 -48.91 77.1 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.272 -0.892 . . . . 0.0 110.082 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 80.4 t -60.38 -47.23 93.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.25 -0.906 . . . . 0.0 110.084 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.477 ' CG2' ' CD2' ' A' ' 33' ' ' LEU . 58.2 t -60.58 -48.26 89.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.25 -0.906 . . . . 0.0 110.119 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.2 -44.09 92.25 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.224 -0.922 . . . . 0.0 109.943 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.455 ' O ' HD12 ' A' ' 67' ' ' LEU . . . -67.23 -44.87 78.42 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.361 -0.837 . . . . 0.0 109.934 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 99.5 t -67.26 -43.58 88.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.248 -0.907 . . . . 0.0 110.107 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -57.57 -35.8 70.84 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.282 -0.886 . . . . 0.0 110.116 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -55.03 -45.17 75.17 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.295 -0.878 . . . . 0.0 110.106 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.86 -37.32 85.85 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.347 -0.845 . . . . 0.0 110.192 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -61.12 -41.98 97.7 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.281 -0.887 . . . . 0.0 110.108 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 72.4 t -56.49 -21.34 12.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.265 -0.897 . . . . 0.0 110.078 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -113.71 30.03 7.55 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.475 -0.765 . . . . 0.0 110.094 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 24.5 pt-20 -73.13 148.75 89.1 Favored Pre-proline 0 N--CA 1.49 1.567 0 O-C-N 121.287 -0.883 . . . . 0.0 110.145 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -62.23 -18.88 64.71 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 O-C-N 123.979 1.515 . . . . 0.0 110.074 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 3.1 mmt85 . . . . . 0 N--CA 1.491 1.583 0 O-C-N 121.314 -0.866 . . . . 0.0 110.161 179.991 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.4 ptp . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.221 0.534 . . . . 0.0 110.218 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -140.41 23.14 2.35 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.174 -0.954 . . . . 0.0 110.258 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -128.23 -31.9 2.29 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.243 -0.911 . . . . 0.0 110.185 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 50.89 68.18 0.82 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.276 -0.89 . . . . 0.0 110.182 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.481 ' O ' ' N ' ' A' ' 7' ' ' ALA . 62.8 m-20 -93.52 -9.97 36.47 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.335 -0.853 . . . . 0.0 110.19 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.446 ' CB ' ' O ' ' A' ' 5' ' ' ASP . 1.3 m 67.21 -57.61 0.43 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.225 -0.922 . . . . 0.0 110.264 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.481 ' N ' ' O ' ' A' ' 5' ' ' ASP . . . -60.99 -46.89 88.91 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.271 -0.893 . . . . 0.0 109.843 179.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -54.28 -36.56 63.77 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.308 -0.87 . . . . 0.0 109.536 179.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 10.5 tp60 -62.44 -46.34 88.97 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.328 -0.858 . . . . 0.0 109.949 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.477 HG11 ' CD2' ' A' ' 14' ' ' PHE . 38.4 t -58.7 -41.48 82.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.342 -0.849 . . . . 0.0 109.963 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 51.0 mt -57.92 -49.58 80.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.328 -0.858 . . . . 0.0 109.427 179.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.91 -38.33 75.66 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 119.573 -0.851 . . . . 0.0 108.873 178.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.1 m -68.0 -40.55 83.0 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.486 -0.759 . . . . 0.0 109.294 179.048 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.554 ' CB ' ' CD1' ' A' ' 60' ' ' TYR . 4.1 m-85 -68.23 -41.35 81.36 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.303 -0.873 . . . . 0.0 109.649 179.467 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -54.43 -44.82 72.77 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.284 -0.885 . . . . 0.0 109.452 179.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.414 HG22 ' HA ' ' B' ' 9' ' ' LYS . 46.4 mt -62.22 -40.97 89.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.343 -0.848 . . . . 0.0 109.83 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.486 HD13 ' HB3' ' A' ' 32' ' ' GLU . 2.9 mm? -64.74 -41.69 95.74 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.218 -0.926 . . . . 0.0 109.829 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.453 ' O ' ' HB3' ' A' ' 19' ' ' SER . . . -81.76 4.24 22.77 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.323 -0.86 . . . . 0.0 110.201 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.453 ' HB3' ' O ' ' A' ' 18' ' ' ALA . 4.9 t 65.09 64.45 0.63 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.199 -0.938 . . . . 0.0 110.278 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 54.94 60.12 3.66 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.267 -0.896 . . . . 0.0 110.368 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.557 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 18.1 mttm -141.66 142.95 27.44 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.3 -0.875 . . . . 0.0 110.01 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -76.07 2.69 6.86 Favored 'Trans proline' 0 C--N 1.304 -1.803 0 O-C-N 124.147 1.604 . . . . 0.0 110.178 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.557 ' CZ ' ' HD3' ' A' ' 21' ' ' LYS . 32.9 p90 -143.7 155.08 44.09 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.307 -0.871 . . . . 0.0 110.107 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.525 HD13 ' CD2' ' A' ' 29' ' ' LEU . 0.4 OUTLIER -129.18 147.88 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.268 -0.895 . . . . 0.0 110.016 -179.871 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.47 ' N ' HD11 ' A' ' 24' ' ' ILE . 8.0 mp -92.14 146.37 23.78 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.134 -0.979 . . . . 0.0 110.431 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.14 -43.02 99.53 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.345 -0.847 . . . . 0.0 110.304 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -56.28 -39.6 72.92 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.252 -0.905 . . . . 0.0 109.834 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.454 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 0.7 OUTLIER -63.66 -45.44 90.17 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.427 -0.796 . . . . 0.0 109.523 179.724 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.531 ' CD1' HD11 ' A' ' 33' ' ' LEU . 3.1 mm? -58.32 -34.29 70.43 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.392 -0.818 . . . . 0.0 109.72 179.633 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 28.1 mtp180 -69.1 -34.78 75.64 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.354 -0.842 . . . . 0.0 110.652 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 10.1 ttt180 -93.88 -25.57 17.26 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.127 -0.983 . . . . 0.0 111.085 -179.176 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.486 ' HB3' HD13 ' A' ' 17' ' ' LEU . 2.7 mp0 -90.91 -23.34 20.52 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.0 -1.063 . . . . 0.0 111.197 -179.162 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.546 HD21 ' CB ' ' A' ' 37' ' ' GLN . 0.3 OUTLIER -128.61 160.86 60.59 Favored Pre-proline 0 N--CA 1.489 1.492 0 O-C-N 120.94 -1.1 . . . . 0.0 110.559 -179.606 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.446 ' HD2' ' CD2' ' A' ' 33' ' ' LEU . 28.0 Cg_exo -58.77 144.12 98.49 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 O-C-N 124.035 1.545 . . . . 0.0 110.241 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -46.64 -30.6 9.12 Favored 'Trans proline' 0 C--N 1.304 -1.78 0 O-C-N 124.093 1.575 . . . . 0.0 110.43 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -65.75 -47.37 75.48 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.22 -0.925 . . . . 0.0 110.556 -179.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.546 ' CB ' HD21 ' A' ' 33' ' ' LEU . 2.0 mp0 -69.66 -38.32 77.05 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.197 -0.94 . . . . 0.0 110.254 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.22 -44.03 79.16 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.319 -0.863 . . . . 0.0 110.293 -179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -64.88 -45.09 87.46 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.254 -0.904 . . . . 0.0 110.317 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -65.6 -47.21 76.48 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.166 -0.959 . . . . 0.0 110.39 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 62.8 m -65.36 -42.74 92.46 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.242 -0.911 . . . . 0.0 110.502 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.499 HG22 HD11 ' A' ' 42' ' ' ILE . 68.6 mt -71.68 -16.26 18.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.238 -0.914 . . . . 0.0 110.535 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.9 tptt -84.64 -17.55 38.25 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.221 -0.924 . . . . 0.0 110.263 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.579 ' HB2' ' CD2' ' A' ' 63' ' ' PHE . 4.9 mtt85 -105.13 -66.54 0.97 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.321 -0.862 . . . . 0.0 110.563 -179.628 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.53 ' C ' ' O ' ' A' ' 44' ' ' ARG . 3.1 ttm -26.35 108.98 0.2 Allowed Pre-proline 0 N--CA 1.499 1.985 0 O-C-N 121.877 -0.515 . . . . 0.0 111.495 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.461 ' HG2' ' OD1' ' A' ' 59' ' ' ASP . 10.8 Cg_endo -79.29 -167.74 0.54 Allowed 'Trans proline' 0 C--N 1.307 -1.646 0 O-C-N 123.971 1.511 . . . . 0.0 110.227 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.439 ' O ' ' C ' ' A' ' 48' ' ' TYR . . . -86.6 121.82 29.66 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.247 -0.908 . . . . 0.0 110.477 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.626 ' O ' ' CD1' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -41.32 136.87 1.57 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.279 -0.888 . . . . 0.0 110.561 179.683 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.8 m -81.32 -99.24 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.933 -1.104 . . . . 0.0 110.22 -179.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . 0.633 ' N ' ' CD ' ' A' ' 51' ' ' PRO . . . -125.58 38.92 2.16 Favored Glycine 0 N--CA 1.488 2.149 0 C-N-CA 119.559 -1.305 . . . . 0.0 110.635 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.633 ' CD ' ' N ' ' A' ' 50' ' ' GLY . 68.2 Cg_endo -90.13 20.31 1.05 Allowed 'Trans proline' 0 C--N 1.313 -1.292 0 O-C-N 123.407 1.214 . . . . 0.0 109.769 179.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.418 ' O ' ' O ' ' A' ' 53' ' ' SER . . . 92.05 -119.34 5.75 Favored Glycine 0 N--CA 1.489 2.189 0 N-CA-C 109.145 -1.582 . . . . 0.0 109.145 -179.348 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.576 ' OG ' ' CD2' ' A' ' 48' ' ' TYR . 0.3 OUTLIER 47.14 -172.92 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.156 -1.203 . . . . 0.0 110.352 179.9 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.545 ' N ' ' OG ' ' A' ' 53' ' ' SER . 13.0 m -136.2 168.85 15.33 Favored Pre-proline 0 C--N 1.292 -1.9 0 C-N-CA 120.444 -0.503 . . . . 0.0 110.375 -179.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.477 ' HD2' ' HB ' ' A' ' 54' ' ' VAL . 9.2 Cg_endo -56.09 136.65 76.08 Favored 'Trans proline' 0 C--N 1.306 -1.668 0 O-C-N 124.075 1.566 . . . . 0.0 110.207 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 104.7 -17.4 46.04 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.359 -1.497 . . . . 0.0 109.359 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -92.29 120.69 33.08 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.292 -1.123 . . . . 0.0 110.12 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.579 ' CD2' ' N ' ' A' ' 58' ' ' LEU . 3.0 mm? -92.89 160.54 14.86 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.289 -0.882 . . . . 0.0 109.965 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.515 ' N ' ' HG2' ' A' ' 45' ' ' MET . 0.7 OUTLIER -105.89 110.16 22.36 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.09 -1.006 . . . . 0.0 110.741 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.554 ' CD1' ' CB ' ' A' ' 14' ' ' PHE . 28.6 p90 -77.49 -19.26 56.16 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.93 -42.59 76.36 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.126 -0.984 . . . . 0.0 108.474 178.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.92 -31.96 72.32 Favored 'General case' 0 N--CA 1.488 1.444 0 CA-C-O 121.931 0.872 . . . . 0.0 108.961 178.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.579 ' CD2' ' HB2' ' A' ' 44' ' ' ARG . 25.7 t80 -60.59 -41.98 95.8 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.792 -0.567 . . . . 0.0 110.412 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.404 ' OG ' ' N ' ' A' ' 65' ' ' SER . 6.2 p -63.1 -50.68 69.56 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.147 -0.971 . . . . 0.0 110.456 -179.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.404 ' N ' ' OG ' ' A' ' 64' ' ' SER . 16.0 m -69.54 -35.68 75.67 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.145 -0.972 . . . . 0.0 110.43 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.36 -39.56 81.77 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.35 -0.844 . . . . 0.0 110.872 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.561 HD13 ' CE1' ' A' ' 63' ' ' PHE . 1.3 mt -75.09 -44.06 49.49 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.079 -1.013 . . . . 0.0 110.485 -179.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -96.22 14.06 25.36 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.2 -0.938 . . . . 0.0 110.397 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.408 ' O ' ' C ' ' A' ' 70' ' ' GLU . . . -87.54 -97.35 0.9 Allowed Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 179.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.408 ' C ' ' O ' ' A' ' 69' ' ' GLY . 2.0 tt0 42.18 38.65 1.17 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.388 -1.066 . . . . 0.0 110.439 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.2 m -90.23 107.67 19.28 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.295 -0.878 . . . . 0.0 110.06 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -69.4 135.62 50.54 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.308 -0.87 . . . . 0.0 110.274 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.485 ' C ' ' CD1' ' A' ' 73' ' ' LEU . 1.1 pp . . . . . 0 N--CA 1.491 1.624 0 O-C-N 121.269 -0.894 . . . . 0.0 110.309 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.252 0 N-CA-C 109.499 -1.441 . . . . 0.0 109.499 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.89 -34.77 5.0 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.231 -1.158 . . . . 0.0 110.095 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.414 ' HA ' HG22 ' A' ' 16' ' ' ILE . 0.1 OUTLIER -66.06 -40.14 90.67 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.256 -0.903 . . . . 0.0 110.194 179.839 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.43 -43.98 79.96 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.323 -0.861 . . . . 0.0 110.113 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -60.33 -40.85 92.11 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.285 -0.884 . . . . 0.0 110.093 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . 0.423 ' O ' HG22 ' B' ' 16' ' ' VAL . . . -65.86 -45.23 82.93 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.303 -0.873 . . . . 0.0 110.14 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.422 ' O ' ' CG2' ' B' ' 17' ' ' VAL . 76.5 t -57.77 -42.44 81.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.292 -0.88 . . . . 0.0 110.121 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.97 -40.13 96.78 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.246 -0.909 . . . . 0.0 110.132 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 42.8 m -63.87 -43.74 95.18 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.227 -0.921 . . . . 0.0 110.16 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.423 HG22 ' O ' ' B' ' 12' ' ' ALA . 66.2 t -65.97 -43.61 92.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.263 -0.898 . . . . 0.0 110.096 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.442 HG21 HD23 ' A' ' 33' ' ' LEU . 31.9 t -63.77 -45.83 96.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.294 -0.879 . . . . 0.0 110.111 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.13 -37.07 83.74 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.258 -0.901 . . . . 0.0 110.041 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.99 -42.68 89.5 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.301 -0.874 . . . . 0.0 110.178 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 69.3 t -65.42 -40.73 89.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.252 -0.905 . . . . 0.0 110.141 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.75 -35.98 82.81 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.379 -0.825 . . . . 0.0 110.089 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.2 -43.62 95.78 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.402 -0.811 . . . . 0.0 110.186 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . 0.445 ' CB ' HD23 ' A' ' 67' ' ' LEU . . . -64.92 -35.25 80.56 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.23 -0.919 . . . . 0.0 110.474 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 5.4 ttt180 -68.32 -46.44 70.22 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.124 -0.985 . . . . 0.0 110.359 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 60.7 t -60.91 -21.79 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.209 -0.932 . . . . 0.0 110.282 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 2.1 tpt85 52.14 58.57 5.29 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.405 -0.809 . . . . 0.0 110.25 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -101.33 131.12 23.5 Favored Pre-proline 0 N--CA 1.493 1.707 0 O-C-N 121.285 -0.885 . . . . 0.0 110.273 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -61.99 -157.08 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.733 0 O-C-N 123.988 1.52 . . . . 0.0 110.227 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 5.2 ptt-85 . . . . . 0 N--CA 1.492 1.64 0 O-C-N 121.231 -0.918 . . . . 0.0 110.29 179.935 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.5 mtp . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 121.327 0.584 . . . . 0.0 110.241 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -138.39 70.25 1.38 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.205 -0.934 . . . . 0.0 110.265 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 51.4 -153.54 0.18 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.213 -0.929 . . . . 0.0 110.172 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -120.33 178.73 4.54 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.235 -0.916 . . . . 0.0 110.184 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.507 ' O ' ' N ' ' A' ' 7' ' ' ALA . 1.3 t0 -155.99 48.63 0.5 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.186 -0.946 . . . . 0.0 110.336 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.445 ' CB ' ' O ' ' A' ' 5' ' ' ASP . 1.7 m 65.09 -66.6 0.14 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.264 -0.897 . . . . 0.0 110.23 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.507 ' N ' ' O ' ' A' ' 5' ' ' ASP . . . -63.85 -47.56 80.24 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.226 -0.921 . . . . 0.0 109.814 179.726 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -54.45 -36.05 63.67 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.31 -0.869 . . . . 0.0 109.797 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -61.66 -37.6 84.63 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.346 -0.847 . . . . 0.0 110.285 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.0 t -58.15 -50.55 77.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.172 -0.955 . . . . 0.0 109.646 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 23.4 mt -55.01 -49.95 67.13 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 121.276 -0.89 . . . . 0.0 109.153 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.07 -39.31 78.22 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.352 -0.843 . . . . 0.0 108.739 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 72.5 m -66.84 -41.11 87.95 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.46 -0.775 . . . . 0.0 109.087 179.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.574 ' HB3' ' CE2' ' A' ' 60' ' ' TYR . 5.1 m-85 -67.24 -41.42 85.67 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.368 -0.832 . . . . 0.0 109.322 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.7 ttt-85 -54.52 -44.62 72.91 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.427 -0.796 . . . . 0.0 109.632 179.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.443 HG22 HD11 ' A' ' 16' ' ' ILE . 44.3 mt -60.93 -44.65 98.41 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.368 -0.832 . . . . 0.0 109.953 179.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.444 HD22 HG21 ' B' ' 13' ' ' VAL . 3.2 mm? -64.41 -39.78 94.5 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.224 -0.923 . . . . 0.0 109.84 179.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.463 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -77.09 -4.26 43.47 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.306 -0.871 . . . . 0.0 110.044 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.463 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 66.93 63.34 0.47 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.266 -0.896 . . . . 0.0 110.359 179.895 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 55.59 62.16 2.55 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.276 -0.89 . . . . 0.0 110.432 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' A' ' 19' ' ' SER . 19.3 mttt -144.73 143.89 22.72 Favored Pre-proline 0 N--CA 1.49 1.563 0 O-C-N 121.329 -0.857 . . . . 0.0 109.887 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -73.72 -0.25 9.13 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 O-C-N 123.938 1.494 . . . . 0.0 110.094 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 13.6 p90 -146.38 155.66 42.76 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.286 -0.884 . . . . 0.0 110.283 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.529 HD12 ' N ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -124.18 142.22 41.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.427 -0.795 . . . . 0.0 109.754 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.529 ' N ' HD12 ' A' ' 24' ' ' ILE . 3.8 mp -80.23 136.54 36.48 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.136 -0.977 . . . . 0.0 110.003 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.32 -41.02 96.33 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.268 -0.895 . . . . 0.0 109.912 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.15 -42.77 77.49 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.38 -0.825 . . . . 0.0 109.541 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.457 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 64.0 tt0 -69.41 -42.39 75.13 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.501 -0.749 . . . . 0.0 109.648 179.541 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.526 HD22 ' CB ' ' A' ' 41' ' ' CYS . 1.2 tp -62.56 -41.4 98.89 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.412 -0.805 . . . . 0.0 108.92 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.53 ' HA ' ' CB ' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -62.43 -33.65 75.22 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.652 -0.655 . . . . 0.0 110.257 179.619 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.3 ttm180 -96.72 -24.8 15.79 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.355 -0.841 . . . . 0.0 111.504 -179.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.457 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 7.7 mm-40 -80.06 -21.55 43.3 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.815 -1.178 . . . . 0.0 111.073 -179.088 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.477 HD22 ' HD3' ' A' ' 34' ' ' PRO . 7.3 mt -116.72 169.65 6.96 Favored Pre-proline 0 C--N 1.303 -1.426 0 O-C-N 120.939 -1.101 . . . . 0.0 111.164 -179.076 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.546 ' CB ' ' HD2' ' A' ' 35' ' ' PRO . 35.3 Cg_exo -58.41 -149.39 0.01 OUTLIER 'Trans proline' 0 C--N 1.307 -1.62 0 O-C-N 124.225 1.645 . . . . 0.0 109.984 179.668 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.546 ' HD2' ' CB ' ' A' ' 34' ' ' PRO . 10.8 Cg_endo -96.24 -44.19 0.02 OUTLIER 'Trans proline' 0 C--N 1.308 -1.603 0 O-C-N 123.647 1.34 . . . . 0.0 110.451 179.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.2 -41.17 90.57 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.309 -0.869 . . . . 0.0 111.096 -179.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 10.7 mp0 -69.68 -44.82 69.67 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.061 -1.024 . . . . 0.0 111.011 -179.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.53 ' CB ' ' HA ' ' A' ' 30' ' ' ARG . . . -62.58 -46.76 86.85 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.306 -0.871 . . . . 0.0 110.769 -179.391 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 15.0 tm0? -65.86 -43.99 86.79 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.177 -0.952 . . . . 0.0 111.067 -179.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -65.51 -42.39 92.1 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.065 -1.022 . . . . 0.0 110.631 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.526 ' CB ' HD22 ' A' ' 29' ' ' LEU . 34.9 m -58.08 -50.51 73.2 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.189 -0.944 . . . . 0.0 110.548 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -58.4 -22.36 19.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.107 -0.995 . . . . 0.0 110.131 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -82.15 -15.41 53.43 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.136 -0.978 . . . . 0.0 110.609 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.56 ' HG3' ' CE1' ' A' ' 63' ' ' PHE . 0.8 OUTLIER -113.68 -60.03 1.94 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.033 -1.042 . . . . 0.0 110.682 -179.818 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.544 ' CE ' ' HB3' ' A' ' 60' ' ' TYR . 3.0 ttm -35.3 100.37 0.19 Allowed Pre-proline 0 N--CA 1.495 1.804 0 O-C-N 121.547 -0.72 . . . . 0.0 111.085 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.459 ' O ' HD11 ' A' ' 58' ' ' LEU . 18.7 Cg_exo -71.59 -168.09 0.33 Allowed 'Trans proline' 0 C--N 1.305 -1.757 0 O-C-N 124.099 1.578 . . . . 0.0 110.073 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.21 146.49 43.3 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.249 -0.907 . . . . 0.0 110.127 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.576 ' CE2' ' CB ' ' A' ' 53' ' ' SER . 0.1 OUTLIER -53.56 -177.54 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.223 -0.923 . . . . 0.0 110.429 -179.917 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -162.29 77.65 0.49 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.246 -0.909 . . . . 0.0 110.102 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -172.79 158.09 27.84 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -70.04 114.43 3.75 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 124.009 1.531 . . . . 0.0 110.368 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.498 ' O ' ' HB2' ' A' ' 53' ' ' SER . . . 101.58 133.21 8.01 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.673 -1.371 . . . . 0.0 109.673 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.576 ' CB ' ' CE2' ' A' ' 48' ' ' TYR . 45.2 t 178.23 -152.1 0.02 OUTLIER 'General case' 0 C--N 1.307 -1.251 0 O-C-N 121.454 -1.027 . . . . 0.0 110.054 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.455 ' HB ' ' HD2' ' A' ' 55' ' ' PRO . 33.5 m -146.57 171.65 6.15 Favored Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.232 -0.917 . . . . 0.0 110.208 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.455 ' HD2' ' HB ' ' A' ' 54' ' ' VAL . 19.7 Cg_endo -72.86 74.31 2.88 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 O-C-N 123.945 1.498 . . . . 0.0 110.207 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 141.64 44.23 0.06 OUTLIER Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.359 -1.496 . . . . 0.0 109.359 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.473 ' O ' ' HB3' ' A' ' 48' ' ' TYR . . . -106.36 112.72 25.86 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.183 -1.186 . . . . 0.0 110.361 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.594 ' CD2' ' N ' ' A' ' 58' ' ' LEU . 3.3 mm? -105.94 160.29 15.38 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.25 -0.907 . . . . 0.0 109.511 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.451 ' C ' ' HG3' ' A' ' 45' ' ' MET . 1.7 m-20 -113.71 111.02 21.12 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.111 -0.993 . . . . 0.0 111.055 -179.365 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.574 ' CE2' ' HB3' ' A' ' 14' ' ' PHE . 15.6 p90 -76.35 -22.76 54.49 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.376 -0.828 . . . . 0.0 109.901 179.422 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.55 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.79 -38.91 70.56 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.341 -0.849 . . . . 0.0 109.632 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.3 -34.68 76.6 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.208 -0.932 . . . . 0.0 109.424 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.56 ' CE1' ' HG3' ' A' ' 44' ' ' ARG . 4.4 t80 -72.0 -35.84 69.57 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.655 -0.653 . . . . 0.0 110.044 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.5 p -60.83 -49.88 75.71 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.234 -0.916 . . . . 0.0 110.333 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 66.0 p -64.98 -43.84 91.28 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.162 -0.962 . . . . 0.0 110.218 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.48 -31.63 69.52 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.305 -0.872 . . . . 0.0 110.216 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.421 ' CD1' ' CZ ' ' A' ' 63' ' ' PHE . 0.6 OUTLIER -65.61 -36.97 85.27 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.203 -0.935 . . . . 0.0 110.202 -179.926 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.4 ' N ' ' CD1' ' A' ' 68' ' ' TYR . 11.1 m-85 -86.77 -21.43 26.54 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.291 -0.881 . . . . 0.0 110.203 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -132.64 116.34 1.77 Allowed Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.554 -1.419 . . . . 0.0 109.554 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -74.02 -61.62 1.79 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.185 -1.185 . . . . 0.0 110.218 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -174.11 -60.64 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.226 -0.921 . . . . 0.0 110.199 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -83.23 115.32 21.9 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.177 -0.952 . . . . 0.0 110.213 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.661 0 O-C-N 121.273 -0.892 . . . . 0.0 110.188 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.256 0 N-CA-C 109.571 -1.411 . . . . 0.0 109.571 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.74 -48.86 4.35 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.194 -1.18 . . . . 0.0 110.17 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.76 -45.3 94.5 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.164 -0.96 . . . . 0.0 110.15 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.9 -35.72 69.3 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.232 -0.917 . . . . 0.0 110.042 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -65.26 -45.49 84.34 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.259 -0.901 . . . . 0.0 110.126 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . 0.411 ' HB1' HD11 ' A' ' 16' ' ' ILE . . . -62.91 -39.16 93.72 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.248 -0.907 . . . . 0.0 110.106 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.444 HG21 HD22 ' A' ' 17' ' ' LEU . 25.1 t -62.45 -42.73 96.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.357 -0.839 . . . . 0.0 110.154 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.7 -40.24 83.06 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.264 -0.898 . . . . 0.0 110.097 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' THR . . . . . 0.457 ' O ' ' HB2' ' B' ' 19' ' ' ALA . 1.3 m -62.36 -48.19 80.88 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.32 -0.863 . . . . 0.0 110.203 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 46.7 t -64.07 -43.62 97.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.247 -0.908 . . . . 0.0 110.268 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.416 HG22 ' O ' ' B' ' 13' ' ' VAL . 45.2 t -63.01 -49.31 84.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.244 -0.91 . . . . 0.0 110.317 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.34 -32.67 74.15 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.186 -0.946 . . . . 0.0 110.305 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.457 ' HB2' ' O ' ' B' ' 15' ' ' THR . . . -67.47 -44.88 77.53 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.198 -0.939 . . . . 0.0 110.411 -179.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 97.6 t -67.17 -42.52 88.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.237 -0.914 . . . . 0.0 110.361 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -65.14 -31.73 73.07 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.255 -0.903 . . . . 0.0 110.447 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . 0.465 ' O ' HG11 ' B' ' 25' ' ' VAL . 6.1 tp60 -64.16 -49.54 71.7 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.173 -0.954 . . . . 0.0 110.573 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . 0.413 ' CB ' ' CD2' ' A' ' 67' ' ' LEU . . . -65.19 -34.69 78.97 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.101 -0.999 . . . . 0.0 110.505 -179.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.7 ttp85 -66.65 -36.56 82.85 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.289 -0.882 . . . . 0.0 110.634 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . 0.465 HG11 ' O ' ' B' ' 22' ' ' GLN . 1.3 p -74.04 -21.18 17.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.049 -1.032 . . . . 0.0 110.304 -179.712 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.437 ' N ' HG11 ' B' ' 25' ' ' VAL . 2.1 ttm180 51.18 57.9 6.12 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.402 -0.811 . . . . 0.0 110.215 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -101.84 126.3 34.34 Favored Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.359 -0.838 . . . . 0.0 110.171 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_exo -87.93 -46.7 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.633 0 O-C-N 123.982 1.517 . . . . 0.0 110.318 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 7.1 mtt-85 . . . . . 0 N--CA 1.493 1.683 0 O-C-N 121.299 -0.876 . . . . 0.0 110.232 179.925 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 121.254 0.549 . . . . 0.0 110.258 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -146.65 -86.62 0.1 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.265 -0.897 . . . . 0.0 110.251 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.41 ' O ' ' C ' ' A' ' 4' ' ' THR . 3.7 t0 51.67 -176.95 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.214 -0.929 . . . . 0.0 110.103 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.415 ' O ' ' CG ' ' A' ' 5' ' ' ASP . 0.0 OUTLIER 43.62 54.65 5.37 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.235 -0.916 . . . . 0.0 110.279 179.954 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.415 ' CG ' ' O ' ' A' ' 4' ' ' THR . 11.1 m-20 -165.29 136.17 3.88 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.219 -0.926 . . . . 0.0 110.406 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.64 ' CG2' ' CZ ' ' A' ' 68' ' ' TYR . 31.3 m -108.54 -71.12 0.77 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.24 -0.913 . . . . 0.0 109.985 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.7 -38.29 89.83 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.181 -0.949 . . . . 0.0 109.098 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -59.14 -35.05 72.81 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.585 -0.697 . . . . 0.0 109.57 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.458 ' O ' ' OG ' ' A' ' 13' ' ' SER . 1.8 tt0 -60.87 -44.29 97.25 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.338 -0.851 . . . . 0.0 110.311 -179.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 95.7 t -65.66 -41.46 90.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 120.978 -1.076 . . . . 0.0 109.846 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.414 HG22 HD11 ' A' ' 11' ' ' ILE . 75.2 mt -65.54 -47.47 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.273 -0.892 . . . . 0.0 109.448 179.571 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.76 -45.99 85.16 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.338 -0.851 . . . . 0.0 108.763 179.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.493 ' HB2' ' CG2' ' B' ' 16' ' ' VAL . 1.5 p -63.12 -42.98 99.63 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.416 -0.803 . . . . 0.0 108.949 178.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -63.61 -41.8 98.28 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.319 -0.863 . . . . 0.0 109.266 179.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.625 ' NH2' ' CE2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -55.98 -41.49 74.86 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.482 -0.761 . . . . 0.0 109.321 179.14 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.526 ' CD1' ' HB2' ' B' ' 12' ' ' ALA . 77.1 mt -61.82 -45.08 99.47 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 O-C-N 121.355 -0.84 . . . . 0.0 109.953 179.545 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 19.9 mt -65.09 -41.31 95.12 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.183 -0.948 . . . . 0.0 110.092 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.455 ' O ' ' HB2' ' A' ' 21' ' ' LYS . . . -73.52 -0.26 14.57 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.253 -0.905 . . . . 0.0 110.229 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.473 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 0.1 OUTLIER 56.71 54.59 7.13 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.216 -0.927 . . . . 0.0 110.381 179.834 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.473 ' HB2' ' O ' ' A' ' 19' ' ' SER . 0.8 OUTLIER 58.43 45.25 16.93 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.255 -0.903 . . . . 0.0 110.384 179.765 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.533 ' O ' ' NH2' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -113.15 145.78 33.86 Favored Pre-proline 0 N--CA 1.494 1.746 0 O-C-N 121.15 -0.969 . . . . 0.0 110.267 179.849 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.569 ' HG2' ' CE2' ' A' ' 23' ' ' TYR . 12.3 Cg_endo -61.25 -11.39 18.92 Favored 'Trans proline' 0 C--N 1.303 -1.838 0 O-C-N 123.971 1.511 . . . . 0.0 109.843 179.292 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.569 ' CE2' ' HG2' ' A' ' 22' ' ' PRO . 8.4 p90 -150.2 170.82 18.05 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.243 -0.911 . . . . 0.0 110.292 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.493 HG21 HD11 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -123.11 145.09 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.329 -0.857 . . . . 0.0 109.878 179.906 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.489 ' N ' HD11 ' A' ' 24' ' ' ILE . 0.4 OUTLIER -94.44 146.75 23.86 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.157 -0.964 . . . . 0.0 110.281 -179.739 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.475 ' O ' ' HG ' ' A' ' 29' ' ' LEU . . . -62.42 -34.49 76.87 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.214 -0.929 . . . . 0.0 110.009 179.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -70.43 -34.17 72.16 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.357 -0.84 . . . . 0.0 110.223 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.466 ' O ' ' HG2' ' A' ' 32' ' ' GLU . 1.5 tp10 -66.32 -50.94 61.94 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.334 -0.854 . . . . 0.0 110.297 -179.711 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.561 ' CD1' ' N ' ' A' ' 30' ' ' ARG . 4.4 pp -66.94 -33.57 75.86 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.086 -1.009 . . . . 0.0 109.081 179.243 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.561 ' N ' ' CD1' ' A' ' 29' ' ' LEU . 4.6 mtt-85 -55.82 -34.8 65.69 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.432 -0.793 . . . . 0.0 109.795 179.304 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -92.81 -18.68 22.57 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.366 -0.834 . . . . 0.0 110.373 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 28' ' ' GLU . 43.8 mm-40 -92.35 -23.32 19.28 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.122 -0.986 . . . . 0.0 110.53 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.485 ' CD2' HG21 ' B' ' 17' ' ' VAL . 0.5 OUTLIER -122.62 144.28 42.03 Favored Pre-proline 0 N--CA 1.487 1.388 0 O-C-N 121.158 -0.964 . . . . 0.0 110.342 -179.791 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.454 ' HD2' HD21 ' A' ' 33' ' ' LEU . 2.4 Cg_endo -46.42 136.54 15.34 Favored 'Trans proline' 0 C--N 1.305 -1.743 0 O-C-N 123.945 1.497 . . . . 0.0 109.67 179.545 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.441 ' C ' ' O ' ' A' ' 34' ' ' PRO . 26.5 Cg_exo -38.07 -37.75 0.66 Allowed 'Trans proline' 0 C--N 1.304 -1.78 0 O-C-N 124.112 1.585 . . . . 0.0 110.784 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -65.93 -47.64 74.04 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.242 -0.911 . . . . 0.0 110.862 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.473 ' HB3' HD23 ' A' ' 33' ' ' LEU . 2.2 mp0 -70.31 -45.55 66.02 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.176 -0.953 . . . . 0.0 110.714 -179.548 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.499 ' CB ' ' HA ' ' A' ' 30' ' ' ARG . . . -55.98 -44.74 78.83 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.279 -0.888 . . . . 0.0 110.663 -179.45 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.8 -40.29 79.55 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.238 -0.914 . . . . 0.0 110.664 -179.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.462 ' HB3' HG12 ' B' ' 20' ' ' VAL . 0.2 OUTLIER -65.11 -45.43 85.17 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.159 -0.963 . . . . 0.0 110.573 -179.769 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.478 ' O ' ' HG2' ' A' ' 45' ' ' MET . 49.2 m -65.29 -51.44 60.69 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.178 -0.951 . . . . 0.0 110.731 -179.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.463 HG13 HD12 ' A' ' 29' ' ' LEU . 97.3 mt -45.26 -27.89 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.098 -1.001 . . . . 0.0 110.29 -179.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.8 tttp -86.14 -37.36 18.84 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.307 -0.871 . . . . 0.0 110.245 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.585 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 19.1 mmt180 -69.11 -76.47 0.09 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.358 -0.839 . . . . 0.0 110.75 -179.491 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.559 ' CB ' ' O ' ' A' ' 59' ' ' ASP . 2.8 ptp -39.42 102.73 0.26 Allowed Pre-proline 0 N--CA 1.493 1.675 0 O-C-N 121.417 -0.802 . . . . 0.0 110.41 -179.225 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.509 ' HD2' ' CB ' ' A' ' 62' ' ' ALA . 13.6 Cg_endo -59.8 -158.79 0.02 OUTLIER 'Trans proline' 0 C--N 1.307 -1.634 0 O-C-N 124.448 1.762 . . . . 0.0 110.986 -179.341 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.474 ' O ' ' O ' ' A' ' 48' ' ' TYR . . . -75.12 120.19 20.3 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.419 -0.801 . . . . 0.0 110.888 -179.513 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.474 ' O ' ' O ' ' A' ' 47' ' ' ALA . 24.2 p90 -41.32 166.76 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.478 -0.764 . . . . 0.0 110.68 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -174.99 63.91 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.308 -0.87 . . . . 0.0 110.133 179.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . 0.467 ' O ' ' OG ' ' A' ' 53' ' ' SER . . . -137.82 -179.22 16.77 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -62.29 133.66 44.61 Favored 'Trans proline' 0 C--N 1.305 -1.757 0 O-C-N 123.997 1.525 . . . . 0.0 110.328 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.46 ' O ' ' C ' ' A' ' 53' ' ' SER . . . 84.65 5.26 86.82 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.477 ' O ' HG11 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -35.9 139.03 0.15 Allowed 'General case' 0 C--N 1.308 -1.224 0 O-C-N 121.697 -0.884 . . . . 0.0 111.045 -179.69 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.484 HG23 ' CZ ' ' A' ' 23' ' ' TYR . 27.4 m -143.15 165.78 23.92 Favored Pre-proline 0 C--N 1.296 -1.723 0 O-C-N 121.69 -0.631 . . . . 0.0 110.273 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -69.27 140.98 45.93 Favored 'Trans proline' 0 C--N 1.306 -1.669 0 O-C-N 123.929 1.489 . . . . 0.0 110.342 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 90.49 -11.85 70.13 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.437 ' O ' ' CD1' ' A' ' 48' ' ' TYR . . . -79.11 146.41 33.23 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.178 -1.19 . . . . 0.0 110.354 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 64.8 mt -132.7 153.48 51.1 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.277 -0.889 . . . . 0.0 109.666 179.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.559 ' O ' ' CB ' ' A' ' 45' ' ' MET . 12.6 t0 -86.98 109.62 19.5 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.033 -1.042 . . . . 0.0 110.326 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.625 ' CE2' ' NH2' ' A' ' 15' ' ' ARG . 26.1 p90 -83.57 -21.96 32.49 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.327 -0.858 . . . . 0.0 109.123 179.17 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.429 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -67.46 -37.72 83.36 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.454 -0.779 . . . . 0.0 109.548 179.472 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.509 ' CB ' ' HD2' ' A' ' 46' ' ' PRO . . . -63.66 -33.02 74.7 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.148 -0.97 . . . . 0.0 109.846 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.585 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 4.1 t80 -71.84 -34.48 69.32 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.503 -0.748 . . . . 0.0 110.163 179.699 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 33.7 p -66.44 -49.77 65.61 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.238 -0.914 . . . . 0.0 110.458 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.44 ' O ' ' N ' ' A' ' 69' ' ' GLY . 0.2 OUTLIER -64.74 -39.56 93.83 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.202 -0.936 . . . . 0.0 110.308 -179.974 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.88 -36.38 80.15 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.246 -0.909 . . . . 0.0 110.329 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.42 HD13 ' CZ ' ' A' ' 63' ' ' PHE . 0.4 OUTLIER -58.57 -42.25 87.55 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.162 -0.961 . . . . 0.0 110.251 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.64 ' CZ ' ' CG2' ' A' ' 6' ' ' THR . 10.5 m-85 -97.92 -23.74 15.69 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.316 -0.865 . . . . 0.0 110.218 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.44 ' N ' ' O ' ' A' ' 65' ' ' SER . . . -65.65 -129.03 0.01 OUTLIER Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -113.56 -170.13 1.64 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.192 -1.181 . . . . 0.0 110.205 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 60.1 p -79.99 -150.33 0.06 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.291 -0.881 . . . . 0.0 110.188 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -94.17 130.02 40.53 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.155 -0.965 . . . . 0.0 110.233 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.636 0 O-C-N 121.351 -0.843 . . . . 0.0 110.178 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' GLY . . . . . 0.466 ' O ' ' N ' ' B' ' 9' ' ' LYS . . . . . . . . 0 N--CA 1.49 2.234 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.452 ' CB ' ' O ' ' B' ' 7' ' ' GLY . 0.0 OUTLIER 66.28 -62.56 0.26 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.202 -1.176 . . . . 0.0 110.241 -179.89 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.466 ' N ' ' O ' ' B' ' 7' ' ' GLY . 0.6 OUTLIER -58.19 -44.54 88.12 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.166 -0.959 . . . . 0.0 110.051 179.859 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.98 -34.89 78.48 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.266 -0.897 . . . . 0.0 109.982 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -65.55 -40.41 92.83 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.259 -0.9 . . . . 0.0 109.924 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . 0.526 ' HB2' ' CD1' ' A' ' 16' ' ' ILE . . . -62.89 -39.38 94.3 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.322 -0.861 . . . . 0.0 109.871 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.436 ' O ' ' CG2' ' B' ' 17' ' ' VAL . 99.4 t -60.37 -41.59 87.86 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.349 -0.844 . . . . 0.0 109.883 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.78 -42.27 95.22 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.321 -0.862 . . . . 0.0 110.061 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 22.2 m -61.91 -46.07 90.96 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.215 -0.928 . . . . 0.0 110.061 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.493 ' CG2' ' HB2' ' A' ' 13' ' ' SER . 21.1 t -64.39 -41.76 93.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.228 -0.92 . . . . 0.0 110.014 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.485 HG21 ' CD2' ' A' ' 33' ' ' LEU . 91.0 t -60.09 -46.23 94.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.275 -0.891 . . . . 0.0 110.136 179.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.17 -42.21 98.17 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.238 -0.913 . . . . 0.0 110.18 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.37 -43.82 89.52 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.256 -0.902 . . . . 0.0 110.212 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . 0.462 HG12 ' HB3' ' A' ' 40' ' ' TYR . 55.7 t -67.46 -45.57 85.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.256 -0.902 . . . . 0.0 110.169 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -57.25 -33.47 67.62 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.349 -0.844 . . . . 0.0 110.241 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.03 -45.88 90.22 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.248 -0.908 . . . . 0.0 110.211 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . 0.413 ' HB1' HD22 ' A' ' 67' ' ' LEU . . . -58.51 -35.02 71.61 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.175 -0.953 . . . . 0.0 110.198 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 44.7 ttt180 -66.0 -35.26 80.08 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.218 -0.926 . . . . 0.0 110.185 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 78.0 t -60.91 -21.68 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.244 -0.91 . . . . 0.0 110.296 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 3.9 ttt180 63.08 69.25 0.59 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.48 -0.763 . . . . 0.0 110.121 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.8 139.15 85.68 Favored Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.363 -0.836 . . . . 0.0 110.202 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -75.84 70.21 5.93 Favored 'Trans proline' 0 C--N 1.305 -1.721 0 O-C-N 123.949 1.5 . . . . 0.0 110.29 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 O-C-N 121.166 -0.959 . . . . 0.0 110.29 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.191 0.519 . . . . 0.0 110.193 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -173.08 -81.29 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.221 -0.924 . . . . 0.0 110.242 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -140.91 177.09 8.29 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.218 -0.926 . . . . 0.0 110.276 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.6 m -130.16 164.54 24.25 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.289 -0.882 . . . . 0.0 110.134 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.506 ' O ' ' N ' ' A' ' 7' ' ' ALA . 0.2 OUTLIER -173.45 51.48 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.23 -0.919 . . . . 0.0 110.325 -179.968 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.629 ' CG2' ' CZ ' ' A' ' 68' ' ' TYR . 1.9 m 64.59 -68.36 0.1 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.23 -0.919 . . . . 0.0 110.375 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.506 ' N ' ' O ' ' A' ' 5' ' ' ASP . . . -68.36 -39.6 81.76 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.258 -0.901 . . . . 0.0 109.831 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -67.39 -36.45 81.33 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.392 -0.817 . . . . 0.0 109.9 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 6.0 tp60 -61.29 -45.97 92.24 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.327 -0.858 . . . . 0.0 110.139 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.563 ' CG1' ' CE2' ' A' ' 14' ' ' PHE . 75.6 t -58.05 -44.88 88.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.24 -0.913 . . . . 0.0 110.071 179.844 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 73.1 mt -54.78 -48.51 73.12 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.239 -0.913 . . . . 0.0 109.716 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.74 -42.67 84.39 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.173 -0.954 . . . . 0.0 109.099 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.463 ' HA ' ' HB3' ' B' ' 12' ' ' ALA . 2.2 m -68.1 -39.75 82.77 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.496 -0.753 . . . . 0.0 109.356 179.134 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.563 ' CE2' ' CG1' ' A' ' 10' ' ' VAL . 2.4 m-85 -68.58 -42.09 78.73 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.307 -0.871 . . . . 0.0 109.528 179.293 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.3 ttt-85 -53.34 -46.78 69.63 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.284 -0.885 . . . . 0.0 109.42 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.424 HG22 HD11 ' A' ' 16' ' ' ILE . 37.8 mt -59.42 -42.54 87.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.352 -0.842 . . . . 0.0 109.571 179.446 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mp -63.99 -41.55 97.47 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.358 -0.839 . . . . 0.0 109.806 179.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.454 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -74.45 -2.81 27.19 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.342 -0.849 . . . . 0.0 110.141 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.43 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.3 OUTLIER 65.29 74.69 0.38 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.263 -0.898 . . . . 0.0 110.258 -179.921 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.8 t0 49.04 59.08 4.7 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.264 -0.897 . . . . 0.0 110.317 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.556 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 11.2 mttt -148.6 144.81 18.88 Favored Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.19 -0.944 . . . . 0.0 110.169 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -77.25 4.33 5.96 Favored 'Trans proline' 0 C--N 1.305 -1.748 0 O-C-N 124.063 1.559 . . . . 0.0 110.117 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.556 ' CZ ' ' HD3' ' A' ' 21' ' ' LYS . 48.8 p90 -148.99 175.34 11.39 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.208 -0.932 . . . . 0.0 110.319 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.422 ' HB ' ' HB3' ' A' ' 18' ' ' ALA . 4.6 tt -151.33 156.96 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.274 -0.891 . . . . 0.0 110.119 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.2 mp -89.26 149.05 23.25 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.264 -0.897 . . . . 0.0 110.258 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.491 ' O ' ' HG ' ' A' ' 29' ' ' LEU . . . -58.03 -34.79 70.45 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.27 -0.894 . . . . 0.0 110.028 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -70.76 -34.11 71.49 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.269 -0.894 . . . . 0.0 110.018 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.453 ' O ' ' CG ' ' A' ' 32' ' ' GLU . 3.8 tp10 -62.5 -50.97 69.27 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.3 -0.875 . . . . 0.0 110.513 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.523 ' CD1' ' HA ' ' A' ' 38' ' ' ALA . 3.5 pp -66.98 -33.16 74.96 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.006 -1.059 . . . . 0.0 109.295 179.444 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.483 ' N ' ' CD1' ' A' ' 29' ' ' LEU . 3.2 ttt85 -58.18 -34.75 70.68 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.394 -0.816 . . . . 0.0 109.61 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.8 ttt180 -91.62 -29.85 16.67 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.433 -0.792 . . . . 0.0 110.196 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.453 ' CG ' ' O ' ' A' ' 28' ' ' GLU . 5.0 mm-40 -82.2 -23.56 35.39 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.174 -0.954 . . . . 0.0 110.26 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.532 ' CD2' ' HD2' ' A' ' 34' ' ' PRO . 6.5 mt -119.96 146.9 43.15 Favored Pre-proline 0 N--CA 1.489 1.476 0 O-C-N 121.257 -0.902 . . . . 0.0 110.094 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.532 ' HD2' ' CD2' ' A' ' 33' ' ' LEU . 1.1 Cg_endo -53.67 158.19 8.62 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 O-C-N 123.938 1.493 . . . . 0.0 110.284 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -50.54 -39.44 55.35 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 124.108 1.583 . . . . 0.0 110.69 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.97 -46.46 81.39 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.21 -0.932 . . . . 0.0 110.445 -179.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.528 ' CB ' HD21 ' A' ' 33' ' ' LEU . 58.5 mm-40 -69.66 -38.33 77.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.25 -0.906 . . . . 0.0 110.686 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.523 ' HA ' ' CD1' ' A' ' 29' ' ' LEU . . . -57.46 -42.12 81.91 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.203 -0.936 . . . . 0.0 110.798 -179.497 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.5 tp60 -60.69 -47.08 87.87 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.179 -0.951 . . . . 0.0 110.692 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -66.0 -43.87 86.49 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.21 -0.931 . . . . 0.0 110.586 -179.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 3.2 m -62.67 -42.91 99.88 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.223 -0.923 . . . . 0.0 111.005 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.416 HG13 ' CD2' ' A' ' 29' ' ' LEU . 68.6 mt -75.2 -12.35 14.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.067 -1.021 . . . . 0.0 110.524 -179.435 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.88 -16.07 49.01 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.23 -0.919 . . . . 0.0 111.129 -179.359 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.514 ' O ' ' C ' ' A' ' 45' ' ' MET . 1.1 mpp_? -117.26 -56.66 2.22 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.086 -1.009 . . . . 0.0 110.997 -179.479 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.514 ' C ' ' O ' ' A' ' 44' ' ' ARG . 3.9 ttm -29.48 94.52 0.06 OUTLIER Pre-proline 0 N--CA 1.498 1.964 0 O-C-N 121.691 -0.63 . . . . 0.0 111.531 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.471 ' N ' ' O ' ' A' ' 44' ' ' ARG . 11.5 Cg_endo -59.07 -174.6 0.08 OUTLIER 'Trans proline' 0 C--N 1.307 -1.641 0 O-C-N 124.121 1.59 . . . . 0.0 110.363 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.62 74.26 7.53 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.192 -0.942 . . . . 0.0 110.303 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 1.1 t80 42.6 -118.66 0.48 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.319 -0.863 . . . . 0.0 110.43 179.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -100.4 160.41 14.36 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.96 -1.087 . . . . 0.0 110.386 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . 0.425 ' N ' ' CD ' ' A' ' 51' ' ' PRO . . . -70.3 -34.58 69.12 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.425 ' CD ' ' N ' ' A' ' 50' ' ' GLY . 44.8 Cg_endo -115.18 130.07 0.02 OUTLIER 'Trans proline' 0 C--N 1.306 -1.683 0 O-C-N 123.972 1.511 . . . . 0.0 110.257 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.448 ' O ' ' HB3' ' A' ' 53' ' ' SER . . . 93.17 -134.49 12.18 Favored Glycine 0 N--CA 1.489 2.202 0 N-CA-C 109.354 -1.498 . . . . 0.0 109.354 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.448 ' HB3' ' O ' ' A' ' 52' ' ' GLY . 11.0 t 55.81 -178.63 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.277 -1.131 . . . . 0.0 110.115 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 20.2 m -123.77 164.08 31.1 Favored Pre-proline 0 C--N 1.295 -1.765 0 O-C-N 121.72 -0.613 . . . . 0.0 110.098 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -75.24 55.35 4.04 Favored 'Trans proline' 0 C--N 1.305 -1.72 0 O-C-N 123.907 1.477 . . . . 0.0 110.381 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 170.82 35.01 0.03 OUTLIER Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.451 ' O ' HD12 ' A' ' 58' ' ' LEU . . . -134.51 128.69 33.87 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.225 -1.162 . . . . 0.0 110.227 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.581 ' CD2' ' N ' ' A' ' 58' ' ' LEU . 2.1 mm? -112.77 156.4 22.91 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.226 -0.921 . . . . 0.0 109.785 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.455 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.6 OUTLIER -111.53 110.46 20.89 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.068 -1.02 . . . . 0.0 110.441 -179.855 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.519 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 18.4 p90 -75.02 -21.75 58.89 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.263 -0.898 . . . . 0.0 109.593 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.519 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.9 -39.15 71.17 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.295 -0.878 . . . . 0.0 109.457 179.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.47 -32.33 73.2 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.34 -0.85 . . . . 0.0 109.087 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.458 ' O ' ' HB3' ' A' ' 67' ' ' LEU . 2.0 t80 -61.78 -38.53 88.39 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-O 121.192 0.52 . . . . 0.0 110.35 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 25.1 m -56.79 -49.67 74.62 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.329 -0.857 . . . . 0.0 110.825 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.431 ' O ' ' HA2' ' A' ' 69' ' ' GLY . 14.0 m -66.18 -36.16 82.36 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.076 -1.015 . . . . 0.0 110.74 -179.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.88 -30.12 56.08 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.145 -0.972 . . . . 0.0 110.842 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.458 ' HB3' ' O ' ' A' ' 63' ' ' PHE . 0.3 OUTLIER -78.18 -46.77 19.64 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.066 -1.021 . . . . 0.0 109.945 -179.632 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.629 ' CZ ' ' CG2' ' A' ' 6' ' ' THR . 12.4 m-85 -100.42 15.26 28.43 Favored 'General case' 0 N--CA 1.492 1.652 0 C-N-CA 119.939 -0.705 . . . . 0.0 110.463 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.431 ' HA2' ' O ' ' A' ' 65' ' ' SER . . . -92.67 51.57 2.64 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.519 -1.432 . . . . 0.0 109.519 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -131.64 -65.6 0.75 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.246 -1.149 . . . . 0.0 110.296 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.8 m -63.02 113.88 3.37 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.238 -0.914 . . . . 0.0 110.249 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -68.42 105.59 2.24 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.249 -0.907 . . . . 0.0 110.27 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.0 tp . . . . . 0 N--CA 1.491 1.577 0 O-C-N 121.252 -0.905 . . . . 0.0 110.204 179.965 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' GLY . . . . . 0.465 ' O ' ' N ' ' B' ' 9' ' ' LYS . . . . . . . . 0 N--CA 1.49 2.296 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.44 ' CB ' ' O ' ' B' ' 7' ' ' GLY . 1.5 ttpt 66.22 -62.04 0.27 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.268 -1.137 . . . . 0.0 110.143 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.465 ' N ' ' O ' ' B' ' 7' ' ' GLY . 1.4 ttmt -58.75 -40.25 83.29 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.122 -0.986 . . . . 0.0 110.001 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.06 -35.43 80.21 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.24 -0.912 . . . . 0.0 109.888 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.6 tm-20 -65.96 -40.32 91.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.373 -0.83 . . . . 0.0 110.144 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . 0.463 ' HB3' ' HA ' ' A' ' 13' ' ' SER . . . -62.54 -41.76 99.09 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.338 -0.851 . . . . 0.0 110.068 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 58.1 t -63.36 -40.55 89.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.264 -0.897 . . . . 0.0 109.892 179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.77 -39.04 87.33 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.369 -0.832 . . . . 0.0 110.276 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 23.7 m -66.15 -43.67 86.36 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.212 -0.93 . . . . 0.0 110.312 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.467 ' O ' HG22 ' B' ' 20' ' ' VAL . 61.5 t -67.53 -40.41 84.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.283 -0.886 . . . . 0.0 110.363 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 98.8 t -58.14 -49.0 83.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.233 -0.917 . . . . 0.0 110.498 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.44 -38.83 92.4 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.24 -0.912 . . . . 0.0 110.276 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.45 -46.04 74.24 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.261 -0.9 . . . . 0.0 110.145 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . 0.493 ' CG1' ' OE1' ' A' ' 37' ' ' GLN . 83.8 t -67.49 -45.92 84.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.291 -0.881 . . . . 0.0 110.091 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -57.46 -38.23 74.13 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.204 -0.935 . . . . 0.0 110.194 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.27 -45.32 72.41 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.226 -0.921 . . . . 0.0 109.946 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.52 -38.81 92.32 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.372 -0.83 . . . . 0.0 109.84 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 22.1 ttt-85 -61.87 -35.72 79.14 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.232 -0.918 . . . . 0.0 109.928 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 78.0 t -76.5 -21.67 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.29 -0.881 . . . . 0.0 110.199 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.49 20.37 3.96 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.361 -0.837 . . . . 0.0 110.103 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . 0.431 ' HA ' ' HD3' ' B' ' 28' ' ' PRO . 28.8 tp10 -105.95 125.17 33.83 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.319 -0.863 . . . . 0.0 110.37 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' B' ' 27' ' ' GLU . 7.4 Cg_exo -59.11 -24.74 75.08 Favored 'Trans proline' 0 C--N 1.307 -1.616 0 O-C-N 123.993 1.523 . . . . 0.0 110.253 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 14.5 tpt85 . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.277 -0.89 . . . . 0.0 110.236 -179.836 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 ttt . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.241 0.544 . . . . 0.0 110.173 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 47.52 86.12 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.265 -0.897 . . . . 0.0 110.2 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.436 ' HB2' ' HG2' ' A' ' 8' ' ' GLU . 4.8 p-10 -125.86 -170.84 2.26 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.307 -0.871 . . . . 0.0 110.255 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.05 -176.19 3.29 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.256 -0.902 . . . . 0.0 110.201 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.495 ' O ' ' N ' ' A' ' 7' ' ' ALA . 6.1 p-10 -121.49 156.14 33.43 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.231 -0.918 . . . . 0.0 110.272 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.548 ' CG2' ' CE1' ' A' ' 68' ' ' TYR . 3.4 m 64.08 -69.11 0.09 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.378 -0.826 . . . . 0.0 110.076 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.495 ' N ' ' O ' ' A' ' 5' ' ' ASP . . . -66.57 -44.43 82.29 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.243 -0.91 . . . . 0.0 109.64 179.557 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.436 ' HG2' ' HB2' ' A' ' 3' ' ' ASP . 14.9 tp10 -58.83 -36.52 74.65 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.482 -0.761 . . . . 0.0 109.914 179.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.49 -47.68 84.52 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.324 -0.86 . . . . 0.0 110.113 -179.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 24.5 t -57.98 -51.18 73.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.289 -0.882 . . . . 0.0 109.784 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 16.5 mt -57.88 -49.7 80.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.392 -0.818 . . . . 0.0 109.621 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.91 -41.89 83.6 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.289 -0.882 . . . . 0.0 109.183 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 65.3 m -67.96 -37.09 81.14 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.392 -0.817 . . . . 0.0 109.33 179.177 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.583 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 2.1 m-85 -67.91 -44.14 77.61 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.31 -0.869 . . . . 0.0 109.644 179.452 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.68 -48.12 72.79 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.266 -0.896 . . . . 0.0 109.608 179.531 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 60.8 mt -60.33 -42.95 92.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.313 -0.867 . . . . 0.0 109.776 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.412 ' N ' HD21 ' A' ' 17' ' ' LEU . 1.8 mm? -62.5 -40.54 97.03 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.32 -0.863 . . . . 0.0 109.915 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.486 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -82.9 7.62 14.87 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.394 -0.816 . . . . 0.0 110.295 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.486 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.8 OUTLIER 67.37 66.27 0.4 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.208 -0.933 . . . . 0.0 110.278 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.454 ' N ' ' OD1' ' A' ' 20' ' ' ASP . 1.0 OUTLIER 49.52 62.03 2.84 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.273 -0.892 . . . . 0.0 110.38 179.906 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.577 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 25.6 mttm -140.84 141.96 26.4 Favored Pre-proline 0 N--CA 1.488 1.454 0 O-C-N 121.235 -0.916 . . . . 0.0 110.074 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -72.02 -1.03 9.39 Favored 'Trans proline' 0 C--N 1.305 -1.748 0 O-C-N 124.059 1.558 . . . . 0.0 110.211 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.577 ' CZ ' ' HD3' ' A' ' 21' ' ' LYS . 39.6 p90 -142.07 162.39 35.61 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.287 -0.883 . . . . 0.0 110.035 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.512 HD11 HG22 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -128.1 140.6 48.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.151 -0.968 . . . . 0.0 110.238 -179.84 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.428 ' HB2' ' HG3' ' A' ' 28' ' ' GLU . 1.1 mt -80.33 144.61 32.63 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.265 -0.897 . . . . 0.0 110.167 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.469 ' O ' ' HG ' ' A' ' 29' ' ' LEU . . . -62.65 -36.54 83.16 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.338 -0.851 . . . . 0.0 110.296 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -68.25 -34.6 76.51 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.105 -0.997 . . . . 0.0 109.936 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.484 ' O ' ' CG ' ' A' ' 32' ' ' GLU . 62.2 mt-10 -65.88 -50.36 64.8 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.29 -0.881 . . . . 0.0 110.003 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.493 HD22 ' CD1' ' A' ' 42' ' ' ILE . 1.7 pp -67.2 -32.99 74.43 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.2 -0.938 . . . . 0.0 109.933 179.62 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.511 ' HA ' ' CB ' ' A' ' 38' ' ' ALA . 6.8 mtt180 -66.35 -34.16 77.35 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.28 -0.887 . . . . 0.0 110.639 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -95.36 -25.54 16.25 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.176 -0.953 . . . . 0.0 111.614 -178.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.492 ' CG ' ' HA ' ' A' ' 29' ' ' LEU . 15.5 pt-20 -92.13 -24.16 19.19 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.815 -1.178 . . . . 0.0 111.204 -178.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.498 ' CD2' ' HB3' ' A' ' 37' ' ' GLN . 0.1 OUTLIER -108.63 141.89 24.27 Favored Pre-proline 0 N--CA 1.492 1.643 0 O-C-N 121.043 -1.035 . . . . 0.0 110.427 -179.972 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.423 ' O ' ' C ' ' A' ' 35' ' ' PRO . 23.1 Cg_exo -44.54 137.7 8.23 Favored 'Trans proline' 0 C--N 1.303 -1.818 0 O-C-N 124.2 1.632 . . . . 0.0 109.765 179.664 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.423 ' C ' ' O ' ' A' ' 34' ' ' PRO . 37.1 Cg_endo -39.6 -38.49 1.66 Allowed 'Trans proline' 0 C--N 1.305 -1.721 0 O-C-N 124.039 1.547 . . . . 0.0 110.378 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -66.21 -45.71 79.8 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.275 -0.89 . . . . 0.0 110.665 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.498 ' HB3' ' CD2' ' A' ' 33' ' ' LEU . 52.4 mm-40 -69.97 -42.56 73.0 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.171 -0.955 . . . . 0.0 110.797 -179.429 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.511 ' CB ' ' HA ' ' A' ' 30' ' ' ARG . . . -63.54 -48.76 76.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.107 -0.995 . . . . 0.0 110.521 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.9 tm0? -56.24 -43.08 78.31 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.196 -0.94 . . . . 0.0 110.499 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -66.27 -42.88 87.85 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.228 -0.92 . . . . 0.0 110.285 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.48 ' O ' ' HG2' ' A' ' 45' ' ' MET . 84.5 m -65.0 -50.93 64.38 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.273 -0.892 . . . . 0.0 110.446 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.493 ' CD1' HD22 ' A' ' 29' ' ' LEU . 19.0 mm -40.41 -32.07 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.291 -0.881 . . . . 0.0 110.325 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.48 -42.19 14.69 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.377 -0.827 . . . . 0.0 110.805 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.575 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 3.9 mmt180 -63.7 -74.71 0.09 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.205 -0.934 . . . . 0.0 110.499 -179.405 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.527 ' HE3' ' CA ' ' A' ' 60' ' ' TYR . 6.8 ptp -56.82 119.48 30.29 Favored Pre-proline 0 N--CA 1.489 1.479 0 O-C-N 121.05 -1.031 . . . . 0.0 110.2 -179.723 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -78.36 -167.05 0.45 Allowed 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 123.972 1.511 . . . . 0.0 110.236 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -84.56 139.67 31.95 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.17 -0.956 . . . . 0.0 110.111 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.434 ' CE2' ' HB2' ' A' ' 53' ' ' SER . 24.3 t80 -69.96 100.78 1.65 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.255 -0.903 . . . . 0.0 110.183 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.9 p -84.7 92.72 8.26 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.241 -0.912 . . . . 0.0 110.198 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -124.89 -164.48 11.9 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -83.49 -52.27 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 124.014 1.534 . . . . 0.0 110.16 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.414 ' O ' ' HB3' ' A' ' 53' ' ' SER . . . -100.35 -79.66 1.45 Allowed Glycine 0 N--CA 1.489 2.222 0 N-CA-C 109.359 -1.496 . . . . 0.0 109.359 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.434 ' HB2' ' CE2' ' A' ' 48' ' ' TYR . 10.1 t 54.38 -178.61 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.249 -1.147 . . . . 0.0 110.194 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.404 ' N ' ' OG ' ' A' ' 53' ' ' SER . 5.0 m -134.05 165.62 35.37 Favored Pre-proline 0 C--N 1.295 -1.763 0 O-C-N 121.741 -0.599 . . . . 0.0 110.205 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -70.05 103.63 1.24 Allowed 'Trans proline' 0 C--N 1.306 -1.71 0 O-C-N 123.991 1.522 . . . . 0.0 110.369 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.485 ' O ' ' CD2' ' A' ' 58' ' ' LEU . . . 121.69 15.94 4.29 Favored Glycine 0 N--CA 1.489 2.201 0 N-CA-C 109.724 -1.351 . . . . 0.0 109.724 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.406 ' C ' HD23 ' A' ' 58' ' ' LEU . . . -91.02 121.02 32.48 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.121 -1.223 . . . . 0.0 110.174 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.59 ' CD2' ' N ' ' A' ' 58' ' ' LEU . 2.5 mm? -116.62 159.61 21.92 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.307 -0.87 . . . . 0.0 110.08 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.438 ' O ' ' HB2' ' A' ' 45' ' ' MET . 88.1 m-20 -109.32 114.36 27.97 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.248 -0.907 . . . . 0.0 110.183 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.583 ' HB2' ' CD2' ' A' ' 14' ' ' PHE . 23.8 p90 -84.31 -24.85 29.67 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.246 -0.909 . . . . 0.0 110.094 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.501 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.26 -35.9 67.94 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.243 -0.911 . . . . 0.0 109.93 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.99 -33.0 73.8 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.289 -0.882 . . . . 0.0 109.972 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.575 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 1.8 t80 -71.66 -32.75 68.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.558 -0.714 . . . . 0.0 110.053 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.8 t -66.27 -47.31 74.08 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.279 -0.888 . . . . 0.0 110.325 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.483 ' O ' ' N ' ' A' ' 69' ' ' GLY . 2.7 t -65.51 -36.83 85.0 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.192 -0.943 . . . . 0.0 110.357 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -75.21 -28.81 60.1 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.185 -0.947 . . . . 0.0 110.272 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.445 ' HB3' ' O ' ' A' ' 63' ' ' PHE . 0.4 OUTLIER -78.48 -45.25 22.54 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.214 -0.929 . . . . 0.0 109.584 179.966 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.548 ' CE1' ' CG2' ' A' ' 6' ' ' THR . 17.4 m-85 -93.38 -23.88 18.28 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.485 -0.76 . . . . 0.0 110.281 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.483 ' N ' ' O ' ' A' ' 65' ' ' SER . . . -91.17 56.74 3.23 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 53.87 176.46 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.262 -1.14 . . . . 0.0 110.156 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 37.7 p -132.87 115.3 15.09 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.292 -0.88 . . . . 0.0 110.231 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -71.28 138.68 49.57 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.248 -0.907 . . . . 0.0 110.29 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 O-C-N 121.28 -0.887 . . . . 0.0 110.215 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.282 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 4.8 mttt -149.45 -45.32 0.14 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.283 -1.128 . . . . 0.0 110.086 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 14.1 ttmt -61.56 -49.56 76.18 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.269 -0.894 . . . . 0.0 110.083 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.15 -38.14 67.87 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.222 -0.924 . . . . 0.0 109.945 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -66.09 -40.06 90.51 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.286 -0.884 . . . . 0.0 109.814 179.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.7 -37.05 84.95 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.32 -0.863 . . . . 0.0 110.07 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 76.6 t -62.49 -40.85 89.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.215 -0.928 . . . . 0.0 109.826 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.28 -38.07 82.44 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.345 -0.847 . . . . 0.0 109.999 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 56.3 m -62.93 -50.33 71.24 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.37 -0.831 . . . . 0.0 110.059 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 92.8 t -62.32 -43.91 98.6 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.318 -0.864 . . . . 0.0 110.053 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 93.5 t -59.83 -45.24 95.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.256 -0.903 . . . . 0.0 110.038 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.47 -38.06 89.69 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.179 -0.951 . . . . 0.0 110.094 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.66 -44.15 91.32 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.256 -0.902 . . . . 0.0 110.178 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 56.4 t -66.16 -39.78 85.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.238 -0.914 . . . . 0.0 110.265 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -65.46 -31.51 72.64 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.192 -0.942 . . . . 0.0 110.234 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -62.59 -38.21 89.23 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.283 -0.885 . . . . 0.0 110.318 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.74 -39.19 93.68 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.202 -0.936 . . . . 0.0 110.38 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.1 -44.26 92.85 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.246 -0.909 . . . . 0.0 109.965 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 95.4 t -52.48 -19.37 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.376 -0.828 . . . . 0.0 110.476 179.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 9.4 ttt180 -71.84 8.75 1.08 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.169 -0.957 . . . . 0.0 111.671 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -84.89 145.22 43.28 Favored Pre-proline 0 N--CA 1.492 1.657 0 O-C-N 121.01 -1.056 . . . . 0.0 109.971 179.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . 0.405 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 12.4 Cg_endo -46.28 -75.75 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.66 0 O-C-N 123.855 1.45 . . . . 0.0 110.413 -179.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . 0.405 ' HG2' ' O ' ' B' ' 28' ' ' PRO . 9.5 mmt180 . . . . . 0 N--CA 1.492 1.64 0 O-C-N 121.184 -0.948 . . . . 0.0 110.186 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.493 1.68 0 CA-C-O 121.235 0.541 . . . . 0.0 110.115 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -59.05 -168.27 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.27 -0.893 . . . . 0.0 110.187 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.442 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 19.5 p-10 -132.74 93.01 3.14 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.249 -0.907 . . . . 0.0 110.124 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 15.1 t -140.9 9.2 2.14 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.309 -0.869 . . . . 0.0 110.114 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -131.22 -175.52 3.72 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.277 -0.889 . . . . 0.0 110.27 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -95.46 -47.53 6.23 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.292 -0.88 . . . . 0.0 110.233 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.11 -47.69 83.48 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.235 -0.915 . . . . 0.0 109.82 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -54.4 -36.23 63.71 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.422 -0.799 . . . . 0.0 109.791 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -61.46 -44.58 96.85 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.401 -0.812 . . . . 0.0 110.281 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 41.7 t -62.64 -41.27 91.54 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.14 -0.975 . . . . 0.0 109.967 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 58.6 mt -59.3 -47.11 91.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.32 -0.862 . . . . 0.0 109.743 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.63 -42.59 83.69 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.265 -0.897 . . . . 0.0 109.055 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.423 ' HA ' ' HB1' ' B' ' 12' ' ' ALA . 0.0 OUTLIER -67.74 -38.42 83.5 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.437 -0.789 . . . . 0.0 109.21 178.914 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.478 ' HB3' ' CE1' ' A' ' 60' ' ' TYR . 0.9 OUTLIER -68.42 -43.22 77.64 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.33 -0.857 . . . . 0.0 109.647 179.284 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.1 ttt180 -53.42 -46.42 69.78 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.264 -0.898 . . . . 0.0 109.565 179.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.427 HD11 ' HB1' ' B' ' 12' ' ' ALA . 42.7 mt -58.13 -45.01 88.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.23 -0.918 . . . . 0.0 109.705 179.562 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.3 mp -63.13 -41.65 99.35 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.396 -0.815 . . . . 0.0 109.74 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.476 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -75.92 -1.78 27.14 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.319 -0.863 . . . . 0.0 110.04 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 67.61 62.43 0.43 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.29 -0.881 . . . . 0.0 110.446 179.997 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.419 ' HB2' ' O ' ' A' ' 19' ' ' SER . 87.0 m-20 54.1 61.22 3.15 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.257 -0.902 . . . . 0.0 110.362 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 39.2 mtmt -149.03 142.71 16.3 Favored Pre-proline 0 N--CA 1.489 1.495 0 O-C-N 121.297 -0.877 . . . . 0.0 109.86 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -69.9 -3.57 12.37 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 O-C-N 123.981 1.516 . . . . 0.0 110.095 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 33.1 p90 -145.74 159.16 43.58 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.252 -0.905 . . . . 0.0 110.154 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 10.5 tt -136.15 153.84 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.213 -0.929 . . . . 0.0 110.216 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 39.9 mt -80.86 134.3 35.74 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.196 -0.94 . . . . 0.0 110.234 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.52 -40.12 71.39 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.231 -0.918 . . . . 0.0 109.875 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -61.68 -38.29 87.27 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.319 -0.863 . . . . 0.0 109.729 179.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.441 ' HG2' ' OE2' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -68.66 -43.73 75.59 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.297 -0.877 . . . . 0.0 109.229 179.315 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.483 HD13 ' HB2' ' A' ' 33' ' ' LEU . 0.8 OUTLIER -64.27 -39.95 94.98 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.513 -0.742 . . . . 0.0 109.199 179.124 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.505 ' HA ' ' CB ' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -58.38 -34.77 71.08 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.544 -0.722 . . . . 0.0 110.236 179.826 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.8 ttt85 -93.12 -17.93 23.2 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.258 -0.901 . . . . 0.0 110.441 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.441 ' OE2' ' HG2' ' A' ' 28' ' ' GLU . 0.4 OUTLIER -88.56 -23.25 23.2 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.168 -0.957 . . . . 0.0 110.352 -179.893 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.483 ' HB2' HD13 ' A' ' 29' ' ' LEU . 13.1 mt -123.61 143.93 42.99 Favored Pre-proline 0 C--N 1.304 -1.381 0 O-C-N 121.231 -0.918 . . . . 0.0 110.383 -179.51 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.427 ' HD2' ' HB2' ' A' ' 37' ' ' GLN . 30.3 Cg_exo -46.62 145.19 6.68 Favored 'Trans proline' 0 C--N 1.305 -1.747 0 O-C-N 123.951 1.5 . . . . 0.0 109.918 179.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.414 ' C ' ' O ' ' A' ' 34' ' ' PRO . 27.8 Cg_endo -42.12 -40.47 6.48 Favored 'Trans proline' 0 C--N 1.304 -1.802 0 O-C-N 123.94 1.495 . . . . 0.0 110.371 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -65.77 -46.92 76.97 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.226 -0.921 . . . . 0.0 110.578 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.427 ' HB2' ' HD2' ' A' ' 34' ' ' PRO . 1.2 mp0 -69.41 -43.63 73.03 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.219 -0.926 . . . . 0.0 110.289 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.505 ' CB ' ' HA ' ' A' ' 30' ' ' ARG . . . -61.19 -48.13 82.95 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.366 -0.834 . . . . 0.0 110.5 -179.651 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.422 ' O ' ' HB2' ' A' ' 43' ' ' LYS . 9.8 tt0 -57.51 -48.04 80.34 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.174 -0.954 . . . . 0.0 110.106 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -64.02 -41.56 97.42 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.262 -0.899 . . . . 0.0 110.241 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 66.9 m -64.53 -50.77 66.04 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.212 -0.93 . . . . 0.0 110.257 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.462 HG13 ' CD2' ' A' ' 29' ' ' LEU . 64.2 mt -66.72 -14.42 17.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.269 -0.895 . . . . 0.0 109.955 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.527 ' HD3' ' CZ ' ' A' ' 44' ' ' ARG . 9.8 tttp -73.55 -16.23 61.27 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.379 -0.825 . . . . 0.0 110.253 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.649 ' CB ' ' CD1' ' A' ' 63' ' ' PHE . 5.1 mpt_? -119.06 -58.42 1.94 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.358 -0.839 . . . . 0.0 110.647 -179.6 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.515 ' C ' ' O ' ' A' ' 44' ' ' ARG . 3.9 ttm -26.96 90.99 0.05 OUTLIER Pre-proline 0 N--CA 1.499 1.994 0 O-C-N 121.973 -0.454 . . . . 0.0 111.529 -179.663 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.52 ' N ' ' O ' ' A' ' 44' ' ' ARG . 18.1 Cg_endo -67.01 -166.5 0.12 Allowed 'Trans proline' 0 C--N 1.305 -1.728 0 O-C-N 124.141 1.601 . . . . 0.0 110.172 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.453 ' O ' ' O ' ' A' ' 48' ' ' TYR . . . -74.4 134.93 42.39 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.259 -0.901 . . . . 0.0 110.231 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.548 ' CD1' ' C ' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -43.53 168.71 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.34 -0.85 . . . . 0.0 110.6 179.952 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.66 -34.75 4.14 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.244 -0.91 . . . . 0.0 110.09 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -70.97 132.85 22.06 Favored Glycine 0 N--CA 1.49 2.241 0 N-CA-C 109.426 -1.469 . . . . 0.0 109.426 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.76 159.88 43.32 Favored 'Trans proline' 0 C--N 1.304 -1.789 0 O-C-N 123.972 1.511 . . . . 0.0 110.173 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.455 ' O ' ' C ' ' A' ' 53' ' ' SER . . . 98.9 -103.34 2.73 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.534 ' HB3' ' CD2' ' A' ' 48' ' ' TYR . 0.3 OUTLIER 39.19 -156.2 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.285 0 O-C-N 121.505 -0.997 . . . . 0.0 110.663 179.789 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.511 ' N ' ' OG ' ' A' ' 53' ' ' SER . 9.6 m -127.94 -179.69 1.03 Allowed Pre-proline 0 C--N 1.294 -1.831 0 O-C-N 121.593 -0.692 . . . . 0.0 110.322 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -78.43 92.29 1.15 Allowed 'Trans proline' 0 C--N 1.306 -1.706 0 O-C-N 123.998 1.525 . . . . 0.0 110.273 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 121.79 26.27 1.96 Allowed Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.02 144.05 26.74 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.213 -1.169 . . . . 0.0 110.205 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.425 ' HB3' ' HG2' ' A' ' 45' ' ' MET . 45.0 mt -130.05 160.15 34.56 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.237 -0.914 . . . . 0.0 109.997 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.456 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.8 OUTLIER -113.38 110.77 20.86 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.086 -1.008 . . . . 0.0 110.706 179.925 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.612 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 18.3 p90 -73.01 -28.12 62.18 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.26 -0.9 . . . . 0.0 109.512 179.283 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.612 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.09 -43.42 78.02 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.445 -0.784 . . . . 0.0 109.881 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.34 -33.3 74.44 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.252 -0.905 . . . . 0.0 109.798 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.649 ' CD1' ' CB ' ' A' ' 44' ' ' ARG . 4.0 t80 -72.12 -34.58 68.7 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.605 -0.684 . . . . 0.0 110.207 179.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.28 -49.67 74.73 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.259 -0.901 . . . . 0.0 110.388 -179.716 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.463 ' O ' ' N ' ' A' ' 69' ' ' GLY . 22.1 t -58.46 -39.06 78.9 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.178 -0.951 . . . . 0.0 110.293 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.06 -39.76 75.47 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.32 -0.863 . . . . 0.0 110.245 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.596 ' CD1' ' CZ ' ' A' ' 63' ' ' PHE . 1.8 mt -59.91 -40.04 87.44 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.24 -0.913 . . . . 0.0 110.277 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -98.77 -16.08 19.07 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.238 -0.914 . . . . 0.0 110.252 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.463 ' N ' ' O ' ' A' ' 65' ' ' SER . . . 91.53 172.11 42.71 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.4 -1.48 . . . . 0.0 109.4 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.441 ' O ' ' CB ' ' A' ' 71' ' ' SER . 23.1 tp10 -157.69 -64.16 0.09 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.192 -1.181 . . . . 0.0 110.247 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.441 ' CB ' ' O ' ' A' ' 70' ' ' GLU . 0.3 OUTLIER 65.28 150.34 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.287 -0.883 . . . . 0.0 110.25 -179.991 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -84.55 124.3 31.26 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.301 -0.874 . . . . 0.0 110.199 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.491 1.611 0 O-C-N 121.191 -0.943 . . . . 0.0 110.216 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' GLY . . . . . 0.494 ' O ' ' N ' ' B' ' 9' ' ' LYS . . . . . . . . 0 N--CA 1.491 2.308 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.454 ' CB ' ' O ' ' B' ' 7' ' ' GLY . 0.7 OUTLIER 65.77 -64.74 0.19 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.267 -1.137 . . . . 0.0 110.218 179.995 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.494 ' N ' ' O ' ' B' ' 7' ' ' GLY . 1.4 ttpt -62.39 -42.3 99.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.23 -0.919 . . . . 0.0 110.011 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.31 -36.11 75.04 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.265 -0.897 . . . . 0.0 109.911 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.42 -42.16 83.68 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.253 -0.904 . . . . 0.0 109.938 179.739 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . 0.427 ' HB1' HD11 ' A' ' 16' ' ' ILE . . . -62.72 -40.89 98.6 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.299 -0.875 . . . . 0.0 109.445 179.494 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.443 HG12 HD22 ' A' ' 33' ' ' LEU . 73.7 t -63.36 -40.39 88.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.356 -0.84 . . . . 0.0 109.493 179.307 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.71 -35.82 79.15 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.39 -0.819 . . . . 0.0 110.074 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 2.4 m -70.07 -47.22 62.82 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.214 -0.929 . . . . 0.0 110.319 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.461 HG13 HD12 ' A' ' 33' ' ' LEU . 23.1 t -62.33 -43.09 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.248 -0.908 . . . . 0.0 110.352 -179.757 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 88.1 t -62.08 -51.04 77.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.276 -0.89 . . . . 0.0 110.334 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.68 -40.16 86.89 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.213 -0.929 . . . . 0.0 110.286 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.85 -41.21 97.84 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.201 -0.937 . . . . 0.0 110.196 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 71.5 t -66.79 -41.29 87.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.191 -0.943 . . . . 0.0 110.223 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . 0.41 ' O ' HG22 ' B' ' 25' ' ' VAL . 13.6 t70 -64.58 -39.59 94.0 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.273 -0.892 . . . . 0.0 110.307 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -58.44 -47.52 83.7 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.085 -1.009 . . . . 0.0 110.308 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.3 -40.8 78.6 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.31 -0.869 . . . . 0.0 110.345 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 3.4 mmm-85 -66.19 -40.64 90.56 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.262 -0.899 . . . . 0.0 110.192 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . 0.41 HG22 ' O ' ' B' ' 21' ' ' ASP . 58.7 t -63.05 -21.54 28.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.275 -0.891 . . . . 0.0 110.221 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 4.9 ttt-85 -109.95 22.38 15.7 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.384 -0.823 . . . . 0.0 110.191 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -85.45 120.62 73.3 Favored Pre-proline 0 N--CA 1.493 1.696 0 O-C-N 121.264 -0.897 . . . . 0.0 110.242 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -50.24 175.78 0.04 OUTLIER 'Trans proline' 0 C--N 1.306 -1.687 0 O-C-N 123.969 1.51 . . . . 0.0 110.229 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 3.7 ttt85 . . . . . 0 N--CA 1.492 1.661 0 O-C-N 121.307 -0.871 . . . . 0.0 110.208 -179.935 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 ttt . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.268 0.556 . . . . 0.0 110.233 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -155.21 -47.0 0.08 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.245 -0.909 . . . . 0.0 110.138 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -123.13 175.47 6.62 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.182 -0.949 . . . . 0.0 110.066 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 46.1 p -142.54 120.85 12.31 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.192 -0.942 . . . . 0.0 110.185 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -168.56 -68.97 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.186 -0.946 . . . . 0.0 110.272 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -149.17 -67.01 0.22 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.189 -0.945 . . . . 0.0 110.208 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.55 -50.01 71.19 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.243 -0.91 . . . . 0.0 109.821 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -36.7 65.53 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.392 -0.817 . . . . 0.0 109.942 179.674 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.428 ' HA ' ' OE1' ' A' ' 9' ' ' GLN . 3.1 tp60 -61.61 -37.49 84.12 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.232 -0.917 . . . . 0.0 110.2 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.471 HG13 ' HB2' ' A' ' 64' ' ' SER . 66.9 t -58.13 -43.49 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.163 -0.961 . . . . 0.0 109.951 179.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.2 mp -62.77 -48.66 87.05 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.278 -0.889 . . . . 0.0 109.54 179.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.69 -42.31 83.39 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.213 -0.93 . . . . 0.0 109.095 179.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.7 p -66.68 -39.14 88.0 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.394 -0.816 . . . . 0.0 109.046 178.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.519 ' HB3' ' CZ ' ' A' ' 60' ' ' TYR . 1.1 m-85 -68.6 -41.91 78.92 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.374 -0.829 . . . . 0.0 109.522 179.039 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.9 ttt180 -54.12 -44.02 70.97 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.341 -0.849 . . . . 0.0 109.629 179.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.406 HD11 ' HB1' ' B' ' 12' ' ' ALA . 68.3 mt -62.63 -44.93 99.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.409 -0.807 . . . . 0.0 109.859 179.607 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.419 HD11 ' N ' ' A' ' 17' ' ' LEU . 6.4 mp -65.0 -34.4 78.36 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.373 -0.829 . . . . 0.0 109.899 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.467 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -81.07 -1.62 44.9 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.32 -0.863 . . . . 0.0 110.162 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.413 ' HB3' ' O ' ' A' ' 18' ' ' ALA . 8.8 t 59.01 74.75 0.43 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.251 -0.905 . . . . 0.0 110.206 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 47.77 62.63 2.37 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.267 -0.896 . . . . 0.0 110.208 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.565 ' HD2' ' CZ ' ' A' ' 23' ' ' TYR . 0.8 OUTLIER -145.96 142.91 18.34 Favored Pre-proline 0 N--CA 1.489 1.493 0 O-C-N 121.239 -0.913 . . . . 0.0 110.144 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -76.37 3.2 6.51 Favored 'Trans proline' 0 C--N 1.303 -1.831 0 O-C-N 124.094 1.576 . . . . 0.0 110.127 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.565 ' CZ ' ' HD2' ' A' ' 21' ' ' LYS . 9.1 p90 -148.91 167.9 24.5 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.224 -0.922 . . . . 0.0 110.228 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.49 HD11 ' N ' ' A' ' 25' ' ' LEU . 0.3 OUTLIER -129.11 145.48 35.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.19 -0.944 . . . . 0.0 110.053 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.49 ' N ' HD11 ' A' ' 24' ' ' ILE . 4.7 mt -89.42 151.18 22.16 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.236 -0.915 . . . . 0.0 110.235 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.82 -39.35 91.49 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.229 -0.92 . . . . 0.0 110.046 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -65.52 -34.9 79.33 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.298 -0.876 . . . . 0.0 110.077 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.443 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 12.2 mm-40 -62.07 -46.42 89.17 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.399 -0.813 . . . . 0.0 110.15 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 21.7 mt -59.86 -35.38 74.67 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.237 -0.914 . . . . 0.0 109.961 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.2 mmm-85 -69.06 -35.74 76.87 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.299 -0.876 . . . . 0.0 110.696 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -90.1 -29.79 18.09 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.149 -0.969 . . . . 0.0 110.71 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.443 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 3.1 mm-40 -91.61 -23.19 19.94 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.107 -0.996 . . . . 0.0 110.57 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.529 HD21 ' CB ' ' A' ' 37' ' ' GLN . 0.3 OUTLIER -128.48 144.95 53.97 Favored Pre-proline 0 N--CA 1.489 1.48 0 O-C-N 121.073 -1.017 . . . . 0.0 110.385 -179.715 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.453 ' HD2' HD21 ' A' ' 33' ' ' LEU . 2.6 Cg_endo -49.01 142.09 20.8 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 O-C-N 124.082 1.57 . . . . 0.0 110.107 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -43.31 -33.56 4.01 Favored 'Trans proline' 0 C--N 1.304 -1.792 0 O-C-N 124.005 1.529 . . . . 0.0 110.611 -179.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -65.38 -47.11 77.52 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.112 -0.992 . . . . 0.0 110.341 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.529 ' CB ' HD21 ' A' ' 33' ' ' LEU . 1.7 mp0 -70.18 -42.1 72.85 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.189 -0.945 . . . . 0.0 110.355 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.28 -42.61 77.74 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.258 -0.901 . . . . 0.0 110.62 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -60.53 -48.55 81.29 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.168 -0.957 . . . . 0.0 110.429 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -63.51 -46.74 84.69 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.162 -0.961 . . . . 0.0 110.471 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 89.0 m -65.3 -41.06 94.47 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.257 -0.902 . . . . 0.0 110.623 -179.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 63.0 mt -67.85 -23.03 28.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.183 -0.948 . . . . 0.0 110.601 -179.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -84.79 -23.54 29.12 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.191 -0.943 . . . . 0.0 110.783 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.488 ' HG2' ' CE1' ' A' ' 63' ' ' PHE . 0.7 OUTLIER -92.49 -56.91 2.85 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.108 -0.995 . . . . 0.0 110.641 -179.544 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.507 ' CE ' ' HB3' ' A' ' 60' ' ' TYR . 0.6 OUTLIER -33.98 103.57 0.23 Allowed Pre-proline 0 N--CA 1.496 1.839 0 O-C-N 121.606 -0.684 . . . . 0.0 111.059 -179.845 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.404 ' O ' ' O ' ' A' ' 45' ' ' MET . 32.2 Cg_exo -60.6 -146.3 0.01 OUTLIER 'Trans proline' 0 C--N 1.307 -1.65 0 O-C-N 124.122 1.59 . . . . 0.0 110.359 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.433 ' O ' ' C ' ' A' ' 48' ' ' TYR . . . -99.28 115.14 28.47 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.363 -0.836 . . . . 0.0 110.031 179.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.556 ' CD2' ' HB3' ' A' ' 53' ' ' SER . 23.1 p90 -41.7 156.57 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.391 -0.818 . . . . 0.0 110.343 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -153.42 41.34 0.54 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.305 -0.872 . . . . 0.0 110.077 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -104.89 -164.16 24.09 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -100.16 164.03 0.47 Allowed 'Trans proline' 0 C--N 1.307 -1.648 0 O-C-N 123.993 1.523 . . . . 0.0 110.432 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.484 ' O ' ' O ' ' A' ' 53' ' ' SER . . . 49.39 24.46 5.28 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.556 ' HB3' ' CD2' ' A' ' 48' ' ' TYR . 1.0 OUTLIER -54.92 -160.16 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.3 0 O-C-N 121.342 -1.093 . . . . 0.0 110.657 -179.637 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.487 ' CG1' ' O ' ' A' ' 53' ' ' SER . 17.3 m -157.03 -177.29 0.72 Allowed Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.264 -0.898 . . . . 0.0 110.149 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.412 ' HD2' ' HB ' ' A' ' 54' ' ' VAL . 12.4 Cg_endo -89.0 105.33 0.41 Allowed 'Trans proline' 0 C--N 1.305 -1.736 0 O-C-N 124.045 1.55 . . . . 0.0 110.292 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 108.9 19.31 8.69 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.515 ' O ' ' CD1' ' A' ' 48' ' ' TYR . . . -91.35 140.23 29.97 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.334 -1.097 . . . . 0.0 110.356 -179.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.45 ' HB3' ' HB3' ' A' ' 45' ' ' MET . 15.0 mt -127.86 154.31 45.62 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.331 -0.856 . . . . 0.0 109.871 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.452 ' C ' ' HG3' ' A' ' 45' ' ' MET . 5.5 m-20 -105.23 110.87 23.4 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.105 -0.997 . . . . 0.0 110.552 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.519 ' CZ ' ' HB3' ' A' ' 14' ' ' PHE . 22.2 p90 -80.42 -21.22 42.43 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.322 -0.861 . . . . 0.0 109.759 179.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.509 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.9 -37.85 69.42 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.372 -0.83 . . . . 0.0 109.808 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.06 -33.75 76.78 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.246 -0.909 . . . . 0.0 109.642 179.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.558 ' CZ ' HD13 ' A' ' 67' ' ' LEU . 1.5 t80 -71.91 -35.93 69.83 Favored 'General case' 0 C--N 1.299 -1.597 0 O-C-N 121.553 -0.717 . . . . 0.0 109.874 179.539 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.471 ' HB2' HG13 ' A' ' 10' ' ' VAL . 0.3 OUTLIER -58.34 -49.61 76.58 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.279 -0.888 . . . . 0.0 110.074 179.886 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 41.8 m -64.3 -36.85 85.44 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.183 -0.948 . . . . 0.0 110.05 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.47 -34.43 72.39 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.297 -0.877 . . . . 0.0 110.024 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.558 HD13 ' CZ ' ' A' ' 63' ' ' PHE . 0.2 OUTLIER -61.38 -44.75 96.62 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.285 -0.884 . . . . 0.0 109.955 179.891 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -99.95 3.96 44.67 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.298 -0.876 . . . . 0.0 110.129 179.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.447 ' O ' ' HB3' ' A' ' 70' ' ' GLU . . . -73.82 -135.47 0.31 Allowed Glycine 0 N--CA 1.489 2.207 0 N-CA-C 109.752 -1.339 . . . . 0.0 109.752 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.447 ' HB3' ' O ' ' A' ' 69' ' ' GLY . 9.2 tt0 63.83 69.53 0.54 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.275 -1.132 . . . . 0.0 110.077 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.4 ' OG ' ' N ' ' A' ' 72' ' ' ASP . 1.8 t -167.59 179.13 5.02 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.312 -0.868 . . . . 0.0 110.099 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.4 ' N ' ' OG ' ' A' ' 71' ' ' SER . 13.6 p-10 -101.74 131.72 47.86 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.203 -0.935 . . . . 0.0 110.248 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.638 0 O-C-N 121.228 -0.92 . . . . 0.0 110.275 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.265 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.452 ' O ' ' HG3' ' B' ' 8' ' ' LYS . 5.5 ptpp? -101.54 37.75 1.74 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.237 -1.155 . . . . 0.0 110.264 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 3.4 ttmt -57.66 -49.18 77.34 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.191 -0.943 . . . . 0.0 109.882 179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.69 -33.84 64.53 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.252 -0.905 . . . . 0.0 109.612 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.66 -40.55 84.51 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.352 -0.843 . . . . 0.0 109.878 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . 0.406 ' HB1' HD11 ' A' ' 16' ' ' ILE . . . -62.66 -42.78 99.8 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.324 -0.86 . . . . 0.0 109.715 179.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.441 ' O ' ' CG2' ' B' ' 17' ' ' VAL . 70.2 t -59.48 -40.46 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.358 -0.839 . . . . 0.0 109.593 179.464 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.9 -41.41 87.15 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.402 -0.811 . . . . 0.0 109.893 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.11 -44.95 94.21 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.357 -0.839 . . . . 0.0 110.129 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.45 HG13 ' CD1' ' A' ' 33' ' ' LEU . 95.6 t -64.31 -42.9 96.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.302 -0.873 . . . . 0.0 109.921 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.441 ' CG2' ' O ' ' B' ' 13' ' ' VAL . 22.1 t -61.29 -48.21 89.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.311 -0.868 . . . . 0.0 110.025 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.71 -45.87 90.76 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.249 -0.907 . . . . 0.0 109.995 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.01 -45.57 88.35 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.254 -0.904 . . . . 0.0 110.048 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 46.9 t -62.6 -43.02 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.156 -0.965 . . . . 0.0 109.887 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.09 -36.85 75.83 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.252 -0.905 . . . . 0.0 109.972 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.63 -44.52 96.07 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.318 -0.864 . . . . 0.0 109.903 179.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . 0.423 ' HB2' HD22 ' A' ' 67' ' ' LEU . . . -63.1 -35.08 79.08 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.308 -0.87 . . . . 0.0 110.258 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 44.3 ttt180 -67.08 -38.74 86.26 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.311 -0.868 . . . . 0.0 110.369 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 23.7 t -78.49 -21.53 13.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.184 -0.948 . . . . 0.0 110.328 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 7.0 ttp180 -103.44 23.27 12.83 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.271 -0.893 . . . . 0.0 110.279 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -97.53 149.83 36.14 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.194 -0.941 . . . . 0.0 110.142 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -97.18 107.2 0.09 OUTLIER 'Trans proline' 0 C--N 1.304 -1.768 0 O-C-N 123.919 1.484 . . . . 0.0 110.391 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 . . . . . 0 N--CA 1.492 1.652 0 O-C-N 121.192 -0.942 . . . . 0.0 110.233 179.972 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 ttp . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.215 0.531 . . . . 0.0 110.176 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -135.3 71.72 1.44 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.241 -0.912 . . . . 0.0 110.285 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -117.7 131.43 56.63 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.245 -0.909 . . . . 0.0 110.132 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 9.8 t -159.39 137.64 10.49 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.225 -0.922 . . . . 0.0 110.349 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -156.43 -79.76 0.08 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.292 -0.88 . . . . 0.0 110.176 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -132.51 -59.27 0.92 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.222 -0.923 . . . . 0.0 110.035 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -66.91 -44.84 79.72 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.307 -0.871 . . . . 0.0 109.681 179.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -54.66 -35.71 63.82 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.426 -0.796 . . . . 0.0 109.789 179.44 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -60.9 -45.33 95.06 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.295 -0.878 . . . . 0.0 109.986 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 61.8 t -63.87 -43.83 97.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.183 -0.948 . . . . 0.0 109.46 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 86.3 mt -60.67 -45.7 97.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.389 -0.819 . . . . 0.0 109.369 179.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.54 -41.67 81.4 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.327 -0.858 . . . . 0.0 108.778 179.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.446 ' HA ' ' CB ' ' B' ' 12' ' ' ALA . 2.6 m -68.03 -39.53 83.1 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 178.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.563 ' HB3' ' CZ ' ' A' ' 60' ' ' TYR . 2.6 m-85 -68.47 -41.96 79.41 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.481 -0.762 . . . . 0.0 109.506 179.205 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -53.39 -45.84 69.43 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.298 -0.876 . . . . 0.0 109.436 179.428 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.464 HD11 HG22 ' A' ' 16' ' ' ILE . 49.7 mt -62.34 -41.3 91.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.415 -0.803 . . . . 0.0 109.711 179.387 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 mp -65.02 -38.58 91.38 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.313 -0.867 . . . . 0.0 110.0 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -85.5 3.68 39.28 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.311 -0.868 . . . . 0.0 110.334 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.453 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 0.1 OUTLIER 60.6 61.39 1.73 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.248 -0.908 . . . . 0.0 110.379 179.949 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 19' ' ' SER . 1.2 m-20 56.13 61.94 2.55 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.218 -0.926 . . . . 0.0 110.439 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 19' ' ' SER . 89.8 mttt -144.84 138.68 14.58 Favored Pre-proline 0 N--CA 1.489 1.494 0 O-C-N 121.287 -0.883 . . . . 0.0 109.733 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -68.3 -3.69 11.36 Favored 'Trans proline' 0 C--N 1.304 -1.8 0 O-C-N 124.008 1.53 . . . . 0.0 110.44 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 18.5 p90 -138.79 156.52 47.28 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.173 -0.954 . . . . 0.0 110.145 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.518 ' CG2' ' SD ' ' A' ' 45' ' ' MET . 0.2 OUTLIER -128.93 138.19 55.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.259 -0.9 . . . . 0.0 110.235 -179.803 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.414 HD22 ' O ' ' A' ' 56' ' ' GLY . 0.8 OUTLIER -80.54 141.9 34.67 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.277 -0.889 . . . . 0.0 110.41 -179.862 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.453 ' HB2' HG22 ' A' ' 42' ' ' ILE . . . -61.21 -40.63 94.71 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.37 -0.831 . . . . 0.0 110.455 -179.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -55.97 -36.78 68.22 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.273 -0.892 . . . . 0.0 110.516 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -67.42 -45.55 75.79 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.198 -0.939 . . . . 0.0 109.888 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.431 ' CD2' HD13 ' A' ' 24' ' ' ILE . 20.4 mt -60.77 -36.68 79.57 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.241 -0.912 . . . . 0.0 109.756 179.697 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.0 tpt180 -62.21 -34.63 76.84 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.33 -0.856 . . . . 0.0 109.643 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 7.4 ttp180 -92.92 -35.91 13.07 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.325 -0.86 . . . . 0.0 110.212 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -77.98 -23.76 48.27 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.334 -0.853 . . . . 0.0 110.744 -179.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.545 ' CD2' ' HB3' ' A' ' 37' ' ' GLN . 0.2 OUTLIER -125.46 163.5 38.17 Favored Pre-proline 0 N--CA 1.487 1.409 0 O-C-N 121.094 -1.004 . . . . 0.0 110.422 -179.622 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.465 ' HD2' HD21 ' A' ' 33' ' ' LEU . 39.6 Cg_exo -64.58 149.58 89.63 Favored 'Trans proline' 0 C--N 1.305 -1.754 0 O-C-N 124.035 1.545 . . . . 0.0 110.101 179.774 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -43.72 -44.85 11.29 Favored 'Trans proline' 0 C--N 1.304 -1.8 0 O-C-N 124.035 1.545 . . . . 0.0 110.418 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.49 ' OD1' ' NE2' ' A' ' 37' ' ' GLN . 3.4 p30 -65.89 -40.06 91.22 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.174 -0.954 . . . . 0.0 110.68 -179.729 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.545 ' HB3' ' CD2' ' A' ' 33' ' ' LEU . 76.0 mm-40 -70.07 -38.54 75.77 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.007 -1.058 . . . . 0.0 110.434 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.2 -42.44 93.53 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.162 -0.961 . . . . 0.0 110.363 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -58.54 -48.98 79.07 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.182 -0.949 . . . . 0.0 110.213 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -66.33 -48.08 71.42 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.242 -0.911 . . . . 0.0 110.17 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 89.6 m -65.39 -43.08 91.78 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.414 -0.804 . . . . 0.0 110.531 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.464 ' O ' HG21 ' A' ' 42' ' ' ILE . 83.8 mt -71.2 -21.17 21.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.164 -0.96 . . . . 0.0 110.364 -179.745 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -84.31 -43.59 14.64 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.176 -0.952 . . . . 0.0 110.382 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.595 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 1.6 mmp_? -68.83 -62.87 1.2 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.198 -0.939 . . . . 0.0 110.459 -179.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.535 ' HE3' ' CB ' ' A' ' 60' ' ' TYR . 2.3 ttm -30.43 118.1 0.33 Allowed Pre-proline 0 N--CA 1.494 1.768 0 O-C-N 121.853 -0.529 . . . . 0.0 111.336 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.466 ' O ' HD22 ' A' ' 58' ' ' LEU . 9.6 Cg_endo -74.14 -157.56 0.06 OUTLIER 'Trans proline' 0 C--N 1.306 -1.694 0 O-C-N 124.084 1.571 . . . . 0.0 110.321 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.602 ' O ' ' CD1' ' A' ' 48' ' ' TYR . . . -97.15 81.12 3.0 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.277 -0.889 . . . . 0.0 110.497 -179.802 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.602 ' CD1' ' O ' ' A' ' 47' ' ' ALA . 16.0 p90 36.4 -160.81 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.904 0 CA-C-O 121.456 0.645 . . . . 0.0 111.3 179.752 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -148.77 11.05 0.84 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.284 -0.885 . . . . 0.0 110.433 -179.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -112.24 -164.53 17.01 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.395 -1.482 . . . . 0.0 109.395 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -116.19 18.53 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.65 0 O-C-N 123.84 1.442 . . . . 0.0 110.326 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.479 ' O ' ' O ' ' A' ' 53' ' ' SER . . . -128.1 51.02 0.87 Allowed Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.868 -1.293 . . . . 0.0 109.868 -179.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.479 ' O ' ' O ' ' A' ' 52' ' ' GLY . 0.9 OUTLIER -51.56 -171.5 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.276 0 O-C-N 121.27 -1.135 . . . . 0.0 110.555 -179.89 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.536 HG21 ' CB ' ' A' ' 57' ' ' ALA . 0.0 OUTLIER -156.81 179.39 1.37 Allowed Pre-proline 0 N--CA 1.495 1.79 0 O-C-N 121.587 -0.696 . . . . 0.0 109.775 179.746 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.483 ' HD2' ' HB ' ' A' ' 54' ' ' VAL . 6.6 Cg_endo -59.56 78.53 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.733 0 O-C-N 123.948 1.499 . . . . 0.0 110.489 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.511 ' N ' ' O ' ' A' ' 54' ' ' VAL . . . 90.92 92.24 1.3 Allowed Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.95 -1.26 . . . . 0.0 109.95 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.536 ' CB ' HG21 ' A' ' 54' ' ' VAL . . . -148.42 130.26 15.18 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.237 -1.155 . . . . 0.0 110.135 179.781 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.482 ' HB3' ' HB3' ' A' ' 45' ' ' MET . 1.1 mt -135.54 160.34 38.78 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.245 -0.91 . . . . 0.0 110.29 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.429 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.5 OUTLIER -107.16 111.26 23.6 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.34 -0.85 . . . . 0.0 110.138 179.759 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.563 ' CZ ' ' HB3' ' A' ' 14' ' ' PHE . 17.9 p90 -72.57 -23.69 61.0 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.286 -0.883 . . . . 0.0 110.081 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.516 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.88 -35.81 66.92 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.251 -0.906 . . . . 0.0 109.787 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.2 -34.26 75.93 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.285 -0.885 . . . . 0.0 109.821 179.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.595 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 12.1 t80 -72.04 -34.81 69.07 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.633 -0.667 . . . . 0.0 110.292 179.761 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.4 m -57.04 -49.72 74.95 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.21 -0.932 . . . . 0.0 110.461 -179.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.502 ' O ' ' N ' ' A' ' 69' ' ' GLY . 1.2 m -57.89 -35.71 71.39 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.171 -0.956 . . . . 0.0 110.614 -179.693 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.17 -46.09 82.24 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.13 -0.981 . . . . 0.0 110.635 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.592 HD22 ' CE1' ' A' ' 63' ' ' PHE . 0.1 OUTLIER -62.08 -43.54 98.61 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.253 -0.904 . . . . 0.0 110.593 -179.695 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -90.29 -16.62 28.93 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.182 -0.948 . . . . 0.0 110.509 -179.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.502 ' N ' ' O ' ' A' ' 65' ' ' SER . . . 112.09 124.27 4.37 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.424 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 10.4 pt-20 -104.61 39.36 1.69 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.266 -1.138 . . . . 0.0 110.243 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.6 t -146.61 170.03 17.77 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.169 -0.957 . . . . 0.0 110.226 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 46.8 t0 -69.42 133.75 48.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.18 -0.95 . . . . 0.0 110.153 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 24.0 mt . . . . . 0 N--CA 1.491 1.59 0 O-C-N 121.261 -0.899 . . . . 0.0 110.223 179.976 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.323 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.93 -39.77 4.71 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.19 -1.183 . . . . 0.0 110.203 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.433 ' O ' HG21 ' B' ' 13' ' ' VAL . 0.0 OUTLIER -70.81 -51.01 29.45 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.206 -0.934 . . . . 0.0 110.027 179.945 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.34 -40.57 71.37 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.258 -0.901 . . . . 0.0 109.943 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -65.63 -40.77 92.92 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.331 -0.856 . . . . 0.0 110.168 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . 0.446 ' CB ' ' HA ' ' A' ' 13' ' ' SER . . . -67.43 -38.01 83.9 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.269 -0.894 . . . . 0.0 110.2 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.435 ' O ' HG22 ' B' ' 17' ' ' VAL . 46.9 t -63.13 -44.14 99.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.328 -0.858 . . . . 0.0 110.152 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.2 -41.84 89.52 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.195 -0.94 . . . . 0.0 110.226 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 28.3 m -63.77 -37.43 87.32 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.317 -0.864 . . . . 0.0 110.234 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 88.0 t -68.89 -46.43 79.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.202 -0.936 . . . . 0.0 110.198 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.45 ' O ' ' HB2' ' B' ' 21' ' ' ASP . 59.3 t -58.74 -43.52 88.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.225 -0.922 . . . . 0.0 110.195 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.97 -44.72 91.88 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.266 -0.897 . . . . 0.0 110.243 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.27 -43.54 94.49 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.196 -0.94 . . . . 0.0 110.22 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 61.2 t -66.96 -42.5 88.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.323 -0.861 . . . . 0.0 110.328 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' B' ' 17' ' ' VAL . 3.1 t0 -60.82 -31.63 71.03 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.252 -0.905 . . . . 0.0 110.376 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -59.24 -51.24 70.83 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.184 -0.948 . . . . 0.0 110.251 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.4 -38.24 87.06 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.245 -0.909 . . . . 0.0 110.148 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.68 -32.38 74.03 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.385 -0.822 . . . . 0.0 110.512 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . 0.421 HG22 ' O ' ' B' ' 21' ' ' ASP . 79.2 t -64.22 -26.36 40.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.213 -0.929 . . . . 0.0 110.586 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 15.0 mmt180 -108.5 28.74 8.06 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.401 -0.812 . . . . 0.0 110.181 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -79.95 124.15 83.27 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.306 -0.871 . . . . 0.0 110.007 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -47.62 -58.45 1.73 Allowed 'Trans proline' 0 C--N 1.307 -1.635 0 O-C-N 123.952 1.501 . . . . 0.0 110.219 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 O-C-N 121.261 -0.9 . . . . 0.0 110.225 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.9 mtp . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.286 0.565 . . . . 0.0 110.114 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.9 176.94 10.29 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.288 -0.882 . . . . 0.0 110.143 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -171.6 101.9 0.19 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.209 -0.932 . . . . 0.0 110.257 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 60.65 109.04 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.279 -0.888 . . . . 0.0 110.252 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -109.96 40.4 1.93 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.289 -0.882 . . . . 0.0 110.204 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.5 HG23 ' CE1' ' A' ' 68' ' ' TYR . 6.6 m -110.64 -67.41 1.0 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.326 -0.859 . . . . 0.0 110.159 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.54 -46.04 84.54 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.249 -0.907 . . . . 0.0 109.71 179.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -57.61 -36.65 72.06 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.402 -0.811 . . . . 0.0 109.879 179.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 37.3 tt0 -61.61 -45.85 92.33 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.263 -0.898 . . . . 0.0 110.115 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.445 HG11 ' CE2' ' A' ' 14' ' ' PHE . 54.1 t -59.47 -42.11 86.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.109 -0.995 . . . . 0.0 109.745 179.675 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 86.8 mt -65.31 -48.12 84.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 121.321 -0.862 . . . . 0.0 109.36 179.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.56 -39.81 77.53 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.282 -0.886 . . . . 0.0 108.792 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.473 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 7.0 m -67.21 -43.92 80.87 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 178.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.532 ' CB ' ' CD1' ' A' ' 60' ' ' TYR . 5.8 m-85 -67.32 -40.71 85.98 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.474 -0.766 . . . . 0.0 109.309 179.044 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.514 ' O ' ' N ' ' A' ' 20' ' ' ASP . 17.2 ttt180 -52.93 -40.95 64.01 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.407 -0.808 . . . . 0.0 109.223 179.241 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 49.1 mt -64.55 -43.91 96.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.407 -0.808 . . . . 0.0 110.224 179.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 13' ' ' SER . 15.5 mt -62.96 -41.73 99.62 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.087 -1.008 . . . . 0.0 110.096 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.465 ' HB2' ' O ' ' A' ' 23' ' ' TYR . . . -83.59 13.31 4.7 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.311 -0.868 . . . . 0.0 110.299 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.429 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 65.69 57.8 0.83 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.21 -0.931 . . . . 0.0 110.28 179.899 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.514 ' N ' ' O ' ' A' ' 15' ' ' ARG . 0.6 OUTLIER 55.42 63.29 2.13 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.303 -0.873 . . . . 0.0 110.48 179.858 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -147.34 143.7 18.47 Favored Pre-proline 0 N--CA 1.49 1.565 0 O-C-N 121.202 -0.936 . . . . 0.0 110.034 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.467 ' O ' ' CD1' ' A' ' 23' ' ' TYR . 14.5 Cg_endo -72.89 -1.23 10.14 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 124.153 1.607 . . . . 0.0 110.114 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.666 ' CZ ' ' CE1' ' A' ' 48' ' ' TYR . 10.7 m-85 -130.44 150.06 51.84 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.262 -0.899 . . . . 0.0 109.866 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.523 HD12 ' N ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -135.28 145.01 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.116 -0.99 . . . . 0.0 110.106 -179.828 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.523 ' N ' HD12 ' A' ' 24' ' ' ILE . 2.1 mp -80.09 153.54 28.67 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.267 -0.896 . . . . 0.0 110.061 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.458 ' O ' ' HB2' ' A' ' 29' ' ' LEU . . . -66.32 -45.37 80.54 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.249 -0.907 . . . . 0.0 110.071 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.84 -36.93 77.84 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.143 -0.973 . . . . 0.0 109.687 179.705 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.468 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 0.9 OUTLIER -58.37 -38.7 77.81 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.294 -0.878 . . . . 0.0 109.183 179.273 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.458 ' HB2' ' O ' ' A' ' 26' ' ' ALA . 20.3 mt -61.42 -38.04 85.67 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.42 -0.8 . . . . 0.0 109.571 179.377 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.403 ' HA ' ' CB ' ' A' ' 38' ' ' ALA . 14.4 mtp85 -68.27 -34.03 75.45 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.306 -0.871 . . . . 0.0 110.077 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 15.4 ttt-85 -87.17 -21.56 25.85 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.284 -0.885 . . . . 0.0 110.7 -179.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.468 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 0.5 OUTLIER -99.02 -23.83 15.14 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.048 -1.033 . . . . 0.0 110.646 -179.552 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.478 ' CD2' ' HB3' ' A' ' 37' ' ' GLN . 3.5 mt -124.01 162.17 42.85 Favored Pre-proline 0 C--N 1.304 -1.39 0 O-C-N 121.11 -0.994 . . . . 0.0 110.196 -179.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.476 ' HD2' HD21 ' A' ' 33' ' ' LEU . 34.8 Cg_exo -62.72 179.86 0.64 Allowed 'Trans proline' 0 C--N 1.304 -1.768 0 O-C-N 123.918 1.483 . . . . 0.0 109.889 179.418 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.463 ' HD2' ' CB ' ' A' ' 34' ' ' PRO . 19.0 Cg_endo -63.99 -49.26 4.07 Favored 'Trans proline' 0 C--N 1.304 -1.772 0 O-C-N 123.941 1.495 . . . . 0.0 110.35 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -66.01 -40.94 91.55 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.292 -0.88 . . . . 0.0 110.863 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.478 ' HB3' ' CD2' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -69.65 -40.9 76.2 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.07 -1.019 . . . . 0.0 110.564 -179.5 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.403 ' CB ' ' HA ' ' A' ' 30' ' ' ARG . . . -66.45 -40.74 89.61 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.151 -0.968 . . . . 0.0 110.353 -179.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -66.08 -48.87 69.56 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.187 -0.946 . . . . 0.0 110.509 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -62.08 -45.58 92.88 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.237 -0.914 . . . . 0.0 110.593 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 68.7 m -60.74 -44.33 96.8 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.149 -0.969 . . . . 0.0 110.514 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 72.3 mt -61.17 -32.84 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.169 -0.957 . . . . 0.0 110.404 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -76.44 -24.49 53.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.136 -0.978 . . . . 0.0 110.346 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.639 ' CD ' ' CE1' ' A' ' 63' ' ' PHE . 0.1 OUTLIER -84.07 -61.79 1.73 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.207 -0.933 . . . . 0.0 110.142 179.987 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.483 ' HE3' ' HB3' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -34.39 103.46 0.23 Allowed Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.672 -0.642 . . . . 0.0 111.241 179.89 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -60.91 -155.48 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.725 0 O-C-N 123.889 1.468 . . . . 0.0 109.683 179.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -101.44 123.75 46.01 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.098 -1.001 . . . . 0.0 110.368 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.666 ' CE1' ' CZ ' ' A' ' 23' ' ' TYR . 3.0 t80 -56.46 -83.12 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.273 -0.892 . . . . 0.0 110.153 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.416 ' O ' ' OG ' ' A' ' 53' ' ' SER . 0.1 OUTLIER -136.4 146.84 46.91 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.286 -0.884 . . . . 0.0 110.237 179.929 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -77.13 -56.98 3.82 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -97.4 128.58 0.27 Allowed 'Trans proline' 0 C--N 1.306 -1.709 0 O-C-N 123.977 1.514 . . . . 0.0 110.344 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.483 ' O ' ' O ' ' A' ' 53' ' ' SER . . . 116.07 -69.65 0.27 Allowed Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.495 ' HB3' ' CD2' ' A' ' 48' ' ' TYR . 93.4 p -55.51 -157.53 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.328 0 O-C-N 121.41 -1.053 . . . . 0.0 110.734 -179.545 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.427 ' HB ' ' HD2' ' A' ' 55' ' ' PRO . 16.6 m -134.7 173.03 6.27 Favored Pre-proline 0 N--CA 1.491 1.592 0 O-C-N 121.204 -0.935 . . . . 0.0 110.208 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.427 ' HD2' ' HB ' ' A' ' 54' ' ' VAL . 19.6 Cg_endo -76.25 55.71 4.7 Favored 'Trans proline' 0 C--N 1.304 -1.782 0 O-C-N 124.033 1.544 . . . . 0.0 110.178 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 174.74 35.68 0.04 OUTLIER Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -131.57 111.11 11.46 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.205 -1.173 . . . . 0.0 110.204 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.471 ' HB3' ' HB3' ' A' ' 45' ' ' MET . 54.5 mt -114.57 159.77 20.04 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.322 -0.861 . . . . 0.0 110.198 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.501 ' OD1' ' N ' ' A' ' 59' ' ' ASP . 13.5 p30 -110.34 111.09 22.15 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.253 -0.905 . . . . 0.0 110.468 179.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.572 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 24.8 p90 -74.8 -27.35 60.27 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.169 -0.957 . . . . 0.0 109.268 179.435 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.572 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.12 -44.74 79.43 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.446 -0.784 . . . . 0.0 109.591 179.616 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.48 -32.83 72.85 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.254 -0.904 . . . . 0.0 109.472 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.639 ' CE1' ' CD ' ' A' ' 44' ' ' ARG . 1.1 t80 -71.67 -40.34 69.69 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.626 -0.671 . . . . 0.0 109.983 179.641 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 21.0 p -58.92 -45.14 91.07 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.295 -0.878 . . . . 0.0 110.23 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 16.3 t -60.51 -39.69 88.69 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.276 -0.89 . . . . 0.0 110.219 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.26 -40.7 51.22 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.215 -0.928 . . . . 0.0 110.104 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.502 ' HG ' ' N ' ' A' ' 68' ' ' TYR . 0.0 OUTLIER -66.48 -45.55 79.31 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.274 -0.891 . . . . 0.0 109.68 179.821 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.502 ' N ' ' HG ' ' A' ' 67' ' ' LEU . 3.9 m-85 -94.47 6.47 48.67 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.632 -0.668 . . . . 0.0 110.223 -179.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -142.78 105.84 0.41 Allowed Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -124.96 65.77 1.12 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.29 -1.124 . . . . 0.0 110.218 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.4 t -126.39 -64.66 1.02 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.293 -0.879 . . . . 0.0 110.219 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -96.37 135.23 38.52 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.274 -0.891 . . . . 0.0 110.193 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.64 0 O-C-N 121.205 -0.934 . . . . 0.0 110.209 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' GLY . . . . . 0.519 ' O ' ' CB ' ' B' ' 8' ' ' LYS . . . . . . . . 0 N--CA 1.49 2.262 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.519 ' CB ' ' O ' ' B' ' 7' ' ' GLY . 33.3 tttt 73.78 -48.07 0.66 Allowed 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.405 -1.056 . . . . 0.0 110.767 -179.852 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 7.2 ttmt -57.02 -33.85 67.59 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.038 -1.038 . . . . 0.0 110.037 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.38 -38.65 88.0 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.269 -0.894 . . . . 0.0 109.664 179.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -65.39 -42.1 93.0 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.296 -0.877 . . . . 0.0 109.807 179.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . 0.458 ' O ' HG22 ' B' ' 16' ' ' VAL . . . -63.16 -33.05 74.63 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.35 -0.844 . . . . 0.0 109.888 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.453 HG21 HD23 ' A' ' 17' ' ' LEU . 87.8 t -65.72 -42.29 92.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.287 -0.883 . . . . 0.0 110.135 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.71 -39.56 81.17 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.23 -0.919 . . . . 0.0 110.245 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.5 m -65.97 -43.74 87.01 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.301 -0.874 . . . . 0.0 110.193 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.458 HG22 ' O ' ' B' ' 12' ' ' ALA . 67.9 t -64.93 -43.22 96.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.246 -0.909 . . . . 0.0 110.06 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.425 HG23 ' HG2' ' A' ' 37' ' ' GLN . 43.6 t -58.58 -50.44 78.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.288 -0.883 . . . . 0.0 110.039 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.8 -46.69 88.44 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.251 -0.905 . . . . 0.0 109.822 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.78 -45.96 87.4 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.342 -0.849 . . . . 0.0 109.901 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . 0.435 HG21 ' O ' ' B' ' 16' ' ' VAL . 75.3 t -63.26 -44.14 99.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.278 -0.889 . . . . 0.0 109.642 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -59.61 -40.25 86.91 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.399 -0.813 . . . . 0.0 109.708 179.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -54.21 -40.13 67.34 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.231 -0.918 . . . . 0.0 109.532 179.539 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.04 -39.39 85.77 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.344 -0.847 . . . . 0.0 109.627 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 6.9 ttm-85 -60.26 -45.12 94.37 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.261 -0.899 . . . . 0.0 109.69 179.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 64.9 t -70.54 -21.14 22.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.384 -0.822 . . . . 0.0 109.781 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.481 ' O ' ' HD3' ' B' ' 28' ' ' PRO . 28.3 ttm-85 56.87 47.02 18.68 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.442 -0.786 . . . . 0.0 110.278 179.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -81.18 107.76 8.61 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.252 -0.905 . . . . 0.0 110.008 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . 0.481 ' HD3' ' O ' ' B' ' 26' ' ' ARG . 43.5 Cg_endo -72.22 -59.97 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.712 0 O-C-N 123.945 1.497 . . . . 0.0 110.409 -179.674 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 3.7 tpt180 . . . . . 0 N--CA 1.489 1.522 0 O-C-N 121.249 -0.907 . . . . 0.0 110.175 -179.899 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 121.26 0.553 . . . . 0.0 110.236 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 46.51 84.79 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.26 -0.9 . . . . 0.0 110.316 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -154.45 -162.37 1.39 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.222 -0.924 . . . . 0.0 110.226 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.0 t -50.3 176.55 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.203 -0.936 . . . . 0.0 110.177 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -107.45 -32.26 7.8 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.191 -0.943 . . . . 0.0 110.28 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.455 HG21 ' CE2' ' A' ' 68' ' ' TYR . 3.6 m -61.49 -50.91 70.85 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.247 -0.908 . . . . 0.0 110.15 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -69.99 -45.2 67.8 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.253 -0.904 . . . . 0.0 109.864 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -54.78 -37.07 65.58 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.34 -0.85 . . . . 0.0 109.806 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.0 tp60 -61.98 -45.0 95.55 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.306 -0.871 . . . . 0.0 110.0 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.453 ' O ' ' HB2' ' A' ' 14' ' ' PHE . 17.3 t -60.36 -45.14 96.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.238 -0.914 . . . . 0.0 109.947 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.404 HG23 HD11 ' A' ' 11' ' ' ILE . 69.2 mt -59.4 -49.65 82.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.319 -0.863 . . . . 0.0 109.911 179.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.97 -47.91 81.54 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.186 -0.947 . . . . 0.0 109.343 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.0 p -65.42 -36.06 82.8 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.336 -0.852 . . . . 0.0 109.201 179.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.453 ' HB2' ' O ' ' A' ' 10' ' ' VAL . 1.0 OUTLIER -68.29 -43.99 76.46 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.431 -0.793 . . . . 0.0 109.323 179.308 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.2 ttt180 -53.53 -48.44 69.04 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.391 -0.818 . . . . 0.0 108.974 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 50.7 mt -58.93 -43.42 88.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.412 -0.805 . . . . 0.0 109.566 179.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.469 HD11 ' N ' ' A' ' 17' ' ' LEU . 5.1 mp -64.94 -36.05 83.13 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.324 -0.86 . . . . 0.0 110.033 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.443 ' HA ' ' OE1' ' A' ' 28' ' ' GLU . . . -81.04 0.78 34.29 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.311 -0.868 . . . . 0.0 110.149 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.44 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 3.3 t 65.28 76.14 0.34 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.259 -0.901 . . . . 0.0 110.172 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.409 ' C ' ' O ' ' A' ' 19' ' ' SER . 10.4 t70 42.85 56.34 4.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.284 -0.885 . . . . 0.0 110.298 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.438 ' HG3' ' O ' ' A' ' 19' ' ' SER . 9.5 mttm -143.94 143.85 24.43 Favored Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.225 -0.922 . . . . 0.0 110.116 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.464 ' O ' ' CD1' ' A' ' 23' ' ' TYR . 19.2 Cg_endo -76.27 3.36 6.32 Favored 'Trans proline' 0 C--N 1.304 -1.795 0 O-C-N 124.049 1.552 . . . . 0.0 110.182 179.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.547 ' CZ ' ' CE1' ' A' ' 48' ' ' TYR . 47.7 m-85 -141.91 165.84 26.37 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.305 -0.872 . . . . 0.0 110.429 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.523 ' CD1' ' HB3' ' A' ' 28' ' ' GLU . 0.3 OUTLIER -132.48 146.32 33.1 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.376 -0.827 . . . . 0.0 109.841 179.932 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.522 ' N ' HD11 ' A' ' 24' ' ' ILE . 49.2 mt -92.33 155.64 17.79 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.164 -0.96 . . . . 0.0 110.344 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.488 ' O ' ' HG ' ' A' ' 29' ' ' LEU . . . -63.07 -38.97 93.32 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.35 -0.844 . . . . 0.0 110.056 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.05 -33.99 70.81 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.226 -0.921 . . . . 0.0 109.705 179.473 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.523 ' HB3' ' CD1' ' A' ' 24' ' ' ILE . 19.9 tt0 -62.9 -51.27 67.62 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.357 -0.839 . . . . 0.0 110.227 -179.563 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.494 ' HA ' ' HG2' ' A' ' 32' ' ' GLU . 4.0 pp -67.8 -33.28 74.49 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.01 -1.056 . . . . 0.0 109.221 179.132 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.45 ' HA ' ' HB3' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -65.55 -33.91 77.02 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.233 -0.917 . . . . 0.0 110.539 179.908 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -89.73 -15.1 33.22 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.062 -1.023 . . . . 0.0 111.395 -179.147 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.494 ' HG2' ' HA ' ' A' ' 29' ' ' LEU . 12.1 pt-20 -108.79 -24.32 11.35 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.797 -1.19 . . . . 0.0 111.329 -179.339 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.513 HD21 ' CB ' ' A' ' 37' ' ' GLN . 0.5 OUTLIER -110.1 146.32 33.95 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 120.944 -1.098 . . . . 0.0 110.173 -179.929 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.428 ' O ' ' C ' ' A' ' 35' ' ' PRO . 47.8 Cg_exo -48.17 140.75 19.2 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 O-C-N 123.934 1.491 . . . . 0.0 110.194 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.428 ' C ' ' O ' ' A' ' 34' ' ' PRO . 29.8 Cg_endo -41.12 -38.15 3.07 Favored 'Trans proline' 0 C--N 1.304 -1.804 0 O-C-N 124.062 1.559 . . . . 0.0 110.263 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -65.74 -44.16 86.79 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.308 -0.87 . . . . 0.0 110.441 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.513 ' CB ' HD21 ' A' ' 33' ' ' LEU . 62.6 mm-40 -68.95 -42.19 77.02 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.197 -0.939 . . . . 0.0 110.26 -179.731 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.493 ' HA ' ' CD1' ' A' ' 29' ' ' LEU . . . -56.25 -43.4 78.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.23 -0.919 . . . . 0.0 110.248 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -65.9 -44.75 84.3 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.24 -0.912 . . . . 0.0 110.148 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.09 -47.81 78.6 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.233 -0.917 . . . . 0.0 110.009 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.478 ' O ' ' HG2' ' A' ' 45' ' ' MET . 60.9 m -65.84 -51.0 62.57 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.453 -0.779 . . . . 0.0 111.082 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.493 HG13 ' CD1' ' A' ' 29' ' ' LEU . 44.3 mt -50.84 -28.49 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 O-C-N 121.208 -0.932 . . . . 0.0 110.675 -179.282 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 6.1 tttt -85.81 -27.14 25.33 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.218 -0.926 . . . . 0.0 110.693 -179.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.573 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 13.8 mmt180 -76.72 -71.63 0.39 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.245 -0.909 . . . . 0.0 110.801 -179.452 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.529 ' HE3' ' CA ' ' A' ' 60' ' ' TYR . 12.0 ptp -57.33 122.48 55.0 Favored Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 121.173 -0.954 . . . . 0.0 110.498 -179.636 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -75.5 -158.61 0.08 OUTLIER 'Trans proline' 0 C--N 1.307 -1.657 0 O-C-N 123.95 1.5 . . . . 0.0 110.199 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.471 ' O ' ' N ' ' A' ' 49' ' ' SER . . . -90.47 134.1 34.58 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.186 -0.947 . . . . 0.0 110.274 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.547 ' CE1' ' CZ ' ' A' ' 23' ' ' TYR . 3.7 t80 -61.88 79.35 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.279 -0.888 . . . . 0.0 110.272 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.471 ' N ' ' O ' ' A' ' 47' ' ' ALA . 33.5 p -67.26 176.87 2.05 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.228 -0.92 . . . . 0.0 110.251 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 156.06 -148.06 17.59 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -85.05 -20.35 3.51 Favored 'Trans proline' 0 C--N 1.304 -1.767 0 O-C-N 124.021 1.537 . . . . 0.0 110.237 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -148.42 -70.14 0.01 OUTLIER Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.422 -1.471 . . . . 0.0 109.422 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.403 ' OG ' ' N ' ' A' ' 54' ' ' VAL . 10.0 t 53.7 -178.59 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.186 -1.185 . . . . 0.0 110.081 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.403 ' N ' ' OG ' ' A' ' 53' ' ' SER . 21.6 m -140.33 175.96 2.82 Favored Pre-proline 0 C--N 1.296 -1.745 0 O-C-N 121.716 -0.615 . . . . 0.0 110.09 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -86.64 118.94 1.58 Allowed 'Trans proline' 0 C--N 1.305 -1.741 0 O-C-N 123.949 1.5 . . . . 0.0 110.272 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 120.58 -20.26 8.87 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -77.01 122.27 24.68 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.318 -1.107 . . . . 0.0 110.179 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.44 ' HB3' ' HG3' ' A' ' 45' ' ' MET . 70.8 mt -118.99 156.89 28.81 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.278 -0.889 . . . . 0.0 110.33 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -107.81 113.29 26.42 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.278 -0.888 . . . . 0.0 110.212 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.529 ' CA ' ' HE3' ' A' ' 45' ' ' MET . 26.0 p90 -83.78 -23.29 31.57 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.214 -0.929 . . . . 0.0 110.339 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.482 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.02 -41.46 74.99 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.119 -0.988 . . . . 0.0 109.508 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.51 -32.42 73.77 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.321 -0.862 . . . . 0.0 109.612 179.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.573 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 5.3 t80 -69.65 -33.09 72.12 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 121.62 -0.675 . . . . 0.0 110.252 179.725 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.452 ' HA ' HD22 ' A' ' 67' ' ' LEU . 5.8 p -63.92 -50.05 70.21 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.222 -0.924 . . . . 0.0 110.154 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.492 ' O ' ' N ' ' A' ' 69' ' ' GLY . 25.8 t -68.8 -35.39 76.96 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.203 -0.936 . . . . 0.0 110.108 179.839 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.18 -46.17 68.17 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.333 -0.854 . . . . 0.0 110.512 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.576 HD13 ' CG ' ' A' ' 68' ' ' TYR . 0.3 OUTLIER -69.33 -38.19 78.06 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.1 -1.0 . . . . 0.0 110.112 -179.84 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.576 ' CG ' HD13 ' A' ' 67' ' ' LEU . 2.4 m-85 -96.84 2.9 52.33 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.484 -0.76 . . . . 0.0 110.248 179.721 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 65' ' ' SER . . . -76.12 -166.14 21.17 Favored Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.675 -1.37 . . . . 0.0 109.675 -179.8 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -136.46 -44.32 0.61 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.359 -1.083 . . . . 0.0 110.289 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.92 115.56 15.75 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.205 -0.934 . . . . 0.0 110.308 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -69.89 110.33 4.95 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.271 -0.893 . . . . 0.0 110.248 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 14.7 tp . . . . . 0 N--CA 1.492 1.646 0 O-C-N 121.2 -0.937 . . . . 0.0 110.162 179.927 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 7' ' ' GLY . . . . . 0.449 ' C ' ' CD ' ' B' ' 8' ' ' LYS . . . . . . . . 0 N--CA 1.49 2.268 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.524 ' HG2' ' N ' ' B' ' 9' ' ' LYS . 0.0 OUTLIER -177.77 -29.64 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.279 -1.13 . . . . 0.0 110.408 179.824 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.524 ' N ' ' HG2' ' B' ' 8' ' ' LYS . 0.7 OUTLIER -57.61 -51.1 70.87 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.008 -1.058 . . . . 0.0 109.834 179.914 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.11 -33.98 67.89 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.252 -0.905 . . . . 0.0 109.581 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -68.7 -40.75 79.85 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.406 -0.809 . . . . 0.0 109.809 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.04 -35.87 81.69 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.344 -0.847 . . . . 0.0 109.983 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 57.8 t -61.62 -43.4 96.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.359 -0.838 . . . . 0.0 110.043 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.87 -35.57 75.08 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.236 -0.915 . . . . 0.0 110.131 179.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 17.0 m -68.16 -48.6 64.86 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.271 -0.893 . . . . 0.0 109.956 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 74.1 t -61.22 -44.32 98.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.237 -0.914 . . . . 0.0 110.13 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.412 HG21 ' HG3' ' A' ' 37' ' ' GLN . 44.1 t -58.46 -48.07 86.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.227 -0.921 . . . . 0.0 110.05 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.3 -39.81 88.24 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.348 -0.845 . . . . 0.0 110.134 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.54 -44.29 82.82 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.274 -0.891 . . . . 0.0 110.006 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . 0.444 ' HB ' ' OE1' ' A' ' 37' ' ' GLN . 77.5 t -63.79 -47.49 90.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.21 -0.931 . . . . 0.0 110.138 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . 0.459 ' O ' HG22 ' B' ' 25' ' ' VAL . 4.1 t70 -55.2 -38.05 67.88 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.18 -0.95 . . . . 0.0 109.636 179.643 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -63.38 -36.88 85.19 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.395 -0.816 . . . . 0.0 109.953 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.76 -39.48 93.68 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.305 -0.872 . . . . 0.0 110.3 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . 0.441 ' CG ' ' N ' ' B' ' 25' ' ' VAL . 0.5 OUTLIER -62.33 -44.92 95.36 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.257 -0.902 . . . . 0.0 109.845 -179.96 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . 0.459 HG22 ' O ' ' B' ' 21' ' ' ASP . 13.6 t -65.99 -24.51 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.256 -0.902 . . . . 0.0 110.039 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.05 16.41 11.29 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.514 -0.741 . . . . 0.0 109.584 179.609 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -105.3 143.56 27.02 Favored Pre-proline 0 N--CA 1.491 1.583 0 O-C-N 121.407 -0.808 . . . . 0.0 110.472 -179.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -80.13 99.75 1.2 Allowed 'Trans proline' 0 C--N 1.306 -1.709 0 O-C-N 124.069 1.563 . . . . 0.0 110.295 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 54.6 ttm-85 . . . . . 0 N--CA 1.492 1.635 0 O-C-N 121.183 -0.948 . . . . 0.0 110.16 179.969 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 ptt? . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.244 0.545 . . . . 0.0 110.189 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -109.32 -77.19 0.6 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.231 -0.918 . . . . 0.0 110.17 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -168.83 -160.41 0.28 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.287 -0.883 . . . . 0.0 110.117 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -131.08 127.47 38.24 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.21 -0.931 . . . . 0.0 110.135 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -172.16 169.91 5.35 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.221 -0.924 . . . . 0.0 110.193 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.608 ' CG2' ' CE1' ' A' ' 68' ' ' TYR . 2.9 m -55.57 -51.33 67.48 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.26 -0.9 . . . . 0.0 110.09 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -69.84 -44.31 70.15 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.205 -0.934 . . . . 0.0 109.774 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 19.7 tp10 -54.98 -36.41 65.35 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.371 -0.831 . . . . 0.0 109.697 179.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.402 ' O ' ' OG ' ' A' ' 13' ' ' SER . 1.1 tp60 -61.25 -44.83 96.61 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.295 -0.878 . . . . 0.0 109.858 179.89 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 59.2 t -58.38 -41.22 80.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.244 -0.91 . . . . 0.0 109.549 179.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.443 ' HA ' ' CE1' ' A' ' 60' ' ' TYR . 69.2 mt -66.71 -43.91 89.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.419 -0.801 . . . . 0.0 109.492 179.295 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.59 -43.27 84.5 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.276 -0.89 . . . . 0.0 108.861 179.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.419 ' O ' HD21 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -66.74 -38.66 87.1 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 178.71 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.552 ' HB3' ' CE2' ' A' ' 60' ' ' TYR . 1.2 m-85 -68.38 -42.28 79.36 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.491 -0.755 . . . . 0.0 109.437 179.124 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.77 -43.37 72.73 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.296 -0.878 . . . . 0.0 109.399 179.303 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.453 HD12 ' HE3' ' B' ' 8' ' ' LYS . 80.9 mt -63.79 -44.83 98.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.314 -0.866 . . . . 0.0 109.624 179.402 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.452 ' CD1' ' HB3' ' A' ' 32' ' ' GLU . 3.2 mm? -63.31 -34.75 78.36 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.32 -0.863 . . . . 0.0 109.735 179.585 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.517 ' CB ' ' O ' ' A' ' 23' ' ' TYR . . . -79.92 2.44 23.43 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.375 -0.828 . . . . 0.0 110.112 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.466 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 4.3 t 60.27 80.3 0.21 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.282 -0.886 . . . . 0.0 110.113 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.465 ' O ' ' HG2' ' A' ' 21' ' ' LYS . 6.3 m-20 45.31 59.33 3.6 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.346 -0.846 . . . . 0.0 110.438 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.466 ' HG3' ' O ' ' A' ' 19' ' ' SER . 18.4 mttp -153.5 141.72 14.01 Favored Pre-proline 0 N--CA 1.489 1.502 0 O-C-N 121.25 -0.906 . . . . 0.0 110.047 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.503 ' HG2' ' CE2' ' A' ' 23' ' ' TYR . 23.4 Cg_endo -78.36 6.25 4.89 Favored 'Trans proline' 0 C--N 1.303 -1.824 0 O-C-N 124.172 1.617 . . . . 0.0 110.232 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.517 ' O ' ' CB ' ' A' ' 18' ' ' ALA . 22.1 m-85 -135.91 166.16 23.97 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.277 -0.889 . . . . 0.0 110.107 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.517 HD11 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -138.45 140.58 39.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.137 -0.977 . . . . 0.0 110.062 -179.945 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.517 ' N ' HD11 ' A' ' 24' ' ' ILE . 4.4 mp -83.55 154.45 23.81 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.174 -0.953 . . . . 0.0 110.019 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.83 -45.28 71.57 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.254 -0.904 . . . . 0.0 110.304 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -56.54 -39.69 73.84 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.268 -0.895 . . . . 0.0 109.937 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -59.26 -41.62 89.26 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.327 -0.858 . . . . 0.0 109.199 179.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.568 ' CD1' ' CD1' ' A' ' 33' ' ' LEU . 2.0 mm? -61.52 -33.82 74.47 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.53 -0.731 . . . . 0.0 109.417 179.265 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 14.8 mmm-85 -68.91 -34.38 75.31 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.381 -0.824 . . . . 0.0 110.322 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.2 -25.45 15.29 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.146 -0.971 . . . . 0.0 111.413 -179.139 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.452 ' HB3' ' CD1' ' A' ' 17' ' ' LEU . 12.3 mm-40 -91.64 -23.59 19.79 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 120.925 -1.109 . . . . 0.0 111.449 -178.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.568 ' CD1' ' CD1' ' A' ' 29' ' ' LEU . 7.8 mt -123.85 163.64 33.93 Favored Pre-proline 0 N--CA 1.487 1.392 0 O-C-N 120.847 -1.158 . . . . 0.0 110.734 -179.297 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.479 ' HG2' ' NE2' ' A' ' 37' ' ' GLN . 21.7 Cg_exo -61.52 139.33 81.2 Favored 'Trans proline' 0 C--N 1.306 -1.69 0 O-C-N 124.114 1.586 . . . . 0.0 110.003 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.431 ' C ' ' O ' ' A' ' 34' ' ' PRO . 31.7 Cg_endo -39.98 -41.65 3.03 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 O-C-N 124.065 1.561 . . . . 0.0 110.511 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -66.0 -37.58 86.31 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.283 -0.885 . . . . 0.0 111.081 -179.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.516 ' OE1' ' CG2' ' B' ' 17' ' ' VAL . 0.1 OUTLIER -69.64 -42.16 74.62 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.928 -1.107 . . . . 0.0 110.42 -179.562 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.471 ' O ' HG12 ' A' ' 42' ' ' ILE . . . -56.01 -48.3 76.17 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.179 -0.951 . . . . 0.0 110.288 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -56.11 -48.83 75.43 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.086 -1.009 . . . . 0.0 110.469 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -62.56 -48.12 80.88 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.152 -0.968 . . . . 0.0 110.101 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 56.6 m -65.26 -47.29 77.25 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.255 -0.903 . . . . 0.0 110.046 179.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.471 HG12 ' O ' ' A' ' 38' ' ' ALA . 16.2 mm -57.41 -22.88 18.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.389 -0.819 . . . . 0.0 110.109 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 26.1 tttt -84.47 -24.14 29.6 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.284 -0.885 . . . . 0.0 110.385 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.581 ' HB3' ' CG ' ' A' ' 63' ' ' PHE . 10.6 mmt180 -93.65 -67.92 0.83 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.246 -0.909 . . . . 0.0 110.275 -179.858 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.49 ' HG3' ' HA ' ' A' ' 60' ' ' TYR . 2.0 ttm -36.62 105.44 0.3 Allowed Pre-proline 0 N--CA 1.493 1.721 0 O-C-N 121.598 -0.689 . . . . 0.0 111.001 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.464 ' HD2' ' OD1' ' A' ' 59' ' ' ASP . 37.6 Cg_exo -71.57 -158.79 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.729 0 O-C-N 124.03 1.542 . . . . 0.0 109.785 179.453 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -99.86 124.96 45.71 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.083 -1.011 . . . . 0.0 110.25 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -63.11 137.29 58.19 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.284 -0.885 . . . . 0.0 110.064 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 19.9 p -127.72 105.96 8.81 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.246 -0.909 . . . . 0.0 110.13 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -130.74 -122.68 2.43 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.632 -1.387 . . . . 0.0 109.632 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -97.08 19.18 0.48 Allowed 'Trans proline' 0 C--N 1.305 -1.757 0 O-C-N 123.97 1.511 . . . . 0.0 110.243 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 147.93 -37.37 1.1 Allowed Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.401 ' OG ' ' N ' ' A' ' 54' ' ' VAL . 9.6 t 52.87 -179.65 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.308 0 O-C-N 121.255 -1.144 . . . . 0.0 110.179 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.503 HG23 ' CB ' ' A' ' 57' ' ' ALA . 32.7 m -108.75 165.32 12.89 Favored Pre-proline 0 C--N 1.294 -1.808 0 O-C-N 121.71 -0.619 . . . . 0.0 110.151 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -74.61 80.86 2.22 Favored 'Trans proline' 0 C--N 1.304 -1.784 0 O-C-N 123.989 1.521 . . . . 0.0 110.208 -179.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 127.28 39.23 0.38 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.503 ' CB ' HG23 ' A' ' 54' ' ' VAL . . . -111.57 115.68 29.58 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.124 -1.221 . . . . 0.0 110.275 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.41 ' HB3' ' HB3' ' A' ' 45' ' ' MET . 1.1 mt -111.62 157.75 20.05 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.226 -0.921 . . . . 0.0 110.181 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.464 ' OD1' ' HD2' ' A' ' 46' ' ' PRO . 0.7 OUTLIER -110.52 111.44 22.69 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.125 -0.984 . . . . 0.0 110.397 179.738 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.552 ' CE2' ' HB3' ' A' ' 14' ' ' PHE . 22.7 p90 -73.66 -24.82 60.03 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.217 -0.927 . . . . 0.0 109.182 179.362 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.547 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.65 -42.68 79.36 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.465 -0.772 . . . . 0.0 109.765 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.45 -40.3 86.39 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.298 -0.876 . . . . 0.0 109.874 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.581 ' CG ' ' HB3' ' A' ' 44' ' ' ARG . 1.7 t80 -71.97 -35.17 69.46 Favored 'General case' 0 C--N 1.298 -1.666 0 O-C-N 121.591 -0.693 . . . . 0.0 110.384 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 70.3 m -58.37 -43.48 88.46 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.21 -0.931 . . . . 0.0 110.465 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.468 ' O ' ' N ' ' A' ' 69' ' ' GLY . 0.3 OUTLIER -61.28 -40.69 95.05 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.173 -0.954 . . . . 0.0 110.272 -179.855 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.61 -31.94 67.46 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.281 -0.887 . . . . 0.0 110.452 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.535 ' HG ' ' CE1' ' A' ' 63' ' ' PHE . 0.5 OUTLIER -64.67 -44.41 90.48 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.109 -0.994 . . . . 0.0 110.386 -179.825 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.608 ' CE1' ' CG2' ' A' ' 6' ' ' THR . 28.4 m-85 -99.54 -25.98 14.25 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.198 -0.939 . . . . 0.0 110.27 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.468 ' N ' ' O ' ' A' ' 65' ' ' SER . . . -82.65 68.36 3.55 Favored Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -109.99 -22.64 11.73 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.214 -1.168 . . . . 0.0 110.179 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 22.3 t -172.23 95.89 0.15 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.304 -0.873 . . . . 0.0 110.178 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -64.49 111.49 2.71 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.254 -0.904 . . . . 0.0 110.189 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.2 pp . . . . . 0 N--CA 1.492 1.625 0 O-C-N 121.272 -0.893 . . . . 0.0 110.136 -179.997 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.315 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.453 ' HE3' HD12 ' A' ' 16' ' ' ILE . 0.0 OUTLIER -174.52 34.33 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.271 -1.135 . . . . 0.0 110.134 179.931 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.32 -40.34 81.82 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.291 -0.88 . . . . 0.0 110.159 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.11 -46.5 79.1 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.23 -0.919 . . . . 0.0 109.964 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -62.12 -40.95 97.63 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.277 -0.89 . . . . 0.0 110.032 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.33 -37.11 86.33 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.342 -0.849 . . . . 0.0 110.184 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.439 ' O ' ' CG2' ' B' ' 17' ' ' VAL . 42.7 t -65.31 -45.09 94.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.321 -0.862 . . . . 0.0 110.128 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.33 -35.94 74.75 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.234 -0.916 . . . . 0.0 110.173 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 15.0 m -67.54 -40.95 85.01 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.378 -0.826 . . . . 0.0 110.347 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.497 ' O ' ' CG2' ' B' ' 20' ' ' VAL . 57.4 t -69.91 -40.18 78.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.248 -0.908 . . . . 0.0 110.168 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.516 ' CG2' ' OE1' ' A' ' 37' ' ' GLN . 16.7 t -61.45 -47.41 93.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.365 -0.834 . . . . 0.0 110.238 -179.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.86 -46.01 92.27 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.253 -0.904 . . . . 0.0 110.322 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.04 -41.4 95.23 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.228 -0.92 . . . . 0.0 110.287 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . 0.497 ' CG2' ' O ' ' B' ' 16' ' ' VAL . 75.1 t -67.1 -39.44 83.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.25 -0.906 . . . . 0.0 110.425 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.44 -33.73 76.55 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.235 -0.916 . . . . 0.0 110.333 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . 0.53 ' O ' ' CG1' ' B' ' 25' ' ' VAL . 28.8 tt0 -58.09 -49.38 77.14 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.286 -0.884 . . . . 0.0 110.267 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.15 -37.32 85.39 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.235 -0.915 . . . . 0.0 110.411 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 51.1 ttt-85 -70.35 -36.45 74.2 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.268 -0.895 . . . . 0.0 110.648 -179.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . 0.53 ' CG1' ' O ' ' B' ' 22' ' ' GLN . 3.3 p -52.51 -23.16 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.082 -1.011 . . . . 0.0 110.275 -179.664 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.501 ' N ' HG11 ' B' ' 25' ' ' VAL . 1.3 ttt180 -102.97 19.81 18.75 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.439 -0.788 . . . . 0.0 110.158 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.71 124.8 53.69 Favored Pre-proline 0 N--CA 1.491 1.582 0 O-C-N 121.334 -0.854 . . . . 0.0 110.274 -179.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -68.56 149.52 74.26 Favored 'Trans proline' 0 C--N 1.306 -1.708 0 O-C-N 124.013 1.533 . . . . 0.0 110.206 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 43.9 mtt85 . . . . . 0 N--CA 1.49 1.553 0 O-C-N 121.161 -0.962 . . . . 0.0 110.233 -179.928 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.654 0 CA-C-O 121.236 0.541 . . . . 0.0 110.173 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -108.99 163.34 13.39 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.232 -0.918 . . . . 0.0 110.186 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -88.61 60.27 5.52 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.2 -0.938 . . . . 0.0 110.222 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.412 HG22 ' HB3' ' A' ' 8' ' ' GLU . 9.6 t -103.84 -146.38 0.38 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.264 -0.898 . . . . 0.0 110.127 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -96.22 -84.89 0.35 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.259 -0.9 . . . . 0.0 110.192 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.5 m -156.6 -43.55 0.07 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.258 -0.901 . . . . 0.0 110.141 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.579 ' HA ' ' CZ ' ' A' ' 68' ' ' TYR . . . -69.99 -41.48 74.34 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.335 -0.853 . . . . 0.0 109.873 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.412 ' HB3' HG22 ' A' ' 4' ' ' THR . 2.1 tp10 -59.66 -36.9 77.35 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.278 -0.889 . . . . 0.0 109.742 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.452 ' O ' ' OG ' ' A' ' 13' ' ' SER . 2.0 tt0 -64.58 -44.04 91.94 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.439 -0.788 . . . . 0.0 110.284 -179.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.46 HG23 ' OH ' ' A' ' 68' ' ' TYR . 54.3 t -57.87 -43.75 85.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.203 -0.936 . . . . 0.0 109.86 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.5 mt -63.74 -49.16 83.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.329 -0.857 . . . . 0.0 109.351 179.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.06 -43.15 86.78 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.294 -0.879 . . . . 0.0 108.92 179.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.485 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 1.0 OUTLIER -63.56 -46.63 85.02 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.608 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.567 ' HB3' ' CE2' ' A' ' 60' ' ' TYR . 3.6 m-85 -59.81 -43.14 94.63 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.465 -0.772 . . . . 0.0 109.129 178.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -52.96 -40.59 63.82 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 61.6 mt -67.1 -44.93 87.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.541 -0.724 . . . . 0.0 110.267 179.41 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 13' ' ' SER . 9.3 mt -57.88 -42.11 83.9 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.929 -1.107 . . . . 0.0 109.698 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.461 ' HB2' ' O ' ' A' ' 23' ' ' TYR . . . -79.5 4.07 16.79 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.378 -0.826 . . . . 0.0 110.298 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.436 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.3 OUTLIER 64.91 66.8 0.55 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.268 -0.895 . . . . 0.0 110.234 179.959 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 52.11 59.88 4.22 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.213 -0.929 . . . . 0.0 110.308 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.448 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 20.9 mttt -143.51 142.05 20.27 Favored Pre-proline 0 N--CA 1.49 1.525 0 O-C-N 121.182 -0.949 . . . . 0.0 110.014 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -69.81 -3.15 11.47 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 O-C-N 124.089 1.573 . . . . 0.0 110.263 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.523 ' O ' ' CD1' ' A' ' 23' ' ' TYR . 7.0 p90 -143.4 152.37 41.5 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.239 -0.913 . . . . 0.0 110.055 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.9 tt -123.0 147.39 27.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.243 -0.911 . . . . 0.0 110.344 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.476 ' HB2' ' HB2' ' A' ' 28' ' ' GLU . 1.2 mp -80.48 141.43 35.22 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.241 -0.912 . . . . 0.0 109.92 179.867 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.484 ' O ' ' HG ' ' A' ' 29' ' ' LEU . . . -60.27 -40.6 90.94 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.203 -0.936 . . . . 0.0 110.471 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -65.01 -35.17 80.34 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.165 -0.959 . . . . 0.0 110.124 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.476 ' HB2' ' HB2' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -68.8 -49.98 54.04 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.366 -0.834 . . . . 0.0 109.869 179.992 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.509 ' CD1' HD13 ' A' ' 42' ' ' ILE . 0.9 OUTLIER -66.82 -34.07 77.01 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.373 -0.829 . . . . 0.0 110.042 179.834 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.539 ' HA ' ' CB ' ' A' ' 38' ' ' ALA . 17.2 ttp180 -69.18 -34.48 75.0 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.319 -0.863 . . . . 0.0 111.12 -179.642 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.531 ' HB3' ' NH1' ' A' ' 31' ' ' ARG . 5.0 ttp-105 -86.48 -22.46 26.43 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.007 -1.058 . . . . 0.0 111.32 -178.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.508 ' HG2' ' HA ' ' A' ' 29' ' ' LEU . 12.8 pt-20 -90.7 -24.03 20.55 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.831 -1.168 . . . . 0.0 110.776 -179.542 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.461 ' HB2' ' O ' ' A' ' 29' ' ' LEU . 7.6 mt -103.17 155.91 36.06 Favored Pre-proline 0 N--CA 1.488 1.457 0 O-C-N 121.122 -0.986 . . . . 0.0 110.409 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.46 ' HB2' ' OD1' ' A' ' 36' ' ' ASP . 6.2 Cg_exo -59.18 142.54 99.36 Favored 'Trans proline' 0 C--N 1.302 -1.892 0 O-C-N 124.069 1.563 . . . . 0.0 109.775 179.593 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.429 ' C ' ' O ' ' A' ' 34' ' ' PRO . 33.7 Cg_exo -37.72 -44.08 1.56 Allowed 'Trans proline' 0 C--N 1.305 -1.749 0 O-C-N 124.055 1.555 . . . . 0.0 110.917 -179.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.46 ' OD1' ' HB2' ' A' ' 34' ' ' PRO . 2.9 p-10 -65.9 -45.82 80.58 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.091 -1.006 . . . . 0.0 111.04 -179.606 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.447 ' HB3' HD21 ' A' ' 33' ' ' LEU . 0.6 OUTLIER -69.82 -37.85 76.36 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.951 -1.093 . . . . 0.0 110.705 -179.53 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.539 ' CB ' ' HA ' ' A' ' 30' ' ' ARG . . . -60.96 -43.86 98.13 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.369 -0.832 . . . . 0.0 110.952 -179.478 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.3 tm0? -60.09 -44.92 94.46 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.255 -0.903 . . . . 0.0 110.849 -179.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -62.21 -41.72 98.63 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.237 -0.914 . . . . 0.0 110.922 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.403 ' HB2' HD12 ' A' ' 29' ' ' LEU . 27.5 m -62.69 -50.88 69.41 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.128 -0.982 . . . . 0.0 110.755 -179.489 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.509 HD13 ' CD1' ' A' ' 29' ' ' LEU . 1.1 mt -63.84 -18.01 21.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.203 -0.935 . . . . 0.0 110.188 -179.736 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.429 ' C ' ' HD2' ' A' ' 44' ' ' ARG . 9.2 tttt -83.22 -16.01 48.19 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.25 -0.906 . . . . 0.0 110.772 -179.69 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.57 ' HB3' ' CG ' ' A' ' 63' ' ' PHE . 2.0 mpt_? -114.32 -62.26 1.62 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.106 -0.996 . . . . 0.0 110.675 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.561 ' HE3' ' CB ' ' A' ' 60' ' ' TYR . 2.3 ttm -32.88 111.1 0.35 Allowed Pre-proline 0 N--CA 1.497 1.92 0 O-C-N 121.618 -0.676 . . . . 0.0 111.272 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -80.06 177.68 8.02 Favored 'Trans proline' 0 C--N 1.306 -1.687 0 O-C-N 124.024 1.539 . . . . 0.0 110.194 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.87 133.17 46.24 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.252 -0.905 . . . . 0.0 110.237 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.444 ' CB ' ' O ' ' A' ' 57' ' ' ALA . 7.7 t80 -59.23 107.8 0.6 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.24 -0.912 . . . . 0.0 110.08 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -107.92 148.89 29.03 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.252 -0.905 . . . . 0.0 110.222 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 148.46 -150.91 23.15 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -78.7 106.74 2.15 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 O-C-N 124.084 1.57 . . . . 0.0 110.222 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.485 ' O ' ' HB2' ' A' ' 53' ' ' SER . . . 72.34 156.91 3.22 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.485 ' HB2' ' O ' ' A' ' 52' ' ' GLY . 34.6 t 178.37 -163.83 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.338 0 O-C-N 121.364 -1.08 . . . . 0.0 110.331 179.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.453 ' CG2' ' CB ' ' A' ' 57' ' ' ALA . 15.4 m -144.89 170.91 7.31 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.323 -0.861 . . . . 0.0 110.235 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -87.78 43.67 0.9 Allowed 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.998 1.525 . . . . 0.0 110.269 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 179.98 35.83 0.07 OUTLIER Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.453 ' CB ' ' CG2' ' A' ' 54' ' ' VAL . . . -122.36 104.5 9.46 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.214 -1.168 . . . . 0.0 110.107 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.437 ' HB3' ' HB3' ' A' ' 45' ' ' MET . 54.3 mt -93.76 159.04 15.38 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.323 -0.861 . . . . 0.0 110.176 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.45 ' C ' ' HG3' ' A' ' 45' ' ' MET . 1.2 m-20 -115.28 110.42 19.39 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.105 -0.997 . . . . 0.0 110.41 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.579 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 15.9 p90 -72.77 -25.77 61.29 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.379 -0.826 . . . . 0.0 110.271 179.767 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.579 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.7 -36.73 67.5 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.279 -0.888 . . . . 0.0 109.958 -179.7 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.56 -43.36 80.84 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.322 -0.861 . . . . 0.0 109.557 179.416 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.57 ' CG ' ' HB3' ' A' ' 44' ' ' ARG . 1.5 t80 -72.12 -35.29 69.11 Favored 'General case' 0 C--N 1.297 -1.689 0 O-C-N 121.75 -0.593 . . . . 0.0 110.311 179.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.566 ' O ' ' CE2' ' A' ' 68' ' ' TYR . 44.3 m -59.67 -49.87 76.07 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.298 -0.876 . . . . 0.0 110.569 -179.606 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.97 -41.24 82.49 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.184 -0.947 . . . . 0.0 110.344 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.64 -39.6 73.96 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.231 -0.918 . . . . 0.0 110.386 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.447 ' CD2' ' HB2' ' B' ' 23' ' ' ALA . 15.3 mt -57.75 -41.12 81.3 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.144 -0.972 . . . . 0.0 110.241 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.579 ' CZ ' ' HA ' ' A' ' 7' ' ' ALA . 2.7 m-85 -84.15 10.15 10.95 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.271 -0.893 . . . . 0.0 110.077 -179.736 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 149.26 -101.58 0.22 Allowed Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 48.6 tt0 -166.85 -54.99 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.228 -1.16 . . . . 0.0 110.204 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.1 m -161.52 159.72 28.23 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.214 -0.929 . . . . 0.0 110.244 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -80.08 133.71 36.13 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.191 -0.943 . . . . 0.0 110.163 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.576 0 O-C-N 121.253 -0.905 . . . . 0.0 110.305 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.331 0 N-CA-C 109.524 -1.431 . . . . 0.0 109.524 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.451 ' HB2' ' OE1' ' B' ' 11' ' ' GLU . 0.2 OUTLIER -158.28 37.04 0.24 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.217 -1.167 . . . . 0.0 110.133 179.905 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.65 -45.63 82.24 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.24 -0.913 . . . . 0.0 110.025 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.99 -40.84 77.34 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.314 -0.866 . . . . 0.0 109.997 179.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . 0.451 ' OE1' ' HB2' ' B' ' 8' ' ' LYS . 5.2 mt-10 -62.05 -40.92 97.39 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.333 -0.854 . . . . 0.0 110.024 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . 0.406 ' O ' HG21 ' B' ' 16' ' ' VAL . . . -65.43 -43.08 91.61 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.415 -0.803 . . . . 0.0 110.0 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.438 ' O ' HG22 ' B' ' 17' ' ' VAL . 90.1 t -58.64 -44.25 89.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.215 -0.928 . . . . 0.0 110.013 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.29 -39.56 90.89 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.307 -0.87 . . . . 0.0 110.179 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 19.7 m -64.66 -44.43 90.42 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.226 -0.921 . . . . 0.0 110.136 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.406 HG21 ' O ' ' B' ' 12' ' ' ALA . 59.8 t -65.18 -42.28 93.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.246 -0.909 . . . . 0.0 110.08 179.898 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.438 HG22 ' O ' ' B' ' 13' ' ' VAL . 74.4 t -60.66 -44.79 97.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.271 -0.893 . . . . 0.0 110.256 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.71 -46.32 90.16 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.197 -0.94 . . . . 0.0 110.199 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.51 -42.02 92.53 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.27 -0.894 . . . . 0.0 110.232 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 57.6 t -66.04 -46.04 89.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.304 -0.873 . . . . 0.0 110.244 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -63.08 -32.58 73.98 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.235 -0.915 . . . . 0.0 110.221 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 4.5 tp60 -56.9 -41.45 78.12 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.268 -0.895 . . . . 0.0 110.11 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . 0.447 ' HB2' ' CD2' ' A' ' 67' ' ' LEU . . . -60.63 -39.06 86.85 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.207 -0.933 . . . . 0.0 109.981 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.72 -33.22 74.67 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.367 -0.833 . . . . 0.0 110.264 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -67.91 -20.8 26.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.277 -0.889 . . . . 0.0 110.05 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 12.0 ttm180 -84.28 26.81 0.73 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.323 -0.861 . . . . 0.0 110.966 -179.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -109.77 134.04 20.75 Favored Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.092 -1.005 . . . . 0.0 110.166 179.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -43.71 100.7 0.04 OUTLIER 'Trans proline' 0 C--N 1.306 -1.709 0 O-C-N 123.879 1.463 . . . . 0.0 110.23 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 10.9 ttm180 . . . . . 0 N--CA 1.49 1.572 0 O-C-N 121.277 -0.889 . . . . 0.0 110.269 -179.991 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 121.269 0.557 . . . . 0.0 110.2 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -95.05 94.04 7.73 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.212 -0.93 . . . . 0.0 110.264 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -93.84 -170.96 2.45 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.25 -0.906 . . . . 0.0 110.207 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -117.9 159.6 22.83 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.303 -0.873 . . . . 0.0 110.285 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.493 ' O ' ' N ' ' A' ' 7' ' ' ALA . 0.2 OUTLIER 62.21 154.12 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.165 -0.959 . . . . 0.0 110.321 179.937 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.564 HG21 ' CZ ' ' A' ' 68' ' ' TYR . 1.9 m 66.62 -59.88 0.35 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.284 -0.885 . . . . 0.0 110.258 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.493 ' N ' ' O ' ' A' ' 5' ' ' ASP . . . -67.8 -37.97 82.69 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.289 -0.882 . . . . 0.0 109.43 179.592 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.6 tp10 -59.85 -36.02 75.98 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.418 -0.801 . . . . 0.0 109.681 179.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.15 -45.66 93.74 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.327 -0.858 . . . . 0.0 110.046 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.509 HG13 ' CD2' ' A' ' 14' ' ' PHE . 21.7 t -61.88 -43.64 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.097 -1.002 . . . . 0.0 109.649 179.621 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 34.8 mt -57.3 -49.47 79.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.385 -0.822 . . . . 0.0 109.413 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.05 -41.85 93.19 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.293 -0.879 . . . . 0.0 109.063 179.09 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.433 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 5.1 m -65.46 -41.24 93.6 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.48 -0.762 . . . . 0.0 109.153 179.022 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.557 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 2.2 m-85 -68.43 -41.26 80.58 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.385 -0.822 . . . . 0.0 109.395 179.257 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.422 ' HD3' ' HA ' ' A' ' 20' ' ' ASP . 1.5 tmm_? -53.58 -43.63 68.7 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.353 -0.842 . . . . 0.0 109.612 179.509 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 54.8 mt -60.14 -44.94 96.28 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.283 -0.886 . . . . 0.0 109.691 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 13' ' ' SER . 38.5 mt -65.36 -40.15 93.21 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.295 -0.878 . . . . 0.0 109.803 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.468 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -72.35 -4.88 32.58 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.298 -0.876 . . . . 0.0 110.103 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.468 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.3 OUTLIER 68.48 54.17 0.54 Allowed 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.24 -0.912 . . . . 0.0 110.2 -179.922 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.422 ' HA ' ' HD3' ' A' ' 15' ' ' ARG . 2.2 t70 63.02 36.74 12.2 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.204 -0.935 . . . . 0.0 110.313 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.465 ' HG3' ' O ' ' A' ' 18' ' ' ALA . 7.5 mmtt -118.47 144.75 35.86 Favored Pre-proline 0 N--CA 1.49 1.543 0 O-C-N 121.237 -0.914 . . . . 0.0 110.037 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -68.77 -5.33 15.2 Favored 'Trans proline' 0 C--N 1.304 -1.79 0 O-C-N 124.123 1.591 . . . . 0.0 109.999 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.544 ' N ' ' CD1' ' A' ' 23' ' ' TYR . 18.0 p90 -141.01 165.11 28.45 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.419 -0.8 . . . . 0.0 110.106 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.543 ' CD1' ' CD2' ' A' ' 29' ' ' LEU . 0.4 OUTLIER -125.76 149.88 30.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.217 -0.927 . . . . 0.0 109.96 -179.886 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.581 ' CD2' ' N ' ' A' ' 25' ' ' LEU . 2.9 mm? -90.99 154.64 19.3 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.26 -0.9 . . . . 0.0 110.238 -179.872 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.0 -37.64 78.83 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.3 -0.875 . . . . 0.0 110.112 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -65.89 -35.2 79.98 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.277 -0.889 . . . . 0.0 110.071 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.455 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 1.1 mt-10 -62.59 -43.99 97.43 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.322 -0.862 . . . . 0.0 109.93 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.543 ' CD2' ' CD1' ' A' ' 24' ' ' ILE . 3.8 mm? -62.55 -34.31 76.69 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.173 -0.955 . . . . 0.0 109.883 179.738 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.77 -39.05 80.43 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.312 -0.868 . . . . 0.0 110.175 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.74 -15.9 27.68 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.267 -0.895 . . . . 0.0 110.298 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.455 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 3.1 mm-40 -100.41 -23.58 14.71 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.109 -0.994 . . . . 0.0 110.383 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.528 HD21 ' CB ' ' A' ' 37' ' ' GLN . 0.3 OUTLIER -134.8 151.4 75.63 Favored Pre-proline 0 N--CA 1.487 1.395 0 O-C-N 121.103 -0.998 . . . . 0.0 110.306 -179.694 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.471 ' HD2' HD21 ' A' ' 33' ' ' LEU . 8.8 Cg_endo -50.5 140.41 35.73 Favored 'Trans proline' 0 C--N 1.304 -1.763 0 O-C-N 124.009 1.531 . . . . 0.0 110.218 179.727 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -43.72 -35.03 6.19 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 124.029 1.542 . . . . 0.0 110.328 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -62.68 -45.63 91.89 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.179 -0.951 . . . . 0.0 110.239 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.528 ' CB ' HD21 ' A' ' 33' ' ' LEU . 1.9 mp0 -69.33 -42.23 75.6 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.179 -0.951 . . . . 0.0 110.297 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.45 -48.42 79.21 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.243 -0.911 . . . . 0.0 110.225 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -57.48 -43.06 83.79 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.31 -0.869 . . . . 0.0 109.867 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -66.13 -44.22 84.85 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.284 -0.885 . . . . 0.0 110.127 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.466 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 5.5 m -59.52 -50.7 72.9 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.3 -0.875 . . . . 0.0 110.494 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 81.2 mt -60.0 -25.21 32.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.269 -0.895 . . . . 0.0 110.339 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.85 -40.37 72.41 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.27 -0.894 . . . . 0.0 109.721 179.495 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.592 ' CB ' ' CD2' ' A' ' 63' ' ' PHE . 11.1 mpt_? -84.46 -69.07 0.67 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.373 -0.829 . . . . 0.0 109.815 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.535 ' CE ' ' HB3' ' A' ' 60' ' ' TYR . 21.5 mtt -32.04 116.78 0.39 Allowed Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.775 -0.578 . . . . 0.0 111.197 179.42 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.533 ' HD2' ' CB ' ' A' ' 62' ' ' ALA . 38.8 Cg_exo -87.83 -149.64 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.753 0 O-C-N 124.013 1.533 . . . . 0.0 110.048 179.721 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -89.05 140.03 29.86 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.195 -0.941 . . . . 0.0 110.299 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -69.23 -56.21 8.26 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.233 -0.917 . . . . 0.0 110.257 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 55.81 89.37 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.28 -0.887 . . . . 0.0 110.233 -179.965 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -134.29 -156.62 7.91 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.683 -1.367 . . . . 0.0 109.683 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -84.53 79.87 2.4 Favored 'Trans proline' 0 C--N 1.306 -1.705 0 O-C-N 124.068 1.562 . . . . 0.0 110.378 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.485 ' O ' ' O ' ' A' ' 53' ' ' SER . . . 86.33 38.81 8.14 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.693 -1.363 . . . . 0.0 109.693 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.485 ' O ' ' O ' ' A' ' 52' ' ' GLY . 1.5 p -54.22 -162.55 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.277 0 O-C-N 121.338 -1.095 . . . . 0.0 110.599 -179.715 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 24.0 m -124.92 160.79 52.57 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.255 -0.903 . . . . 0.0 110.185 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -73.5 69.06 4.32 Favored 'Trans proline' 0 C--N 1.306 -1.663 0 O-C-N 124.031 1.543 . . . . 0.0 110.36 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.469 ' O ' HD11 ' A' ' 25' ' ' LEU . . . 148.7 37.14 0.04 OUTLIER Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.734 -1.346 . . . . 0.0 109.734 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -113.56 115.01 27.29 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.204 -1.174 . . . . 0.0 110.016 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.592 ' CD2' ' N ' ' A' ' 58' ' ' LEU . 0.9 OUTLIER -105.6 160.73 14.96 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.28 -0.887 . . . . 0.0 110.217 -179.615 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.514 ' OD1' ' N ' ' A' ' 59' ' ' ASP . 1.5 p-10 -107.46 110.53 22.5 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.097 -1.002 . . . . 0.0 111.081 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.576 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 16.0 p90 -72.77 -23.21 60.79 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.328 -0.858 . . . . 0.0 109.231 178.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.576 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.19 -41.92 72.59 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.273 -0.892 . . . . 0.0 108.719 179.436 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.533 ' CB ' ' HD2' ' A' ' 46' ' ' PRO . . . -58.89 -32.19 69.28 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 119.494 -0.882 . . . . 0.0 108.79 178.493 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.592 ' CD2' ' CB ' ' A' ' 44' ' ' ARG . 26.2 t80 -59.7 -49.33 78.16 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 121.257 0.551 . . . . 0.0 110.708 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.468 ' OG ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -70.5 -37.25 74.16 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.123 -0.985 . . . . 0.0 110.78 -179.432 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 51.3 p -64.52 -41.78 96.18 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.149 -0.969 . . . . 0.0 110.467 -179.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -75.57 -40.69 56.31 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.148 -0.97 . . . . 0.0 110.507 -179.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.574 HD12 ' CD1' ' A' ' 63' ' ' PHE . 0.2 OUTLIER -64.02 -43.98 93.95 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.204 -0.935 . . . . 0.0 110.424 -179.713 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.564 ' CZ ' HG21 ' A' ' 6' ' ' THR . 24.5 m-85 -98.89 15.36 25.84 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.23 -0.919 . . . . 0.0 110.287 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -96.5 -170.23 34.46 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.454 -1.458 . . . . 0.0 109.454 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -68.27 -169.09 0.13 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.259 -1.142 . . . . 0.0 110.15 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.4 p -164.5 -177.11 4.67 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.281 -0.887 . . . . 0.0 110.234 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -101.68 135.09 43.8 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.198 -0.939 . . . . 0.0 110.199 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.8 tp . . . . . 0 N--CA 1.492 1.645 0 O-C-N 121.239 -0.913 . . . . 0.0 110.14 -179.947 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.89 -5.71 56.52 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.262 -1.14 . . . . 0.0 110.282 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 10.4 ttpt -62.3 -39.45 93.05 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.251 -0.906 . . . . 0.0 110.239 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.66 -40.04 86.42 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.211 -0.931 . . . . 0.0 110.15 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.31 -39.81 91.87 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.316 -0.865 . . . . 0.0 110.273 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.98 -41.87 98.51 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.18 -0.95 . . . . 0.0 109.984 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.462 ' O ' HG22 ' B' ' 17' ' ' VAL . 59.0 t -63.65 -43.11 98.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.264 -0.898 . . . . 0.0 109.721 179.518 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.51 -42.21 95.91 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.317 -0.864 . . . . 0.0 110.005 179.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 22.8 m -64.57 -43.21 94.63 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.314 -0.866 . . . . 0.0 110.018 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 30.9 t -63.61 -46.51 94.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.255 -0.903 . . . . 0.0 110.024 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.512 ' CG2' HD22 ' A' ' 33' ' ' LEU . 83.2 t -58.16 -42.32 82.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.245 -0.91 . . . . 0.0 109.944 179.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.67 -45.57 93.66 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.231 -0.918 . . . . 0.0 109.917 179.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.97 -42.06 90.35 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.301 -0.874 . . . . 0.0 109.957 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . 0.503 HG23 ' CZ ' ' A' ' 63' ' ' PHE . 52.2 t -67.77 -43.2 86.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.278 -0.889 . . . . 0.0 110.045 179.837 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . 0.459 ' O ' ' HG2' ' B' ' 24' ' ' ARG . 2.0 t70 -64.2 -34.04 77.17 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.283 -0.885 . . . . 0.0 110.123 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . 0.439 ' OE1' ' OE1' ' B' ' 27' ' ' GLU . 0.6 OUTLIER -66.9 -36.58 82.6 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.232 -0.917 . . . . 0.0 110.243 179.926 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.38 -42.77 92.32 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.238 -0.913 . . . . 0.0 110.618 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . 0.459 ' HG2' ' O ' ' B' ' 21' ' ' ASP . 2.1 ptm180 -70.3 -35.84 73.95 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.041 -1.037 . . . . 0.0 110.274 -179.863 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . 0.466 ' O ' ' CB ' ' B' ' 26' ' ' ARG . 71.3 t -54.22 -21.19 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.363 -0.836 . . . . 0.0 110.463 -179.886 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.466 ' CB ' ' O ' ' B' ' 25' ' ' VAL . 0.5 OUTLIER 67.88 70.87 0.33 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.329 -0.857 . . . . 0.0 110.096 -179.899 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . 0.439 ' OE1' ' OE1' ' B' ' 22' ' ' GLN . 1.6 pt-20 -75.98 142.39 72.59 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.235 -0.915 . . . . 0.0 110.336 -179.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -83.84 137.18 7.49 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 O-C-N 124.086 1.572 . . . . 0.0 110.358 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 2.9 ttt85 . . . . . 0 N--CA 1.491 1.582 0 O-C-N 121.187 -0.946 . . . . 0.0 110.279 179.979 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.405 ' O ' ' HG3' ' A' ' 1' ' ' MET . 4.4 ptp . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 121.284 0.564 . . . . 0.0 110.227 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -139.67 155.93 47.11 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.246 -0.909 . . . . 0.0 110.27 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 17.4 p30 -150.37 163.98 37.0 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.282 -0.886 . . . . 0.0 110.011 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.46 ' HA ' ' OE1' ' A' ' 8' ' ' GLU . 10.0 t -161.22 175.78 11.95 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.163 -0.96 . . . . 0.0 110.435 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -178.42 -160.51 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.315 -0.866 . . . . 0.0 110.207 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.2 m -76.93 -52.23 9.79 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.289 -0.882 . . . . 0.0 110.092 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -70.04 -46.25 65.42 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.162 -0.961 . . . . 0.0 109.909 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.46 ' OE1' ' HA ' ' A' ' 4' ' ' THR . 1.3 tt0 -54.64 -36.68 64.79 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.383 -0.823 . . . . 0.0 110.051 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -61.63 -43.09 99.51 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.255 -0.903 . . . . 0.0 110.236 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 98.2 t -61.79 -42.13 93.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.194 -0.941 . . . . 0.0 109.996 179.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 82.7 mt -57.41 -49.88 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.31 -0.869 . . . . 0.0 109.683 179.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.54 -37.61 76.04 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 119.504 -0.878 . . . . 0.0 108.796 178.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.466 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 41.7 m -67.66 -39.7 84.54 Favored 'General case' 0 N--CA 1.485 1.324 0 O-C-N 121.456 -0.778 . . . . 0.0 109.206 178.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.507 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 0.7 OUTLIER -68.41 -42.62 78.73 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.346 -0.847 . . . . 0.0 109.534 179.185 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -53.95 -41.57 67.92 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.245 -0.91 . . . . 0.0 108.939 179.077 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.431 HG22 HD11 ' A' ' 16' ' ' ILE . 40.8 mt -62.0 -41.11 89.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.459 -0.775 . . . . 0.0 109.611 179.21 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 13' ' ' SER . 26.7 mt -64.89 -41.94 95.19 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.256 -0.902 . . . . 0.0 109.456 179.455 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.477 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -77.14 -7.31 55.58 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.438 -0.789 . . . . 0.0 110.092 179.761 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.477 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 68.07 67.44 0.34 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.231 -0.918 . . . . 0.0 110.235 -179.908 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 59.85 61.84 1.82 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.246 -0.908 . . . . 0.0 110.3 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.436 ' HB2' ' CB ' ' A' ' 18' ' ' ALA . 6.3 mttt -147.92 142.78 16.93 Favored Pre-proline 0 N--CA 1.489 1.487 0 O-C-N 121.234 -0.916 . . . . 0.0 110.01 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -74.29 0.92 7.9 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 O-C-N 123.955 1.503 . . . . 0.0 110.081 179.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.463 ' O ' ' HB2' ' A' ' 18' ' ' ALA . 45.5 p90 -145.83 164.82 30.73 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.259 -0.901 . . . . 0.0 110.159 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.523 ' CG2' ' SD ' ' A' ' 45' ' ' MET . 0.2 OUTLIER -131.62 141.91 44.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.162 -0.961 . . . . 0.0 110.2 -179.873 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.469 ' O ' HD11 ' A' ' 24' ' ' ILE . 4.2 mt -81.52 157.7 24.73 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.13 -0.981 . . . . 0.0 110.205 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.73 -41.06 75.8 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.302 -0.874 . . . . 0.0 110.32 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -60.7 -35.41 76.23 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.176 -0.953 . . . . 0.0 110.17 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.455 ' OE1' ' OE2' ' A' ' 32' ' ' GLU . 9.0 mt-10 -64.25 -44.11 92.82 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.348 -0.845 . . . . 0.0 109.925 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 18.0 mt -60.66 -33.72 73.24 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.203 -0.936 . . . . 0.0 109.609 179.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.9 mtt85 -67.89 -35.08 77.88 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.388 -0.82 . . . . 0.0 110.309 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.4 ttt180 -95.62 -20.62 18.81 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.164 -0.96 . . . . 0.0 110.82 -179.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.46 ' OE1' ' HB3' ' A' ' 17' ' ' LEU . 86.5 mt-10 -96.14 -23.78 16.59 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.05 -1.031 . . . . 0.0 110.466 -179.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.525 HD21 ' CB ' ' A' ' 37' ' ' GLN . 6.0 mt -129.44 153.59 80.62 Favored Pre-proline 0 C--N 1.305 -1.348 0 O-C-N 121.233 -0.917 . . . . 0.0 110.078 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.461 ' HD2' HD21 ' A' ' 33' ' ' LEU . 33.1 Cg_exo -56.19 154.46 28.45 Favored 'Trans proline' 0 C--N 1.306 -1.69 0 O-C-N 123.94 1.495 . . . . 0.0 110.264 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -47.68 -38.74 29.66 Favored 'Trans proline' 0 C--N 1.307 -1.652 0 O-C-N 124.048 1.551 . . . . 0.0 110.305 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.73 -46.33 85.87 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.248 -0.908 . . . . 0.0 110.291 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.525 ' CB ' HD21 ' A' ' 33' ' ' LEU . 9.6 mp0 -69.27 -44.42 71.92 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.282 -0.886 . . . . 0.0 110.383 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.44 ' O ' ' CD1' ' A' ' 42' ' ' ILE . . . -56.26 -48.07 77.29 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.175 -0.953 . . . . 0.0 110.367 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.8 tm0? -64.74 -43.02 94.7 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.226 -0.921 . . . . 0.0 110.191 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -64.93 -46.79 80.17 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.281 -0.887 . . . . 0.0 110.305 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.443 ' SG ' ' O ' ' A' ' 37' ' ' GLN . 62.2 m -65.46 -49.71 68.09 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.157 -0.965 . . . . 0.0 110.452 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.44 ' CD1' ' O ' ' A' ' 38' ' ' ALA . 6.3 mt -58.22 -24.03 23.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.221 -0.924 . . . . 0.0 110.38 -179.769 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.41 -30.3 33.62 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.156 -0.965 . . . . 0.0 110.367 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.583 ' HG3' ' CE1' ' A' ' 63' ' ' PHE . 2.2 mmt180 -86.27 -58.93 2.44 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.218 -0.927 . . . . 0.0 110.195 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.523 ' SD ' ' CG2' ' A' ' 24' ' ' ILE . 1.4 ttm -38.29 119.27 1.02 Allowed Pre-proline 0 N--CA 1.492 1.641 0 O-C-N 121.511 -0.743 . . . . 0.0 110.722 179.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -82.1 -163.16 0.2 Allowed 'Trans proline' 0 C--N 1.305 -1.736 0 O-C-N 123.937 1.493 . . . . 0.0 110.22 179.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -88.44 127.43 35.51 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.215 -0.928 . . . . 0.0 110.267 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.5 ' CB ' ' O ' ' A' ' 57' ' ' ALA . 5.9 t80 -65.04 116.31 6.31 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.191 -0.943 . . . . 0.0 110.052 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.32 126.74 52.44 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.203 -0.936 . . . . 0.0 110.18 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -155.6 -119.5 0.65 Allowed Glycine 0 N--CA 1.489 2.232 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -95.13 -42.1 0.02 OUTLIER 'Trans proline' 0 C--N 1.304 -1.765 0 O-C-N 124.053 1.554 . . . . 0.0 110.203 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.485 ' O ' ' O ' ' A' ' 53' ' ' SER . . . -170.56 51.9 0.19 Allowed Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.451 -1.46 . . . . 0.0 109.451 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.485 ' O ' ' O ' ' A' ' 52' ' ' GLY . 2.5 m -54.87 -159.82 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.325 0 O-C-N 121.347 -1.09 . . . . 0.0 110.746 -179.656 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.443 ' O ' ' N ' ' A' ' 56' ' ' GLY . 12.1 m -141.44 147.84 48.11 Favored Pre-proline 0 N--CA 1.492 1.633 0 O-C-N 121.225 -0.922 . . . . 0.0 110.158 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -57.88 86.68 0.05 OUTLIER 'Trans proline' 0 C--N 1.305 -1.728 0 O-C-N 124.095 1.577 . . . . 0.0 110.21 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 54' ' ' VAL . . . 164.73 -36.52 0.28 Allowed Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.5 ' O ' ' CB ' ' A' ' 48' ' ' TYR . . . -78.82 96.62 5.68 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.206 -1.173 . . . . 0.0 110.207 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.495 ' CB ' ' HG2' ' A' ' 45' ' ' MET . 13.2 mt -92.71 155.76 17.49 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.186 -0.946 . . . . 0.0 110.17 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.442 ' C ' ' HG3' ' A' ' 45' ' ' MET . 4.4 m-20 -103.32 111.7 24.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.2 -0.938 . . . . 0.0 110.13 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.507 ' HB2' ' CD2' ' A' ' 14' ' ' PHE . 23.7 p90 -72.63 -22.35 60.96 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.389 -0.82 . . . . 0.0 110.157 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.488 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.01 -34.18 65.58 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.182 -0.949 . . . . 0.0 110.021 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.23 -36.49 79.58 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.234 -0.916 . . . . 0.0 109.827 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.587 ' CE1' ' HB3' ' A' ' 67' ' ' LEU . 3.5 t80 -72.1 -35.42 69.2 Favored 'General case' 0 C--N 1.297 -1.683 0 O-C-N 121.676 -0.64 . . . . 0.0 110.455 179.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.5 m -56.51 -49.76 73.78 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.258 -0.901 . . . . 0.0 110.567 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.5 m -66.15 -35.6 80.92 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.247 -0.908 . . . . 0.0 110.471 -179.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.13 -39.36 63.36 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.299 -0.875 . . . . 0.0 110.841 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.587 ' HB3' ' CE1' ' A' ' 63' ' ' PHE . 0.3 OUTLIER -72.55 -41.22 66.02 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.099 -1.001 . . . . 0.0 110.413 -179.499 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.54 ' N ' ' HG ' ' A' ' 67' ' ' LEU . 1.8 m-85 -98.46 4.99 48.41 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.38 -0.825 . . . . 0.0 110.206 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -90.41 161.71 28.91 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 64.5 tt0 -118.12 103.36 9.8 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.238 -1.154 . . . . 0.0 110.197 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.6 t -141.07 69.13 1.34 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.298 -0.876 . . . . 0.0 110.304 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -80.35 138.71 36.73 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.293 -0.88 . . . . 0.0 110.22 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.3 tt . . . . . 0 N--CA 1.491 1.597 0 O-C-N 121.288 -0.883 . . . . 0.0 110.2 -179.985 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.259 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 5.6 ptpp? -125.02 -4.57 7.48 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.288 -1.125 . . . . 0.0 110.093 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 6.2 ttmt -62.63 -45.67 91.77 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.277 -0.89 . . . . 0.0 109.983 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.52 -37.87 79.47 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.219 -0.926 . . . . 0.0 109.906 179.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -63.34 -43.08 98.77 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.238 -0.914 . . . . 0.0 110.014 179.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . 0.425 ' O ' HG22 ' B' ' 16' ' ' VAL . . . -63.65 -37.56 87.81 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.299 -0.875 . . . . 0.0 110.088 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 87.9 t -60.63 -43.27 94.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.269 -0.894 . . . . 0.0 110.018 179.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.07 -39.07 84.77 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.298 -0.876 . . . . 0.0 110.158 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 53.0 m -65.52 -49.01 70.53 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.182 -0.949 . . . . 0.0 110.118 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.425 HG22 ' O ' ' B' ' 12' ' ' ALA . 36.9 t -63.53 -40.73 90.15 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.319 -0.863 . . . . 0.0 110.21 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.408 HG21 HD23 ' A' ' 33' ' ' LEU . 71.6 t -61.94 -47.26 94.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.224 -0.922 . . . . 0.0 110.271 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.44 -41.1 96.75 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.161 -0.962 . . . . 0.0 110.425 -179.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.78 -45.6 81.82 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.18 -0.95 . . . . 0.0 110.371 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 58.4 t -67.83 -45.91 83.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.178 -0.951 . . . . 0.0 110.39 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -56.88 -31.78 65.19 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.253 -0.904 . . . . 0.0 110.271 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . 0.464 ' O ' ' CG1' ' B' ' 25' ' ' VAL . 1.5 tt0 -56.79 -49.88 74.0 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.268 -0.895 . . . . 0.0 110.572 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.94 -34.87 73.84 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.226 -0.921 . . . . 0.0 110.545 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 2.5 tpt180 -70.34 -34.25 72.43 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.164 -0.96 . . . . 0.0 110.489 -179.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . 0.493 HG11 ' N ' ' B' ' 26' ' ' ARG . 1.8 p -63.24 -21.47 28.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.164 -0.96 . . . . 0.0 110.279 -179.703 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.493 ' N ' HG11 ' B' ' 25' ' ' VAL . 0.0 OUTLIER -117.86 38.9 3.5 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.319 -0.863 . . . . 0.0 110.479 -179.838 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -112.05 150.83 43.01 Favored Pre-proline 0 N--CA 1.491 1.585 0 O-C-N 121.198 -0.939 . . . . 0.0 110.208 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -81.52 170.6 14.33 Favored 'Trans proline' 0 C--N 1.306 -1.684 0 O-C-N 123.928 1.488 . . . . 0.0 110.361 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 O-C-N 121.32 -0.863 . . . . 0.0 110.157 -179.96 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.4 mtm . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.197 0.523 . . . . 0.0 110.271 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -94.23 143.13 26.65 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.253 -0.904 . . . . 0.0 110.172 -179.956 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -76.34 -63.93 1.22 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.316 -0.865 . . . . 0.0 110.102 179.913 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.2 p -146.29 80.35 1.56 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.216 -0.928 . . . . 0.0 110.154 179.974 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 53.21 -166.41 0.07 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.229 -0.919 . . . . 0.0 110.103 -179.936 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.517 ' CG2' ' OH ' ' A' ' 68' ' ' TYR . 2.0 m -105.03 -28.45 11.04 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.136 -0.977 . . . . 0.0 110.107 179.89 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.88 -44.99 83.71 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.237 -0.914 . . . . 0.0 109.628 179.626 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.14 -36.01 67.78 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.467 -0.771 . . . . 0.0 109.959 179.532 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -61.11 -44.17 97.76 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.296 -0.878 . . . . 0.0 110.273 -179.642 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.462 ' HB ' ' HB3' ' A' ' 64' ' ' SER . 22.8 t -58.62 -46.36 90.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.151 -0.968 . . . . 0.0 109.964 179.842 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 21.5 mt -65.18 -49.73 77.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.303 -0.873 . . . . 0.0 109.699 179.789 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.14 -40.84 91.2 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.268 -0.895 . . . . 0.0 109.177 179.274 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.46 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 68.1 m -67.02 -41.15 87.11 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.394 -0.816 . . . . 0.0 109.277 179.134 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.532 ' HB3' ' CD2' ' A' ' 60' ' ' TYR . 1.7 m-85 -68.2 -43.01 79.03 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.386 -0.821 . . . . 0.0 109.57 179.426 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.1 ttp180 -53.24 -41.19 65.2 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.217 -0.927 . . . . 0.0 109.124 179.222 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.5 mt -59.8 -44.86 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.446 -0.784 . . . . 0.0 109.504 179.151 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 13' ' ' SER . 18.4 mt -65.05 -41.68 94.94 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.287 -0.883 . . . . 0.0 109.701 179.508 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.489 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -73.29 -1.41 17.82 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.307 -0.871 . . . . 0.0 110.074 179.778 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.489 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 1.4 t 68.28 64.92 0.34 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.198 -0.939 . . . . 0.0 110.267 -179.998 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 50.26 58.2 5.75 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.397 -0.814 . . . . 0.0 110.293 179.953 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.564 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 29.8 mttt -140.7 143.01 30.64 Favored Pre-proline 0 N--CA 1.49 1.56 0 O-C-N 121.303 -0.873 . . . . 0.0 110.085 179.852 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_endo -65.62 -7.6 16.81 Favored 'Trans proline' 0 C--N 1.305 -1.722 0 O-C-N 123.931 1.49 . . . . 0.0 110.122 179.83 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.564 ' CZ ' ' HD3' ' A' ' 21' ' ' LYS . 23.3 p90 -138.99 166.4 24.59 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.214 -0.929 . . . . 0.0 110.495 -179.927 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.533 HD12 ' N ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -136.32 144.48 32.85 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.374 -0.829 . . . . 0.0 109.87 -179.967 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.533 ' N ' HD12 ' A' ' 24' ' ' ILE . 4.0 mt -79.87 150.4 30.64 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.188 -0.945 . . . . 0.0 110.075 -179.825 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.17 -45.61 76.46 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.297 -0.877 . . . . 0.0 110.327 -179.875 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.456 ' CG ' ' N ' ' A' ' 28' ' ' GLU . 22.9 pt-20 -59.27 -37.54 77.88 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.138 -0.976 . . . . 0.0 109.747 179.883 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.456 ' N ' ' CG ' ' A' ' 27' ' ' GLU . 6.2 tt0 -66.75 -34.66 78.32 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.237 -0.914 . . . . 0.0 108.876 179.076 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.466 HD13 ' HB2' ' A' ' 33' ' ' LEU . 2.6 tp -66.67 -39.92 88.37 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 108.706 -0.849 . . . . 0.0 108.706 178.803 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.23 -34.43 78.09 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.561 -0.712 . . . . 0.0 109.544 179.065 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.7 tpt180 -84.46 -39.3 19.1 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.484 -0.76 . . . . 0.0 110.876 -179.792 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.452 ' OE1' HD21 ' A' ' 17' ' ' LEU . 2.2 mt-10 -76.15 -23.5 54.79 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.217 -0.927 . . . . 0.0 110.973 -179.084 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.534 HD21 ' CB ' ' A' ' 37' ' ' GLN . 4.2 mt -127.87 156.59 75.69 Favored Pre-proline 0 N--CA 1.488 1.458 0 O-C-N 121.07 -1.019 . . . . 0.0 110.228 -179.837 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.473 ' HD2' ' CG ' ' A' ' 37' ' ' GLN . 22.9 Cg_exo -60.01 142.49 98.55 Favored 'Trans proline' 0 C--N 1.304 -1.774 0 O-C-N 124.011 1.532 . . . . 0.0 110.184 179.979 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -41.68 -38.87 4.59 Favored 'Trans proline' 0 C--N 1.304 -1.773 0 O-C-N 124.065 1.561 . . . . 0.0 110.225 179.996 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -63.12 -43.28 98.87 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.337 -0.852 . . . . 0.0 110.242 179.956 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.534 ' CB ' HD21 ' A' ' 33' ' ' LEU . 25.0 mm100 -69.21 -41.99 76.34 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.188 -0.945 . . . . 0.0 109.981 179.966 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.463 ' O ' HG12 ' A' ' 42' ' ' ILE . . . -63.67 -48.22 78.08 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.294 -0.879 . . . . 0.0 110.089 179.969 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -54.95 -48.6 72.96 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.251 -0.906 . . . . 0.0 109.926 179.932 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -64.01 -47.86 78.61 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.311 -0.868 . . . . 0.0 109.854 179.771 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.48 ' O ' ' HG2' ' A' ' 45' ' ' MET . 75.9 m -65.43 -49.57 68.69 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.341 -0.849 . . . . 0.0 110.381 179.929 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.463 HG12 ' O ' ' A' ' 38' ' ' ALA . 9.0 mm -41.54 -33.43 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.317 -0.865 . . . . 0.0 110.241 -179.893 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.44 -37.67 19.52 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.29 -0.881 . . . . 0.0 110.263 179.948 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.525 ' HG3' ' CE1' ' A' ' 63' ' ' PHE . 0.9 OUTLIER -65.79 -75.66 0.09 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.284 -0.885 . . . . 0.0 110.243 -179.878 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.537 ' CE ' ' HB3' ' A' ' 60' ' ' TYR . 6.3 ptp -53.02 108.58 1.14 Allowed Pre-proline 0 N--CA 1.488 1.462 0 O-C-N 121.22 -0.925 . . . . 0.0 110.175 179.952 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.459 ' HD3' ' O ' ' A' ' 44' ' ' ARG . 17.3 Cg_exo -68.95 -147.17 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.756 0 O-C-N 123.995 1.524 . . . . 0.0 110.326 -179.865 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -83.3 152.07 25.29 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.24 -0.912 . . . . 0.0 110.237 179.989 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.511 ' CD1' ' C ' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -68.65 173.67 4.93 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.265 -0.897 . . . . 0.0 110.353 179.997 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.7 p -169.02 44.97 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.302 -0.874 . . . . 0.0 110.216 179.946 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -105.56 166.79 14.4 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.465 -1.454 . . . . 0.0 109.465 179.936 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -86.48 127.84 2.88 Favored 'Trans proline' 0 C--N 1.304 -1.769 0 O-C-N 124.069 1.562 . . . . 0.0 110.338 179.994 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.474 ' O ' ' O ' ' A' ' 53' ' ' SER . . . 96.9 -19.45 54.71 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 179.967 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.474 ' O ' ' O ' ' A' ' 52' ' ' GLY . 6.0 m -53.63 -163.93 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.291 -1.123 . . . . 0.0 110.718 -179.666 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.491 ' O ' ' CE2' ' A' ' 48' ' ' TYR . 13.4 m -148.26 166.75 14.85 Favored Pre-proline 0 N--CA 1.493 1.675 0 O-C-N 121.368 -0.833 . . . . 0.0 110.132 179.838 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -72.7 121.72 7.62 Favored 'Trans proline' 0 C--N 1.304 -1.779 0 O-C-N 124.065 1.561 . . . . 0.0 110.335 -179.891 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 119.22 -7.73 12.57 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 179.888 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.98 157.44 18.38 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.146 -1.208 . . . . 0.0 110.334 -179.978 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 91.7 mt -127.71 160.29 32.12 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.294 -0.879 . . . . 0.0 110.024 179.94 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -111.75 111.93 23.26 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.149 -0.969 . . . . 0.0 110.517 -179.775 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.537 ' HB3' ' CE ' ' A' ' 45' ' ' MET . 14.5 p90 -81.66 -19.82 40.87 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.318 -0.864 . . . . 0.0 109.647 179.415 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.422 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.03 -36.65 68.24 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.249 -0.907 . . . . 0.0 109.793 179.883 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.458 ' HB1' ' HD2' ' A' ' 46' ' ' PRO . . . -63.94 -34.95 79.14 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.224 -0.923 . . . . 0.0 109.763 179.593 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.58 ' CE1' ' CD1' ' A' ' 67' ' ' LEU . 4.6 t80 -71.78 -32.74 67.96 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.567 -0.708 . . . . 0.0 110.114 179.628 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.462 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.9 OUTLIER -71.79 -49.29 40.02 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.348 -0.845 . . . . 0.0 110.297 -179.876 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 66.2 m -63.75 -42.34 97.86 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.251 -0.905 . . . . 0.0 110.301 -179.887 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.446 ' HA ' ' O ' ' A' ' 69' ' ' GLY . . . -70.52 -28.75 65.18 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.188 -0.945 . . . . 0.0 110.27 -179.87 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.58 ' CD1' ' CE1' ' A' ' 63' ' ' PHE . 8.4 mt -61.44 -42.41 98.71 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.205 -0.935 . . . . 0.0 110.365 -179.935 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.517 ' OH ' ' CG2' ' A' ' 6' ' ' THR . 20.1 m-85 -98.39 4.43 48.51 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.208 -0.932 . . . . 0.0 110.223 179.987 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.446 ' O ' ' HA ' ' A' ' 66' ' ' ALA . . . -151.46 134.08 4.49 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 -179.962 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.434 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 11.8 pt-20 -118.41 145.38 45.24 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.323 -1.104 . . . . 0.0 110.177 -179.993 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 71.0 p -167.36 -164.7 0.62 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.235 -0.916 . . . . 0.0 110.16 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 19.7 p-10 -104.08 116.02 31.48 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.331 -0.856 . . . . 0.0 110.175 179.964 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.3 tp . . . . . 0 N--CA 1.491 1.617 0 O-C-N 121.281 -0.887 . . . . 0.0 110.218 -179.991 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.235 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 3.1 tmtm? -103.6 -65.59 1.0 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.228 -1.16 . . . . 0.0 110.132 -179.906 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.79 -44.69 96.37 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.18 -0.95 . . . . 0.0 110.147 179.974 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.01 -38.8 68.35 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.219 -0.926 . . . . 0.0 109.949 179.871 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -65.48 -39.93 92.51 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.286 -0.884 . . . . 0.0 110.017 179.806 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.28 -37.5 85.75 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.208 -0.933 . . . . 0.0 109.991 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.441 ' O ' HG22 ' B' ' 17' ' ' VAL . 51.9 t -65.0 -40.44 89.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.208 -0.933 . . . . 0.0 109.8 179.658 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.63 -35.59 76.57 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.326 -0.858 . . . . 0.0 110.058 179.843 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 41.2 m -68.1 -43.6 78.12 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.291 -0.88 . . . . 0.0 110.238 -179.981 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.415 ' CG1' HD12 ' A' ' 33' ' ' LEU . 92.1 t -66.6 -42.48 89.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.273 -0.892 . . . . 0.0 110.134 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.527 HG21 ' CD2' ' A' ' 33' ' ' LEU . 70.1 t -63.38 -47.54 91.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.406 -0.809 . . . . 0.0 110.313 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.31 -40.76 95.36 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.307 -0.871 . . . . 0.0 110.198 -179.976 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.67 -37.97 88.0 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.286 -0.884 . . . . 0.0 110.236 179.977 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 54.5 t -67.92 -43.86 85.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.199 -0.938 . . . . 0.0 110.273 -179.902 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 38.4 t0 -62.1 -35.57 79.1 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.308 -0.87 . . . . 0.0 110.366 -179.965 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -60.05 -50.08 75.12 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.222 -0.924 . . . . 0.0 110.297 -179.978 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.76 -35.07 79.39 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.278 -0.889 . . . . 0.0 110.107 179.994 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.22 -41.53 73.48 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.247 -0.908 . . . . 0.0 110.182 179.833 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 65.8 t -78.34 -21.73 13.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 121.242 -0.911 . . . . 0.0 110.245 -179.979 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 48.87 35.73 7.07 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.406 -0.809 . . . . 0.0 110.456 179.773 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . 0.405 ' HA ' ' HD3' ' B' ' 28' ' ' PRO . 5.4 tt0 -111.95 140.84 23.85 Favored Pre-proline 0 N--CA 1.492 1.674 0 O-C-N 121.096 -1.003 . . . . 0.0 110.237 179.906 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' B' ' 27' ' ' GLU . 38.4 Cg_exo -86.43 -67.47 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.694 0 O-C-N 124.006 1.529 . . . . 0.0 110.36 179.914 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.176 -0.952 . . . . 0.0 110.276 -179.962 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 121.197 0.522 . . . . 0.0 110.233 . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -140.26 102.87 4.46 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.296 -0.877 . . . . 0.0 110.186 -179.963 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.407 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 7.5 t0 -122.74 27.88 7.56 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.261 -0.899 . . . . 0.0 110.222 179.99 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.2 p -91.41 79.69 5.56 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.242 -0.911 . . . . 0.0 110.257 -179.871 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -133.28 177.96 7.27 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.233 -0.917 . . . . 0.0 110.225 179.875 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.78 -66.53 1.04 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.224 -0.923 . . . . 0.0 110.191 -179.885 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.68 -47.78 77.17 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.186 -0.946 . . . . 0.0 109.867 179.909 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.65 -36.15 64.26 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.425 -0.797 . . . . 0.0 109.981 179.586 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.407 ' NE2' ' O ' ' A' ' 3' ' ' ASP . 0.0 OUTLIER -61.45 -44.68 96.68 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.364 -0.835 . . . . 0.0 110.37 -179.711 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.463 HG23 ' CD2' ' A' ' 67' ' ' LEU . 88.6 t -57.99 -41.38 80.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.261 -0.9 . . . . 0.0 110.012 179.996 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.468 HG22 HD12 ' A' ' 11' ' ' ILE . 59.5 mt -63.65 -49.83 80.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.359 -0.838 . . . . 0.0 109.651 179.653 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.25 -42.45 91.15 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.284 -0.885 . . . . 0.0 109.033 179.22 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.09 -39.43 94.05 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.379 -0.826 . . . . 0.0 109.302 179.033 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.623 ' CB ' ' CD1' ' A' ' 60' ' ' TYR . 3.1 m-85 -68.15 -42.17 80.51 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.308 -0.87 . . . . 0.0 109.51 179.282 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -55.85 -41.18 73.94 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.166 -0.959 . . . . 0.0 109.429 179.209 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.519 HD11 ' CB ' ' B' ' 12' ' ' ALA . 96.8 mt -60.27 -44.84 96.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.388 -0.82 . . . . 0.0 109.728 179.408 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 61.1 mt -64.98 -41.89 95.04 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.315 -0.866 . . . . 0.0 109.548 179.561 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.478 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -71.06 -15.27 62.53 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.357 -0.839 . . . . 0.0 110.089 179.625 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.478 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 68.05 72.25 0.31 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.291 -0.881 . . . . 0.0 110.339 -179.985 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.47 ' HB2' ' O ' ' A' ' 19' ' ' SER . 2.7 m-20 56.62 61.9 2.49 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.347 -0.845 . . . . 0.0 110.367 179.857 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 19' ' ' SER . 35.1 mttp -153.5 142.1 14.3 Favored Pre-proline 0 N--CA 1.489 1.49 0 O-C-N 121.274 -0.891 . . . . 0.0 110.093 179.878 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -76.59 3.9 6.02 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 O-C-N 124.092 1.575 . . . . 0.0 110.188 179.912 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.467 ' O ' ' HB2' ' A' ' 18' ' ' ALA . 20.6 p90 -145.9 156.52 43.59 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.185 -0.947 . . . . 0.0 110.026 179.999 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.468 HD11 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -125.67 142.74 41.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.169 -0.957 . . . . 0.0 109.735 179.997 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.468 ' N ' HD11 ' A' ' 24' ' ' ILE . 6.0 mp -80.14 145.81 32.15 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.132 -0.98 . . . . 0.0 109.919 -179.729 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.464 ' HA ' HD22 ' A' ' 29' ' ' LEU . . . -58.68 -44.91 90.36 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.324 -0.86 . . . . 0.0 110.366 -179.628 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.77 -34.18 77.74 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.216 -0.928 . . . . 0.0 110.369 180.0 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.449 ' N ' ' OE1' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -64.08 -51.08 65.74 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.12 -0.988 . . . . 0.0 110.288 -179.698 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.516 ' CD1' ' HA ' ' A' ' 38' ' ' ALA . 1.0 OUTLIER -67.27 -33.54 75.51 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.141 -0.974 . . . . 0.0 109.579 179.402 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.53 ' HA ' ' CB ' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -61.23 -35.0 76.04 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.524 -0.735 . . . . 0.0 110.347 -179.965 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.2 ttt180 -94.03 -17.83 22.48 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.221 -0.925 . . . . 0.0 110.262 -179.949 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -90.09 -21.62 22.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.273 -0.892 . . . . 0.0 110.246 179.972 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.467 HD21 ' HD2' ' A' ' 34' ' ' PRO . 11.2 mt -117.59 154.27 50.69 Favored Pre-proline 0 N--CA 1.487 1.395 0 O-C-N 121.261 -0.899 . . . . 0.0 110.249 -179.698 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.471 ' HD2' ' HB2' ' A' ' 37' ' ' GLN . 39.7 Cg_exo -59.24 153.87 50.17 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 O-C-N 123.875 1.461 . . . . 0.0 110.134 179.788 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -43.89 -44.1 11.95 Favored 'Trans proline' 0 C--N 1.305 -1.72 0 O-C-N 124.088 1.573 . . . . 0.0 110.542 -179.857 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.409 ' O ' ' HB2' ' A' ' 40' ' ' TYR . 0.3 OUTLIER -65.53 -46.91 77.76 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.273 -0.892 . . . . 0.0 110.393 -179.835 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.471 ' HB2' ' HD2' ' A' ' 34' ' ' PRO . 3.8 mp0 -69.69 -41.82 74.94 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.202 -0.936 . . . . 0.0 110.377 -179.935 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.53 ' CB ' ' HA ' ' A' ' 30' ' ' ARG . . . -59.21 -48.38 81.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.183 -0.948 . . . . 0.0 110.374 -179.811 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 -66.23 -43.48 86.49 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.25 -0.906 . . . . 0.0 110.37 -179.894 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.409 ' HB2' ' O ' ' A' ' 36' ' ' ASP . 1.2 t80 -62.31 -47.08 85.88 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.31 -0.869 . . . . 0.0 110.548 -179.76 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.455 ' O ' ' SD ' ' A' ' 45' ' ' MET . 71.9 m -62.43 -51.17 68.59 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.284 -0.885 . . . . 0.0 110.508 -179.668 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.46 ' CD1' ' HG3' ' A' ' 30' ' ' ARG . 53.3 mt -58.84 -19.08 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.244 -0.91 . . . . 0.0 110.332 -179.96 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 4.9 tttm -85.22 -19.98 30.84 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.323 -0.861 . . . . 0.0 110.529 -179.717 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.58 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 12.6 mmt85 -100.35 -72.82 0.66 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.176 -0.953 . . . . 0.0 110.759 -179.56 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.522 ' N ' ' HB2' ' A' ' 63' ' ' PHE . 1.4 ptm -45.25 127.47 5.85 Favored Pre-proline 0 N--CA 1.487 1.412 0 O-C-N 121.14 -0.975 . . . . 0.0 110.265 -179.698 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.46 ' HG2' ' HB3' ' A' ' 59' ' ' ASP . 9.4 Cg_endo -52.51 -170.33 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.738 0 O-C-N 124.084 1.571 . . . . 0.0 110.3 -179.94 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.504 ' O ' ' HB2' ' A' ' 48' ' ' TYR . . . -108.22 37.88 2.36 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.253 -0.904 . . . . 0.0 110.473 -179.713 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.504 ' HB2' ' O ' ' A' ' 47' ' ' ALA . 88.1 t80 179.3 174.68 0.74 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.295 -0.878 . . . . 0.0 110.175 179.771 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.471 ' HB3' ' HD2' ' A' ' 51' ' ' PRO . 0.1 OUTLIER -137.51 -56.47 0.69 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.244 -0.91 . . . . 0.0 110.333 -179.962 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . 0.506 ' N ' ' CD ' ' A' ' 51' ' ' PRO . . . 164.39 -52.59 0.28 Allowed Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.805 -1.318 . . . . 0.0 109.805 -179.997 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.506 ' CD ' ' N ' ' A' ' 50' ' ' GLY . 33.1 Cg_exo -46.96 173.28 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.732 0 O-C-N 123.947 1.498 . . . . 0.0 110.387 -179.948 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.461 ' O ' ' C ' ' A' ' 53' ' ' SER . . . -49.23 102.75 0.06 OUTLIER Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.711 -1.356 . . . . 0.0 109.711 -179.832 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.461 ' C ' ' O ' ' A' ' 52' ' ' GLY . 0.0 OUTLIER -37.83 139.5 0.31 Allowed 'General case' 0 C--N 1.308 -1.221 0 O-C-N 121.517 -0.99 . . . . 0.0 110.771 -179.754 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.435 ' O ' ' N ' ' A' ' 56' ' ' GLY . 34.5 m -128.28 161.16 58.17 Favored Pre-proline 0 C--N 1.294 -1.808 0 O-C-N 121.697 -0.627 . . . . 0.0 110.248 -179.894 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -45.18 96.68 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.74 0 O-C-N 124.05 1.553 . . . . 0.0 110.328 179.977 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.435 ' N ' ' O ' ' A' ' 54' ' ' VAL . . . 77.1 78.55 0.74 Allowed Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.611 -1.396 . . . . 0.0 109.611 179.85 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.464 ' O ' ' HA ' ' A' ' 48' ' ' TYR . . . -117.21 121.6 41.68 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.275 -1.132 . . . . 0.0 110.213 179.876 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.446 ' HA ' ' N ' ' A' ' 48' ' ' TYR . 2.5 mp -129.03 143.66 50.94 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.223 -0.923 . . . . 0.0 110.089 179.592 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.464 ' OD1' ' HB1' ' A' ' 61' ' ' ALA . 7.7 t0 -94.69 111.29 23.06 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.18 -0.95 . . . . 0.0 110.244 179.755 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.623 ' CD1' ' CB ' ' A' ' 14' ' ' PHE . 21.7 p90 -76.87 -25.29 52.92 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.189 -0.944 . . . . 0.0 108.882 179.118 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.527 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.42 -45.35 80.76 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.519 -0.738 . . . . 0.0 109.449 179.33 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.425 ' HB3' ' CD ' ' A' ' 46' ' ' PRO . . . -57.16 -36.15 70.4 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.346 -0.846 . . . . 0.0 109.643 179.549 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.58 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 1.6 t80 -71.8 -37.86 70.32 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.647 -0.658 . . . . 0.0 110.004 179.581 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.4 p -56.03 -49.73 72.89 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.313 -0.867 . . . . 0.0 110.234 -179.897 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.1 m -62.27 -37.3 84.95 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.165 -0.96 . . . . 0.0 110.064 179.892 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.89 -39.05 64.17 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.234 -0.916 . . . . 0.0 110.115 179.753 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.544 ' HG ' ' N ' ' A' ' 68' ' ' TYR . 0.1 OUTLIER -60.32 -44.86 95.08 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.247 -0.908 . . . . 0.0 109.593 179.893 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.544 ' N ' ' HG ' ' A' ' 67' ' ' LEU . 4.5 m-85 -95.5 5.12 52.37 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.569 -0.707 . . . . 0.0 110.239 179.985 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 85.19 137.35 4.01 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.641 -1.384 . . . . 0.0 109.641 179.927 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -96.27 -49.13 5.34 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.263 -1.139 . . . . 0.0 110.172 179.998 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 58.7 m -163.25 -85.04 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.199 -0.938 . . . . 0.0 110.12 179.905 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.489 ' N ' ' OD1' ' A' ' 72' ' ' ASP . 38.1 p-10 -96.57 103.15 15.04 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.246 -0.908 . . . . 0.0 110.103 179.874 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.593 ' N ' ' CD1' ' A' ' 73' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.667 0 O-C-N 121.264 -0.897 . . . . 0.0 110.447 -179.859 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.244 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 24.6 ttmt -97.48 6.35 48.29 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.298 -1.119 . . . . 0.0 110.153 -179.955 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 8.7 ttpt -62.37 -48.44 79.78 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.274 -0.891 . . . . 0.0 110.174 -179.935 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.74 -40.22 72.21 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.196 -0.94 . . . . 0.0 109.986 179.915 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.35 -41.43 98.85 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.215 -0.928 . . . . 0.0 109.974 179.855 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . 0.519 ' CB ' HD11 ' A' ' 16' ' ' ILE . . . -62.86 -42.83 99.9 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.276 -0.89 . . . . 0.0 110.057 179.909 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 79.0 t -57.53 -43.06 82.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.261 -0.899 . . . . 0.0 110.057 179.829 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.94 -37.55 85.13 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.338 -0.851 . . . . 0.0 109.97 179.849 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 11.8 m -64.61 -44.26 91.13 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.296 -0.878 . . . . 0.0 109.879 179.91 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.417 ' O ' HG22 ' B' ' 20' ' ' VAL . 73.5 t -65.71 -45.54 91.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.294 -0.879 . . . . 0.0 110.043 179.935 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 59.5 t -58.42 -45.84 89.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.255 -0.903 . . . . 0.0 110.116 179.914 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.36 -43.79 93.45 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.297 -0.877 . . . . 0.0 110.256 179.993 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.44 -45.86 82.18 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.279 -0.888 . . . . 0.0 110.2 -179.95 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . 0.417 HG22 ' O ' ' B' ' 16' ' ' VAL . 54.8 t -60.22 -41.17 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.259 -0.9 . . . . 0.0 110.056 179.826 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -64.79 -33.01 74.98 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.364 -0.835 . . . . 0.0 110.143 179.994 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.36 -49.98 75.71 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.206 -0.934 . . . . 0.0 110.027 179.881 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.42 -40.42 97.13 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.253 -0.905 . . . . 0.0 109.993 179.805 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 2.4 ttp85 -61.05 -32.6 72.23 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.37 -0.831 . . . . 0.0 110.316 -179.966 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 70.6 t -71.06 -21.12 21.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.195 -0.941 . . . . 0.0 110.44 -179.734 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.23 44.41 1.32 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.297 -0.877 . . . . 0.0 110.515 -179.666 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . 0.519 ' O ' ' N ' ' B' ' 29' ' ' ARG . 3.9 tt0 -111.18 124.23 33.27 Favored Pre-proline 0 N--CA 1.493 1.69 0 O-C-N 121.135 -0.978 . . . . 0.0 110.083 179.766 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -63.77 69.12 0.19 Allowed 'Trans proline' 0 C--N 1.307 -1.647 0 O-C-N 123.967 1.509 . . . . 0.0 110.326 -179.912 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . 0.519 ' N ' ' O ' ' B' ' 27' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.186 -0.946 . . . . 0.0 110.204 179.889 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.456 ' O ' ' HB2' ' A' ' 2' ' ' ALA . 2.7 mtt . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.21 0.529 . . . . 0.0 110.219 . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.463 ' O ' ' O ' ' A' ' 3' ' ' ASP . . . 56.84 -105.63 0.28 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.273 -0.892 . . . . 0.0 110.261 -179.982 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.463 ' O ' ' O ' ' A' ' 2' ' ' ALA . 15.8 t0 59.2 122.02 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.945 -1.097 . . . . 0.0 110.362 179.929 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 9.9 t -143.24 143.46 31.75 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.166 -0.959 . . . . 0.0 110.22 179.946 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.505 ' O ' ' N ' ' A' ' 7' ' ' ALA . 4.5 t0 -169.44 48.36 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.156 -0.965 . . . . 0.0 110.173 -179.955 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.558 HG21 ' CZ ' ' A' ' 68' ' ' TYR . 7.4 m 63.19 -71.57 0.05 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.328 -0.857 . . . . 0.0 110.248 -179.939 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.505 ' N ' ' O ' ' A' ' 5' ' ' ASP . . . -68.41 -36.2 78.75 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.158 -0.964 . . . . 0.0 109.561 179.702 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.69 -36.49 73.32 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.401 -0.812 . . . . 0.0 109.812 179.474 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.57 -42.62 99.11 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.33 -0.856 . . . . 0.0 110.081 179.9 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.464 HG11 ' CD2' ' A' ' 14' ' ' PHE . 96.0 t -60.61 -46.44 95.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.224 -0.922 . . . . 0.0 109.829 179.643 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 56.8 mt -54.73 -45.78 73.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.328 -0.858 . . . . 0.0 109.393 179.471 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.72 -41.07 81.03 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.22 -0.925 . . . . 0.0 108.635 178.859 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.4 m -68.21 -37.95 81.42 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 178.718 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.561 ' HB3' ' CD1' ' A' ' 60' ' ' TYR . 1.9 m-85 -68.39 -41.95 79.77 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.452 -0.78 . . . . 0.0 109.387 179.033 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -54.15 -46.42 72.27 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.407 -0.808 . . . . 0.0 109.393 179.355 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 53.2 mt -58.13 -43.69 85.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.389 -0.819 . . . . 0.0 109.501 179.336 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.444 HD12 HG21 ' B' ' 13' ' ' VAL . 2.5 mp -65.0 -40.13 94.49 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.397 -0.814 . . . . 0.0 109.748 179.485 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.476 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -77.19 -1.35 29.02 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.374 -0.829 . . . . 0.0 110.246 179.739 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.3 OUTLIER 68.71 63.87 0.32 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.226 -0.922 . . . . 0.0 110.308 179.965 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 51.68 59.02 4.87 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.19 -0.944 . . . . 0.0 110.141 179.937 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.457 ' HG3' ' O ' ' A' ' 19' ' ' SER . 9.0 mttt -145.46 142.92 18.75 Favored Pre-proline 0 N--CA 1.49 1.525 0 O-C-N 121.248 -0.908 . . . . 0.0 110.071 179.985 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -69.63 -4.84 14.76 Favored 'Trans proline' 0 C--N 1.305 -1.723 0 O-C-N 123.973 1.512 . . . . 0.0 109.907 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.434 ' C ' ' CD1' ' A' ' 23' ' ' TYR . 19.6 p90 -144.77 161.9 38.09 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.349 -0.844 . . . . 0.0 109.884 179.866 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.424 HD12 HG22 ' A' ' 24' ' ' ILE . 11.3 tt -139.32 153.14 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.137 -0.977 . . . . 0.0 110.311 -179.823 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.2 mp -89.24 156.24 18.89 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.309 -0.87 . . . . 0.0 109.964 179.798 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.38 -42.23 92.92 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.172 -0.955 . . . . 0.0 110.256 -179.825 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -56.45 -40.48 74.87 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.28 -0.887 . . . . 0.0 110.152 179.931 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.474 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 1.9 mt-10 -68.32 -41.12 81.31 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.212 -0.93 . . . . 0.0 108.771 179.215 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.473 ' O ' ' HB2' ' A' ' 33' ' ' LEU . 3.3 tp -66.83 -38.84 87.19 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 179.012 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.5 ttm180 -66.96 -34.58 78.08 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.559 -0.713 . . . . 0.0 110.587 -179.923 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.08 -20.26 22.24 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.21 -0.931 . . . . 0.0 111.04 -179.391 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.474 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 86.2 mt-10 -94.87 -19.26 20.44 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.012 -1.055 . . . . 0.0 110.814 -179.447 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.53 HD21 ' CB ' ' A' ' 37' ' ' GLN . 5.7 mt -120.92 162.06 37.03 Favored Pre-proline 0 N--CA 1.489 1.498 0 O-C-N 121.079 -1.013 . . . . 0.0 110.303 -179.857 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.458 ' HD2' HD21 ' A' ' 33' ' ' LEU . 32.5 Cg_exo -67.76 148.43 77.27 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 124.032 1.543 . . . . 0.0 110.246 179.914 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.402 ' C ' ' O ' ' A' ' 34' ' ' PRO . 16.6 Cg_exo -41.78 -40.59 5.73 Favored 'Trans proline' 0 C--N 1.303 -1.864 0 O-C-N 124.116 1.588 . . . . 0.0 110.496 -179.823 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -63.58 -47.25 82.27 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.223 -0.923 . . . . 0.0 110.37 -179.705 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.53 ' CB ' HD21 ' A' ' 33' ' ' LEU . 14.5 mp0 -69.58 -40.85 76.47 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.192 -0.943 . . . . 0.0 110.267 179.957 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.424 ' O ' ' CD1' ' A' ' 42' ' ' ILE . . . -58.88 -47.84 83.51 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.303 -0.873 . . . . 0.0 110.299 -179.921 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 48.7 tp60 -61.63 -48.83 79.12 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.309 -0.869 . . . . 0.0 110.378 -179.906 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.19 -42.22 89.15 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.235 -0.916 . . . . 0.0 110.228 179.991 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.459 ' HB3' HD23 ' A' ' 29' ' ' LEU . 13.7 m -63.65 -48.24 78.03 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.305 -0.872 . . . . 0.0 110.15 179.885 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.445 HG13 ' CD2' ' A' ' 29' ' ' LEU . 1.2 mt -61.23 -21.24 24.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.274 -0.891 . . . . 0.0 110.071 -179.993 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -81.56 -39.79 24.08 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.15 -0.969 . . . . 0.0 110.144 179.794 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.576 ' HB2' ' CD2' ' A' ' 63' ' ' PHE . 40.4 mmt-85 -77.11 -66.09 0.87 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.273 -0.892 . . . . 0.0 109.97 179.805 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.549 ' HE2' ' CB ' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -29.91 114.92 0.31 Allowed Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.9 -0.5 . . . . 0.0 111.471 179.648 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.524 ' CD ' ' HB1' ' A' ' 62' ' ' ALA . 18.5 Cg_endo -94.18 -158.65 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.743 0 O-C-N 124.003 1.528 . . . . 0.0 109.932 179.649 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.81 124.63 32.52 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.197 -0.94 . . . . 0.0 110.189 179.863 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -68.48 132.71 47.45 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.34 -0.85 . . . . 0.0 110.224 -179.848 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.471 ' HB3' ' O ' ' A' ' 52' ' ' GLY . 0.6 OUTLIER 59.2 157.88 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.368 -0.833 . . . . 0.0 110.482 179.972 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -84.05 -73.49 1.26 Allowed Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -99.19 27.08 0.16 Allowed 'Trans proline' 0 C--N 1.305 -1.73 0 O-C-N 124.037 1.546 . . . . 0.0 110.199 -179.96 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.686 ' O ' ' CB ' ' A' ' 53' ' ' SER . . . -140.26 147.26 18.96 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -179.993 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.686 ' CB ' ' O ' ' A' ' 52' ' ' GLY . 30.1 t 130.91 -166.56 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.385 0 C-N-CA 124.003 0.921 . . . . 0.0 109.518 179.832 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.446 ' N ' ' OG ' ' A' ' 53' ' ' SER . 13.4 m -135.19 156.07 78.41 Favored Pre-proline 0 N--CA 1.491 1.596 0 O-C-N 121.295 -0.878 . . . . 0.0 110.198 179.87 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -60.46 100.54 0.15 Allowed 'Trans proline' 0 C--N 1.306 -1.705 0 O-C-N 123.94 1.495 . . . . 0.0 110.281 -179.986 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 123.61 8.98 6.06 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.714 -1.354 . . . . 0.0 109.714 179.903 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.415 ' HB3' HG21 ' A' ' 54' ' ' VAL . . . -104.64 119.18 38.4 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.204 -1.174 . . . . 0.0 110.143 -179.969 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.582 ' CD2' ' N ' ' A' ' 58' ' ' LEU . 3.1 mm? -113.66 160.49 18.55 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.361 -0.837 . . . . 0.0 110.021 179.962 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.505 ' OD1' ' CB ' ' A' ' 61' ' ' ALA . 6.9 t70 -109.38 110.23 21.31 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.993 -1.067 . . . . 0.0 111.008 -179.915 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.561 ' CD1' ' HB3' ' A' ' 14' ' ' PHE . 26.4 p90 -73.1 -23.61 60.53 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 178.192 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.519 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.29 -40.68 74.67 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.702 -0.624 . . . . 0.0 109.71 179.667 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.524 ' HB1' ' CD ' ' A' ' 46' ' ' PRO . . . -56.4 -32.17 64.57 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.241 -0.912 . . . . 0.0 109.619 179.532 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.576 ' CD2' ' HB2' ' A' ' 44' ' ' ARG . 1.7 t80 -65.78 -47.6 74.63 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.6 -0.688 . . . . 0.0 110.559 179.976 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.0 t -55.81 -47.53 77.0 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.168 -0.958 . . . . 0.0 110.759 -179.288 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.32 -39.19 92.13 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.14 -0.975 . . . . 0.0 110.521 -179.721 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.26 -30.53 57.89 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.149 -0.969 . . . . 0.0 110.556 -179.656 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.461 ' HB3' ' O ' ' A' ' 63' ' ' PHE . 0.6 OUTLIER -78.59 -45.2 22.24 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.119 -0.988 . . . . 0.0 109.603 -179.955 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.558 ' CZ ' HG21 ' A' ' 6' ' ' THR . 17.1 m-85 -96.37 9.7 40.41 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.535 -0.728 . . . . 0.0 110.316 179.961 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -94.48 -147.65 22.72 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.916 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.403 ' O ' ' O ' ' A' ' 71' ' ' SER . 10.5 pt-20 -129.33 -168.47 1.94 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.26 -1.141 . . . . 0.0 110.155 -179.951 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.403 ' O ' ' O ' ' A' ' 70' ' ' GLU . 0.2 OUTLIER 61.03 149.65 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.239 -0.913 . . . . 0.0 110.264 179.986 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -104.55 125.02 50.31 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.231 -0.918 . . . . 0.0 110.262 179.946 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 51.0 mt . . . . . 0 N--CA 1.492 1.629 0 O-C-N 121.278 -0.889 . . . . 0.0 110.188 -179.931 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' B' B ' 7' ' ' GLY . . . . . 0.5 ' O ' ' N ' ' B' ' 9' ' ' LYS . . . . . . . . 0 N--CA 1.49 2.285 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.468 ' CB ' ' O ' ' B' ' 7' ' ' GLY . 0.7 OUTLIER 66.85 -59.68 0.37 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.208 -1.172 . . . . 0.0 110.161 -179.92 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.5 ' N ' ' O ' ' B' ' 7' ' ' GLY . 2.4 ttmt -57.84 -50.04 74.62 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.2 -0.938 . . . . 0.0 109.926 179.863 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.0 -38.36 67.79 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.184 -0.948 . . . . 0.0 109.706 179.66 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -67.79 -41.03 83.82 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.407 -0.808 . . . . 0.0 109.874 179.684 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.53 -37.67 88.36 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.315 -0.865 . . . . 0.0 109.902 179.718 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.444 HG21 HD12 ' A' ' 17' ' ' LEU . 46.5 t -61.1 -41.51 89.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.266 -0.896 . . . . 0.0 109.998 179.732 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.95 -42.94 99.97 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.264 -0.897 . . . . 0.0 110.022 179.778 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 90.6 m -61.29 -43.2 99.26 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.22 -0.925 . . . . 0.0 110.159 179.88 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 98.2 t -64.81 -41.27 91.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.177 -0.952 . . . . 0.0 110.053 179.86 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.432 HG11 ' NE2' ' A' ' 37' ' ' GLN . 86.5 t -59.87 -46.31 93.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.295 -0.878 . . . . 0.0 110.271 -179.964 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.17 -39.63 94.41 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.247 -0.908 . . . . 0.0 110.27 -179.948 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.42 -41.49 96.58 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.257 -0.902 . . . . 0.0 110.399 -179.855 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 61.4 t -67.01 -41.67 87.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.225 -0.922 . . . . 0.0 110.367 -179.807 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.86 -40.14 91.8 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.269 -0.894 . . . . 0.0 110.303 -179.964 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.21 -49.03 72.99 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.251 -0.905 . . . . 0.0 110.287 -179.977 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.02 -37.44 87.18 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.277 -0.889 . . . . 0.0 110.233 179.997 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 9.9 ttp180 -68.42 -45.16 73.32 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.271 -0.893 . . . . 0.0 110.05 179.925 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . 0.452 HG13 ' OE1' ' B' ' 27' ' ' GLU . 20.3 t -73.16 -20.83 18.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.223 -0.923 . . . . 0.0 110.239 179.996 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.4 ' C ' ' O ' ' B' ' 25' ' ' VAL . 1.5 mtt180 43.84 48.05 6.91 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.277 -0.889 . . . . 0.0 110.375 179.662 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . 0.494 ' O ' ' CG ' ' B' ' 27' ' ' GLU . 4.9 pt-20 -100.55 121.33 53.42 Favored Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.157 -0.964 . . . . 0.0 110.241 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -65.2 80.28 0.21 Allowed 'Trans proline' 0 C--N 1.305 -1.755 0 O-C-N 123.986 1.519 . . . . 0.0 110.071 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 14.9 mtt85 . . . . . 0 N--CA 1.49 1.574 0 O-C-N 121.159 -0.963 . . . . 0.0 110.232 -179.828 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 ttt . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 121.193 0.52 . . . . 0.0 110.292 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 53.49 -179.51 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.213 -0.929 . . . . 0.0 110.277 179.999 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.528 ' O ' ' CG2' ' A' ' 4' ' ' THR . 33.4 t70 -68.74 -65.15 0.74 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.245 -0.909 . . . . 0.0 110.066 179.924 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.528 ' CG2' ' O ' ' A' ' 3' ' ' ASP . 14.7 t 37.97 -152.83 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.627 -0.671 . . . . 0.0 110.602 179.886 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -97.96 112.22 24.24 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.241 -0.912 . . . . 0.0 110.294 -179.981 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -87.62 -39.69 14.84 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.182 -0.949 . . . . 0.0 110.134 179.878 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -66.16 -46.82 76.09 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.262 -0.899 . . . . 0.0 109.725 179.826 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -54.52 -36.78 64.6 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.358 -0.839 . . . . 0.0 109.82 179.633 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.445 ' OE1' HG22 ' B' ' 15' ' ' THR . 0.4 OUTLIER -62.02 -48.39 80.49 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.29 -0.881 . . . . 0.0 109.91 179.92 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.439 ' O ' ' OG ' ' A' ' 13' ' ' SER . 77.7 t -58.92 -43.25 88.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.251 -0.906 . . . . 0.0 109.773 179.657 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 45.0 mt -62.0 -47.07 94.92 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.305 -0.872 . . . . 0.0 109.545 179.433 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.56 -42.13 82.41 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.324 -0.86 . . . . 0.0 108.944 179.175 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.458 ' O ' HD11 ' A' ' 17' ' ' LEU . 0.8 OUTLIER -68.43 -40.39 81.19 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.416 -0.802 . . . . 0.0 109.277 179.004 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.553 ' CB ' ' CD1' ' A' ' 60' ' ' TYR . 1.7 m-85 -65.26 -42.94 92.73 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.242 -0.911 . . . . 0.0 109.587 179.396 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 35.8 ttm-85 -55.96 -47.08 78.27 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.302 -0.873 . . . . 0.0 109.579 179.388 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.464 HG22 HD11 ' A' ' 16' ' ' ILE . 30.1 mt -60.73 -41.14 87.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.398 -0.814 . . . . 0.0 109.649 179.403 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.479 ' CD2' ' OE2' ' A' ' 32' ' ' GLU . 5.5 mp -64.86 -40.5 95.24 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.419 -0.8 . . . . 0.0 109.781 179.602 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.461 ' HA ' ' OE2' ' A' ' 28' ' ' GLU . . . -73.65 -4.89 37.04 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.405 -0.809 . . . . 0.0 110.103 179.842 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.458 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.1 OUTLIER 67.46 59.42 0.5 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.298 -0.876 . . . . 0.0 110.158 -179.948 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.423 ' CB ' ' O ' ' A' ' 19' ' ' SER . 0.2 OUTLIER 63.96 64.66 0.74 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.276 -0.89 . . . . 0.0 110.295 179.939 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.43 ' HB2' ' HB2' ' A' ' 18' ' ' ALA . 73.4 mttt -153.02 143.6 15.67 Favored Pre-proline 0 N--CA 1.489 1.491 0 O-C-N 121.212 -0.93 . . . . 0.0 110.093 -179.979 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -75.69 2.0 7.44 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 O-C-N 123.957 1.504 . . . . 0.0 110.011 179.539 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.549 ' N ' ' CD1' ' A' ' 23' ' ' TYR . 14.7 p90 -142.48 169.7 17.09 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.326 -0.858 . . . . 0.0 109.952 179.949 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.486 HG21 HD11 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -137.27 141.63 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.104 -0.998 . . . . 0.0 110.165 -179.897 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.441 ' O ' HD11 ' A' ' 24' ' ' ILE . 1.4 mp -81.54 153.6 26.69 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.21 -0.931 . . . . 0.0 110.127 -179.925 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.482 ' HA ' HD22 ' A' ' 29' ' ' LEU . . . -68.27 -38.53 81.82 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.366 -0.834 . . . . 0.0 110.403 -179.775 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -69.25 -34.2 74.43 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.252 -0.905 . . . . 0.0 109.937 179.852 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.461 ' OE2' ' HA ' ' A' ' 18' ' ' ALA . 14.5 tt0 -65.5 -50.97 63.29 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.23 -0.919 . . . . 0.0 109.951 -179.98 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.524 ' HA ' ' CG ' ' A' ' 32' ' ' GLU . 1.2 pp -67.3 -33.74 75.91 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.187 -0.945 . . . . 0.0 109.716 179.378 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.534 ' HA ' ' CB ' ' A' ' 38' ' ' ALA . 10.3 mtt-85 -63.73 -34.1 77.13 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.427 -0.796 . . . . 0.0 110.381 179.974 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.14 -16.33 29.78 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.205 -0.934 . . . . 0.0 111.255 -179.174 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.524 ' CG ' ' HA ' ' A' ' 29' ' ' LEU . 0.8 OUTLIER -99.51 -23.77 14.99 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.807 -1.183 . . . . 0.0 110.726 -179.667 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.538 HD21 ' CB ' ' A' ' 37' ' ' GLN . 4.3 mt -108.89 139.86 21.31 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.229 -0.919 . . . . 0.0 110.44 -179.994 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.459 ' HD2' HD21 ' A' ' 33' ' ' LEU . 37.5 Cg_exo -44.36 139.47 6.61 Favored 'Trans proline' 0 C--N 1.306 -1.693 0 O-C-N 123.962 1.506 . . . . 0.0 109.87 179.676 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.438 ' C ' ' O ' ' A' ' 34' ' ' PRO . 24.9 Cg_exo -39.92 -39.01 2.13 Favored 'Trans proline' 0 C--N 1.306 -1.693 0 O-C-N 124.027 1.541 . . . . 0.0 110.574 -179.563 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.16 -45.98 79.03 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.244 -0.91 . . . . 0.0 110.805 -179.891 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.538 ' CB ' HD21 ' A' ' 33' ' ' LEU . 98.3 mm-40 -69.64 -44.34 70.8 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.032 -1.043 . . . . 0.0 110.413 -179.664 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.534 ' CB ' ' HA ' ' A' ' 30' ' ' ARG . . . -58.16 -49.24 77.71 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.315 -0.866 . . . . 0.0 110.56 -179.553 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -58.97 -40.85 86.0 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.152 -0.967 . . . . 0.0 110.412 -179.887 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.29 -47.97 71.91 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.254 -0.904 . . . . 0.0 110.356 -179.88 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.573 ' HA ' ' CE1' ' A' ' 63' ' ' PHE . 48.1 m -63.02 -48.33 79.23 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.236 -0.915 . . . . 0.0 110.371 -179.863 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.522 ' CD1' HD23 ' A' ' 29' ' ' LEU . 12.4 mm -47.1 -19.3 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.303 -0.873 . . . . 0.0 111.225 -179.854 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.28 -24.12 30.04 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.969 -1.082 . . . . 0.0 111.527 -179.072 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.632 ' CD ' ' CE1' ' A' ' 63' ' ' PHE . 36.7 mtt180 -95.79 -69.91 0.73 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 120.862 -1.149 . . . . 0.0 110.862 -179.419 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.567 ' C ' ' O ' ' A' ' 44' ' ' ARG . 2.1 mtp -14.99 84.13 0.03 OUTLIER Pre-proline 0 N--CA 1.507 2.399 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -179.477 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.516 ' HG2' ' CB ' ' A' ' 62' ' ' ALA . 35.4 Cg_exo -57.22 168.29 2.82 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 O-C-N 124.053 1.554 . . . . 0.0 110.28 -179.923 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.436 ' O ' ' C ' ' A' ' 48' ' ' TYR . . . -56.79 120.47 7.92 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.197 -0.939 . . . . 0.0 110.113 179.974 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.548 ' CG ' ' N ' ' A' ' 49' ' ' SER . 16.9 p90 -41.67 -40.16 1.87 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.367 -0.833 . . . . 0.0 110.452 -179.931 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.548 ' N ' ' CG ' ' A' ' 48' ' ' TYR . 0.3 OUTLIER 170.94 -170.15 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.221 -0.924 . . . . 0.0 110.111 -179.907 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -106.97 -54.4 0.67 Allowed Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.347 -1.501 . . . . 0.0 109.347 179.891 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -114.19 45.87 0.01 OUTLIER 'Trans proline' 0 C--N 1.307 -1.652 0 O-C-N 123.934 1.491 . . . . 0.0 110.301 179.768 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.49 ' O ' ' O ' ' A' ' 53' ' ' SER . . . -120.7 -108.37 2.14 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -179.857 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.503 ' HB3' ' CD2' ' A' ' 48' ' ' TYR . 0.7 OUTLIER -55.99 -153.33 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.314 0 O-C-N 121.388 -1.066 . . . . 0.0 110.805 -179.577 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 18.9 m -106.06 150.36 39.21 Favored Pre-proline 0 N--CA 1.49 1.526 0 O-C-N 121.196 -0.94 . . . . 0.0 110.182 179.917 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -49.86 112.03 0.63 Allowed 'Trans proline' 0 C--N 1.305 -1.755 0 O-C-N 124.037 1.546 . . . . 0.0 110.325 -179.991 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 129.44 -26.75 4.31 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 179.895 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.73 144.58 56.25 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.2 -1.176 . . . . 0.0 110.274 -179.996 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 79.1 mt -121.06 157.44 30.04 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.195 -0.941 . . . . 0.0 109.962 179.813 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.425 ' CG ' ' HA ' ' A' ' 48' ' ' TYR . 1.2 m-20 -104.54 112.07 25.0 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.209 -0.932 . . . . 0.0 110.527 -179.911 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.553 ' CD1' ' CB ' ' A' ' 14' ' ' PHE . 23.2 p90 -81.19 -19.43 43.33 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.298 -0.876 . . . . 0.0 109.353 179.483 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.427 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.86 -40.83 73.46 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.326 -0.859 . . . . 0.0 109.264 179.575 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.516 ' CB ' ' HG2' ' A' ' 46' ' ' PRO . . . -58.36 -32.31 68.45 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.328 -0.858 . . . . 0.0 108.981 179.083 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.632 ' CE1' ' CD ' ' A' ' 44' ' ' ARG . 6.1 t80 -58.65 -45.45 89.3 Favored 'General case' 0 C--N 1.3 -1.558 0 CA-C-O 121.278 0.561 . . . . 0.0 110.219 179.607 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 81.2 p -72.44 -45.02 61.5 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.191 -0.943 . . . . 0.0 110.554 -179.78 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 47.2 t -68.42 -41.04 80.97 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.255 -0.903 . . . . 0.0 110.576 -179.642 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.25 -35.44 71.42 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.209 -0.932 . . . . 0.0 110.594 -179.683 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.593 ' CD1' ' CD2' ' A' ' 63' ' ' PHE . 11.2 mt -74.94 -41.14 60.21 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.172 -0.955 . . . . 0.0 110.556 -179.705 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -97.39 7.39 46.63 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.154 -0.966 . . . . 0.0 110.307 -179.783 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -74.19 -23.88 74.83 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 179.905 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -59.66 -33.34 71.41 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.303 -1.116 . . . . 0.0 110.227 -179.994 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.4 m -108.86 125.92 52.51 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.217 -0.927 . . . . 0.0 110.108 179.978 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -80.62 125.02 29.48 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.255 -0.903 . . . . 0.0 110.162 -179.982 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.622 0 O-C-N 121.306 -0.871 . . . . 0.0 110.144 179.973 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 7' ' ' GLY . . . . . 0.522 ' O ' ' N ' ' B' ' 9' ' ' LYS . . . . . . . . 0 N--CA 1.49 2.291 0 N-CA-C 109.589 -1.405 . . . . 0.0 109.589 . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.05 -74.39 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.267 -1.137 . . . . 0.0 110.279 179.938 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.522 ' N ' ' O ' ' B' ' 7' ' ' GLY . 0.0 OUTLIER -60.36 -44.05 95.95 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.302 -0.873 . . . . 0.0 110.241 -179.997 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.16 -35.95 74.42 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.195 -0.94 . . . . 0.0 110.067 179.993 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -65.42 -40.62 93.56 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.268 -0.895 . . . . 0.0 109.91 179.855 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.17 -44.32 92.42 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.292 -0.88 . . . . 0.0 110.234 179.96 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.451 HG22 ' O ' ' B' ' 9' ' ' LYS . 47.5 t -62.25 -46.25 96.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.229 -0.919 . . . . 0.0 110.042 -179.914 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.49 -35.42 72.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.281 -0.887 . . . . 0.0 110.038 179.905 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 15' ' ' THR . . . . . 0.445 HG22 ' OE1' ' A' ' 9' ' ' GLN . 8.8 m -66.2 -42.87 88.22 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.267 -0.895 . . . . 0.0 109.97 179.737 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 53.3 t -67.16 -43.3 88.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.21 -0.931 . . . . 0.0 110.103 179.907 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 59.2 t -61.4 -44.92 99.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.354 -0.841 . . . . 0.0 110.315 -179.905 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.14 -43.54 94.92 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.222 -0.924 . . . . 0.0 110.213 179.865 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.37 -40.59 96.14 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.28 -0.887 . . . . 0.0 110.213 -179.898 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 65.6 t -67.49 -42.52 87.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.153 -0.967 . . . . 0.0 110.101 179.993 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -63.17 -40.13 96.65 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.274 -0.891 . . . . 0.0 110.132 179.919 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -54.21 -49.96 68.2 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.288 -0.883 . . . . 0.0 109.846 179.908 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -58.27 -42.41 86.47 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.192 -0.942 . . . . 0.0 109.795 179.632 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 5.0 ttp180 -60.54 -47.81 84.53 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.303 -0.873 . . . . 0.0 109.99 179.837 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 57.7 t -57.52 -20.91 14.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.248 -0.907 . . . . 0.0 110.022 179.822 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 55.99 38.06 29.54 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.524 -0.735 . . . . 0.0 110.332 179.944 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . 0.408 ' HA ' ' HD3' ' B' ' 28' ' ' PRO . 0.5 OUTLIER -92.19 136.64 25.55 Favored Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.287 -0.883 . . . . 0.0 110.279 -179.969 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' B' ' 27' ' ' GLU . 23.8 Cg_exo -87.49 63.63 3.92 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 O-C-N 124.039 1.547 . . . . 0.0 110.702 -179.874 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.708 0 O-C-N 121.08 -1.012 . . . . 0.0 110.239 179.722 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 mpt? . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.347 0.594 . . . . 0.0 110.264 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -83.33 -43.0 16.45 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.201 -0.937 . . . . 0.0 110.243 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -164.35 119.92 1.52 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.349 -0.845 . . . . 0.0 110.119 179.9 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.1 p -105.56 150.12 25.65 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.238 -0.914 . . . . 0.0 110.375 -179.953 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.0 p30 -166.98 172.66 10.0 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.264 -0.897 . . . . 0.0 110.093 -179.989 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.1 m -111.32 -32.05 6.86 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.197 -0.939 . . . . 0.0 110.271 -179.936 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.598 ' HA ' ' CZ ' ' A' ' 68' ' ' TYR . . . -65.22 -46.55 80.17 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.193 -0.942 . . . . 0.0 109.948 179.925 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.78 -36.54 69.98 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.28 -0.888 . . . . 0.0 109.831 179.485 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.57 -43.36 99.01 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.341 -0.849 . . . . 0.0 110.181 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.526 ' CG2' ' OH ' ' A' ' 68' ' ' TYR . 65.6 t -59.07 -44.87 92.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.09 -1.006 . . . . 0.0 109.777 179.732 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 44.4 mt -57.1 -49.72 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.404 -0.81 . . . . 0.0 109.465 179.574 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.78 -39.24 84.23 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.309 -0.869 . . . . 0.0 108.829 178.901 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.463 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 70.8 m -65.41 -40.54 93.52 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.465 -0.772 . . . . 0.0 109.099 178.898 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -66.82 -43.88 82.65 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.343 -0.848 . . . . 0.0 109.366 179.102 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -53.35 -41.21 65.58 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.353 -0.842 . . . . 0.0 109.153 179.049 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.412 ' CD1' ' HB2' ' B' ' 12' ' ' ALA . 49.3 mt -59.18 -45.09 93.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.426 -0.796 . . . . 0.0 109.687 179.326 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 13' ' ' SER . 15.4 mt -65.09 -41.83 94.63 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.185 -0.947 . . . . 0.0 109.41 179.386 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.486 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -71.12 -7.27 45.44 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.527 -0.733 . . . . 0.0 110.123 179.826 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.486 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 1.5 t 68.38 64.3 0.34 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.24 -0.912 . . . . 0.0 110.199 -179.971 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 58.2 66.35 1.12 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.257 -0.902 . . . . 0.0 110.312 179.969 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.415 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 64.5 mttt -153.15 143.22 15.31 Favored Pre-proline 0 N--CA 1.49 1.537 0 O-C-N 121.248 -0.908 . . . . 0.0 110.023 179.992 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -75.28 2.17 7.06 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 O-C-N 123.983 1.517 . . . . 0.0 110.156 179.703 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.469 ' O ' ' HB2' ' A' ' 18' ' ' ALA . 23.7 p90 -141.66 160.65 39.72 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.202 -0.936 . . . . 0.0 110.075 179.951 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.524 HD11 HG22 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -130.31 140.79 47.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.228 -0.92 . . . . 0.0 109.937 179.916 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.403 ' N ' ' CD1' ' A' ' 24' ' ' ILE . 1.1 mt -81.85 148.32 28.89 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.223 -0.923 . . . . 0.0 110.45 -179.733 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.77 -44.84 95.14 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.373 -0.829 . . . . 0.0 109.953 179.818 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -56.52 -36.28 69.02 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.276 -0.89 . . . . 0.0 109.869 179.744 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.517 ' O ' ' N ' ' A' ' 32' ' ' GLU . 0.6 OUTLIER -62.73 -42.22 99.56 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.416 -0.803 . . . . 0.0 109.681 179.742 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.418 HD11 HG13 ' A' ' 42' ' ' ILE . 17.5 mt -58.32 -34.2 70.33 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.272 -0.892 . . . . 0.0 109.532 179.634 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 9.6 mtm-85 -66.92 -38.68 86.65 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.343 -0.848 . . . . 0.0 109.828 179.597 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.76 -12.16 24.06 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.297 -0.877 . . . . 0.0 110.665 -179.754 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.517 ' N ' ' O ' ' A' ' 28' ' ' GLU . 11.3 mm-40 -96.76 -23.55 16.36 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.095 -1.003 . . . . 0.0 110.451 -179.819 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.532 ' CD2' ' CG2' ' B' ' 17' ' ' VAL . 1.4 mt -136.75 157.03 75.72 Favored Pre-proline 0 C--N 1.306 -1.317 0 O-C-N 121.166 -0.959 . . . . 0.0 110.102 -179.769 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.468 ' HD2' HD21 ' A' ' 33' ' ' LEU . 32.7 Cg_exo -46.25 171.21 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.735 0 O-C-N 123.861 1.453 . . . . 0.0 110.075 179.777 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_endo -64.77 -41.92 16.96 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 O-C-N 123.921 1.485 . . . . 0.0 110.305 -179.89 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.95 -40.89 91.73 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.34 -0.85 . . . . 0.0 110.548 -179.795 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.523 ' CB ' HD21 ' A' ' 33' ' ' LEU . 12.9 mp0 -69.33 -37.94 77.95 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.142 -0.974 . . . . 0.0 110.394 -179.739 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.79 -45.96 90.69 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.264 -0.898 . . . . 0.0 110.33 -179.94 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.465 ' O ' ' HB2' ' A' ' 43' ' ' LYS . 14.1 tt0 -66.1 -43.76 86.32 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.142 -0.974 . . . . 0.0 110.51 -179.873 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.8 -42.2 95.2 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.26 -0.9 . . . . 0.0 110.401 -179.766 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 31.1 m -63.09 -46.89 85.28 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.298 -0.876 . . . . 0.0 110.578 -179.666 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.418 HG13 HD11 ' A' ' 29' ' ' LEU . 74.5 mt -72.98 -13.72 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.126 -0.984 . . . . 0.0 110.519 -179.644 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 39' ' ' GLN . 0.1 OUTLIER -76.29 -21.19 56.56 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.163 -0.961 . . . . 0.0 110.461 -179.707 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.58 ' HB3' ' CG ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -113.0 -48.99 2.95 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.123 -0.986 . . . . 0.0 110.344 -180.0 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.519 ' SD ' ' CG2' ' A' ' 24' ' ' ILE . 2.0 ttm -34.62 96.77 0.11 Allowed Pre-proline 0 N--CA 1.494 1.764 0 O-C-N 121.695 -0.628 . . . . 0.0 111.071 -179.975 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.478 ' O ' HD11 ' A' ' 58' ' ' LEU . 27.1 Cg_exo -59.08 -153.79 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.716 0 O-C-N 123.995 1.524 . . . . 0.0 110.026 179.765 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.43 ' O ' ' C ' ' A' ' 48' ' ' TYR . . . -98.32 127.43 44.26 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.27 -0.894 . . . . 0.0 110.371 -179.972 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.657 ' CD2' ' CB ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -42.07 145.82 0.33 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.268 -0.895 . . . . 0.0 110.149 179.879 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 94.3 p -115.52 9.02 15.32 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.154 -0.967 . . . . 0.0 110.43 -179.75 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -99.41 139.31 14.37 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 179.939 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -79.09 154.76 25.6 Favored 'Trans proline' 0 C--N 1.306 -1.681 0 O-C-N 123.899 1.473 . . . . 0.0 110.222 179.904 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.488 ' O ' ' O ' ' A' ' 53' ' ' SER . . . 98.34 -28.67 13.73 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.441 -1.464 . . . . 0.0 109.441 -179.787 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.657 ' CB ' ' CD2' ' A' ' 48' ' ' TYR . 0.3 OUTLIER -55.02 -157.11 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.266 0 O-C-N 121.492 -1.005 . . . . 0.0 110.902 -179.756 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.466 ' CG2' ' HB2' ' A' ' 57' ' ' ALA . 10.8 m -117.37 179.93 0.74 Allowed Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.285 -0.884 . . . . 0.0 110.02 179.649 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -82.56 11.26 3.26 Favored 'Trans proline' 0 C--N 1.305 -1.713 0 O-C-N 123.989 1.52 . . . . 0.0 110.261 179.749 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -142.85 40.84 1.22 Allowed Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 179.897 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.466 ' HB2' ' CG2' ' A' ' 54' ' ' VAL . . . -111.09 133.86 53.14 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.328 -1.101 . . . . 0.0 110.217 -179.931 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.583 ' CD2' ' N ' ' A' ' 58' ' ' LEU . 2.3 mm? -116.2 160.19 20.75 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.305 -0.872 . . . . 0.0 109.936 179.996 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.457 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.6 OUTLIER -106.8 110.41 22.58 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.041 -1.037 . . . . 0.0 110.445 -179.98 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.624 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 17.2 p90 -75.91 -26.31 56.86 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.259 -0.9 . . . . 0.0 109.966 179.601 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.624 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.15 -39.59 72.54 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.327 -0.858 . . . . 0.0 110.023 -179.806 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.453 ' CB ' ' HG2' ' A' ' 46' ' ' PRO . . . -65.56 -39.55 91.81 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.177 -0.952 . . . . 0.0 109.831 179.667 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.58 ' CG ' ' HB3' ' A' ' 44' ' ' ARG . 2.0 t80 -71.9 -35.05 69.59 Favored 'General case' 0 C--N 1.298 -1.647 0 O-C-N 121.572 -0.705 . . . . 0.0 110.137 179.68 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.579 ' O ' ' CD2' ' A' ' 68' ' ' TYR . 17.4 m -56.19 -49.9 72.73 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.343 -0.848 . . . . 0.0 110.554 -179.692 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.5 p -55.65 -44.42 77.16 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.211 -0.931 . . . . 0.0 110.461 -179.754 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.16 -39.08 74.54 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.149 -0.97 . . . . 0.0 110.481 -179.802 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.528 HD13 ' CZ ' ' A' ' 63' ' ' PHE . 18.3 mt -60.25 -38.52 83.72 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.188 -0.945 . . . . 0.0 110.292 -179.894 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.598 ' CZ ' ' HA ' ' A' ' 7' ' ' ALA . 10.3 m-85 -86.48 -22.44 26.44 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.315 -0.866 . . . . 0.0 110.215 -179.641 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 108.02 -43.5 1.69 Allowed Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.964 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -171.95 95.63 0.16 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.264 -1.139 . . . . 0.0 110.28 -179.995 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.71 -67.92 0.37 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.286 -0.884 . . . . 0.0 110.137 179.993 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -70.6 103.54 2.55 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.248 -0.908 . . . . 0.0 110.134 179.941 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.641 0 O-C-N 121.298 -0.876 . . . . 0.0 110.191 -179.91 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.258 0 N-CA-C 109.541 -1.424 . . . . 0.0 109.541 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 11.4 ptpt -173.36 33.35 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.255 -1.144 . . . . 0.0 110.192 179.993 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 15.8 ttmt -58.55 -41.87 86.6 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.221 -0.925 . . . . 0.0 110.161 -179.969 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.16 -35.74 77.94 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.235 -0.916 . . . . 0.0 110.011 179.927 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.86 -42.62 94.72 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.343 -0.848 . . . . 0.0 110.128 179.998 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . 0.412 ' HB2' ' CD1' ' A' ' 16' ' ' ILE . . . -63.17 -35.78 81.44 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.141 -0.974 . . . . 0.0 110.018 179.83 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.434 ' O ' HG21 ' B' ' 17' ' ' VAL . 72.8 t -61.61 -42.34 93.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.28 -0.887 . . . . 0.0 110.075 179.892 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.51 -44.26 93.16 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.309 -0.87 . . . . 0.0 110.234 179.955 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 37.0 m -64.57 -49.12 72.43 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.301 -0.875 . . . . 0.0 110.33 -180.0 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 86.2 t -60.99 -43.98 97.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.183 -0.948 . . . . 0.0 110.298 -179.966 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.532 ' CG2' ' CD2' ' A' ' 33' ' ' LEU . 90.2 t -63.18 -47.17 93.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.327 -0.858 . . . . 0.0 110.2 -179.886 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.54 -43.25 75.65 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.25 -0.906 . . . . 0.0 110.165 -179.975 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.5 -44.09 83.53 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.309 -0.869 . . . . 0.0 110.161 179.989 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 75.1 t -66.07 -44.96 91.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.226 -0.921 . . . . 0.0 110.192 179.956 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -57.16 -34.81 68.81 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.276 -0.89 . . . . 0.0 110.24 -179.96 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.9 tm0? -61.18 -49.83 75.62 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.2 -0.938 . . . . 0.0 110.162 -179.914 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . 0.475 ' O ' ' HG2' ' B' ' 26' ' ' ARG . . . -60.81 -35.4 76.4 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.291 -0.881 . . . . 0.0 110.353 -179.922 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 21.5 ttp85 -70.59 -32.22 69.5 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.15 -0.968 . . . . 0.0 110.487 179.979 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 63.8 t -54.89 -24.01 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.175 -0.953 . . . . 0.0 110.536 -179.589 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.475 ' HG2' ' O ' ' B' ' 23' ' ' ALA . 9.1 ptm180 -102.67 19.54 18.93 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.341 -0.85 . . . . 0.0 110.037 179.913 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -106.98 145.16 30.54 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.268 -0.895 . . . . 0.0 110.027 179.89 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -86.89 92.66 0.53 Allowed 'Trans proline' 0 C--N 1.305 -1.735 0 O-C-N 123.906 1.477 . . . . 0.0 110.274 179.921 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.567 0 O-C-N 121.255 -0.903 . . . . 0.0 110.207 -179.94 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 121.215 0.531 . . . . 0.0 110.264 . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -165.12 -149.83 0.12 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.22 -0.925 . . . . 0.0 110.109 179.995 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.427 ' O ' ' OG1' ' A' ' 4' ' ' THR . 2.0 p-10 -165.03 124.9 1.87 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.227 -0.921 . . . . 0.0 110.229 179.944 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.427 ' OG1' ' O ' ' A' ' 3' ' ' ASP . 40.7 p 43.48 74.0 0.13 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.226 -0.921 . . . . 0.0 110.05 -179.997 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.509 ' O ' ' N ' ' A' ' 7' ' ' ALA . 1.5 m-20 -123.91 -72.42 0.68 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.245 -0.909 . . . . 0.0 110.278 -179.967 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.621 ' CG2' ' CZ ' ' A' ' 68' ' ' TYR . 3.3 m 66.02 -63.36 0.23 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.283 -0.885 . . . . 0.0 110.196 -179.958 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.509 ' N ' ' O ' ' A' ' 5' ' ' ASP . . . -66.94 -45.53 77.53 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.22 -0.925 . . . . 0.0 109.823 179.774 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -57.02 -36.65 70.69 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.32 -0.863 . . . . 0.0 109.883 179.694 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -61.38 -47.37 86.15 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.333 -0.854 . . . . 0.0 110.185 -179.853 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 41.6 t -58.26 -41.3 80.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.164 -0.96 . . . . 0.0 109.871 179.755 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 29.8 mt -63.33 -47.92 89.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.354 -0.841 . . . . 0.0 109.487 179.547 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.43 -39.01 75.32 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.334 -0.853 . . . . 0.0 108.722 179.018 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.467 ' HA ' ' HB3' ' B' ' 12' ' ' ALA . 10.6 m -66.91 -40.34 87.65 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 178.71 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.564 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 6.6 m-85 -68.28 -41.23 81.33 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.464 -0.772 . . . . 0.0 109.525 179.219 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -53.1 -44.26 67.49 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.348 -0.845 . . . . 0.0 109.456 179.363 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 48.3 mt -59.74 -43.6 91.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.479 -0.763 . . . . 0.0 109.882 179.467 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 13' ' ' SER . 48.3 mt -65.12 -41.75 94.57 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.289 -0.882 . . . . 0.0 109.949 179.792 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.469 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -83.75 13.97 4.32 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.456 -0.778 . . . . 0.0 110.337 -179.879 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 57.73 70.58 0.64 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.245 -0.91 . . . . 0.0 110.465 179.932 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.8 t70 44.99 54.96 6.51 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.332 -0.855 . . . . 0.0 110.514 179.777 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.527 ' HD2' ' CZ ' ' A' ' 23' ' ' TYR . 7.1 mttm -133.55 141.83 41.71 Favored Pre-proline 0 N--CA 1.491 1.575 0 O-C-N 121.143 -0.973 . . . . 0.0 109.901 179.89 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -68.13 -4.4 12.55 Favored 'Trans proline' 0 C--N 1.305 -1.729 0 O-C-N 124.02 1.537 . . . . 0.0 110.388 179.973 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.573 ' HB3' ' CE1' ' A' ' 48' ' ' TYR . 51.8 p90 -139.18 157.41 45.98 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.213 -0.93 . . . . 0.0 110.306 -179.913 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.525 ' CG2' ' SD ' ' A' ' 45' ' ' MET . 0.2 OUTLIER -132.91 138.25 52.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.286 -0.884 . . . . 0.0 109.467 179.581 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.446 HD11 ' O ' ' A' ' 56' ' ' GLY . 1.0 OUTLIER -82.15 139.48 34.32 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.13 -0.981 . . . . 0.0 110.369 -179.48 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -54.99 -35.22 64.11 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.39 -0.819 . . . . 0.0 110.175 179.945 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 87.6 mt-10 -61.12 -38.56 86.77 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.224 -0.922 . . . . 0.0 109.991 179.9 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -65.87 -40.48 91.69 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.329 -0.857 . . . . 0.0 109.565 179.627 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.448 HD22 HD13 ' A' ' 24' ' ' ILE . 63.6 mt -59.24 -34.03 71.72 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.433 -0.792 . . . . 0.0 109.476 179.446 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.4 ' HA ' ' CB ' ' A' ' 38' ' ' ALA . 27.8 mtp180 -68.48 -34.56 76.14 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.388 -0.82 . . . . 0.0 110.047 179.754 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.22 -31.48 13.47 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.3 -0.875 . . . . 0.0 110.499 -179.665 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -83.48 -23.36 32.23 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.074 -1.017 . . . . 0.0 110.431 -179.773 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.531 HD21 ' CB ' ' A' ' 37' ' ' GLN . 1.5 mt -129.85 147.84 67.1 Favored Pre-proline 0 N--CA 1.488 1.461 0 O-C-N 121.082 -1.011 . . . . 0.0 110.329 -179.749 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.484 ' HD2' ' CD2' ' A' ' 33' ' ' LEU . 1.0 OUTLIER -46.45 167.11 0.07 OUTLIER 'Trans proline' 0 C--N 1.305 -1.76 0 O-C-N 124.021 1.537 . . . . 0.0 110.095 179.665 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -62.44 -36.02 68.57 Favored 'Trans proline' 0 C--N 1.304 -1.794 0 O-C-N 124.03 1.542 . . . . 0.0 110.484 -179.768 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.521 ' OD1' ' N ' ' A' ' 37' ' ' GLN . 1.7 p30 -65.61 -46.4 79.46 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.25 -0.906 . . . . 0.0 110.462 -179.78 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.531 ' CB ' HD21 ' A' ' 33' ' ' LEU . 0.3 OUTLIER -69.45 -40.17 77.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.121 -0.987 . . . . 0.0 110.153 -179.962 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.432 ' O ' HG13 ' A' ' 42' ' ' ILE . . . -58.64 -48.14 82.02 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.289 -0.882 . . . . 0.0 110.185 179.917 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 66.7 tp60 -62.91 -47.52 82.9 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.266 -0.896 . . . . 0.0 110.14 179.888 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -66.21 -46.56 76.84 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.339 -0.851 . . . . 0.0 110.045 179.962 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 89.6 m -64.92 -45.97 83.61 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.356 -0.84 . . . . 0.0 110.332 -179.998 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 38' ' ' ALA . 66.2 mt -68.73 -12.46 15.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.245 -0.909 . . . . 0.0 110.424 -179.853 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 19.7 tttm -83.12 -40.23 20.05 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.209 -0.932 . . . . 0.0 110.487 -179.783 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.511 ' O ' ' C ' ' A' ' 45' ' ' MET . 3.2 mtp85 -85.27 -61.61 1.73 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.204 -0.935 . . . . 0.0 110.55 -179.656 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.525 ' SD ' ' CG2' ' A' ' 24' ' ' ILE . 5.8 ttm -28.0 103.32 0.16 Allowed Pre-proline 0 N--CA 1.497 1.919 0 O-C-N 121.84 -0.537 . . . . 0.0 111.598 -179.886 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.469 ' O ' HD13 ' A' ' 58' ' ' LEU . 11.4 Cg_endo -57.03 -160.58 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.713 0 O-C-N 124.058 1.557 . . . . 0.0 110.028 179.691 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.458 ' O ' ' O ' ' A' ' 48' ' ' TYR . . . -98.35 49.52 0.99 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.13 -0.981 . . . . 0.0 110.371 -179.924 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.573 ' CE1' ' HB3' ' A' ' 23' ' ' TYR . 24.9 t80 49.63 177.58 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.25 -0.906 . . . . 0.0 110.369 179.86 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -128.76 178.46 6.34 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.185 -0.947 . . . . 0.0 110.141 -179.974 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 112.05 -170.05 13.42 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 -179.952 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -72.93 -86.5 0.0 OUTLIER 'Trans proline' 0 C--N 1.307 -1.648 0 O-C-N 123.968 1.51 . . . . 0.0 110.261 179.937 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.488 ' O ' ' O ' ' A' ' 53' ' ' SER . . . -125.85 82.69 0.35 Allowed Glycine 0 N--CA 1.49 2.261 0 N-CA-C 109.519 -1.433 . . . . 0.0 109.519 -179.945 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.488 ' O ' ' O ' ' A' ' 52' ' ' GLY . 0.9 OUTLIER -55.61 -156.86 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.29 0 O-C-N 121.361 -1.082 . . . . 0.0 110.702 -179.596 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.511 ' HB ' ' CD ' ' A' ' 55' ' ' PRO . 14.6 m -76.73 -160.09 0.02 OUTLIER Pre-proline 0 N--CA 1.492 1.651 0 O-C-N 121.23 -0.919 . . . . 0.0 110.244 179.996 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.511 ' CD ' ' HB ' ' A' ' 54' ' ' VAL . 24.4 Cg_exo -99.3 52.39 0.06 OUTLIER 'Trans proline' 0 C--N 1.306 -1.67 0 O-C-N 123.898 1.473 . . . . 0.0 110.403 -179.882 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.446 ' O ' HD11 ' A' ' 25' ' ' LEU . . . 141.26 46.83 0.05 OUTLIER Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.941 -1.264 . . . . 0.0 109.941 179.831 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.451 ' O ' ' HB2' ' A' ' 48' ' ' TYR . . . -100.01 124.14 45.03 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.144 -1.21 . . . . 0.0 110.032 179.694 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.59 ' CD2' ' N ' ' A' ' 58' ' ' LEU . 1.6 mm? -110.41 154.51 23.47 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.25 -0.906 . . . . 0.0 110.129 -179.846 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.461 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.4 OUTLIER -106.27 110.64 22.94 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.166 -0.959 . . . . 0.0 110.354 179.837 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.564 ' HB2' ' CD2' ' A' ' 14' ' ' PHE . 17.4 p90 -72.56 -18.02 61.66 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.242 -0.911 . . . . 0.0 109.164 179.223 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.434 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.79 -35.47 66.33 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.451 -0.781 . . . . 0.0 109.104 179.571 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.456 ' CB ' ' CD ' ' A' ' 46' ' ' PRO . . . -60.15 -32.68 71.26 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.368 -0.832 . . . . 0.0 109.174 179.185 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.554 ' CD2' HD13 ' A' ' 67' ' ' LEU . 2.6 t80 -63.14 -48.79 76.96 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.785 -0.572 . . . . 0.0 110.203 179.756 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.453 ' O ' ' HB2' ' A' ' 68' ' ' TYR . 41.3 p -63.92 -45.74 87.91 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.216 -0.928 . . . . 0.0 110.401 -179.862 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.495 ' O ' ' CA ' ' A' ' 69' ' ' GLY . 54.0 m -67.06 -39.25 86.86 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.236 -0.915 . . . . 0.0 110.285 -179.897 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.19 -43.86 69.89 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.231 -0.918 . . . . 0.0 110.35 -179.851 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.554 HD13 ' CD2' ' A' ' 63' ' ' PHE . 22.5 mt -73.6 -44.6 56.73 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.175 -0.953 . . . . 0.0 110.357 -179.868 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.621 ' CZ ' ' CG2' ' A' ' 6' ' ' THR . 11.7 m-85 -99.44 15.4 26.53 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.222 -0.924 . . . . 0.0 110.286 -179.935 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.495 ' CA ' ' O ' ' A' ' 65' ' ' SER . . . -46.13 112.21 0.79 Allowed Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -179.834 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -119.2 -16.89 9.02 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.309 -1.113 . . . . 0.0 110.181 179.902 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 178.9 107.41 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.247 -0.908 . . . . 0.0 110.22 179.966 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -73.54 136.83 44.09 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.176 -0.952 . . . . 0.0 110.255 179.961 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 O-C-N 121.33 -0.857 . . . . 0.0 110.213 179.967 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.257 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 14.3 ptmt -114.18 36.25 3.81 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.207 -1.172 . . . . 0.0 110.226 -179.965 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.435 ' O ' HG22 ' B' ' 13' ' ' VAL . 7.3 ttpt -65.2 -45.74 83.55 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.174 -0.954 . . . . 0.0 110.228 -179.879 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.45 -41.94 73.57 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.284 -0.885 . . . . 0.0 110.099 179.859 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -61.07 -41.28 96.34 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.231 -0.918 . . . . 0.0 110.115 179.872 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . 0.467 ' HB3' ' HA ' ' A' ' 13' ' ' SER . . . -62.97 -36.43 83.45 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.309 -0.869 . . . . 0.0 110.142 179.94 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.435 HG22 ' O ' ' B' ' 9' ' ' LYS . 55.0 t -65.96 -45.12 91.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.255 -0.903 . . . . 0.0 110.163 179.758 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.04 -39.69 79.06 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.262 -0.899 . . . . 0.0 110.207 179.973 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 15.9 m -70.04 -40.79 74.95 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.317 -0.864 . . . . 0.0 110.21 179.916 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.446 HG13 HD12 ' A' ' 33' ' ' LEU . 92.4 t -67.08 -45.47 86.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.265 -0.897 . . . . 0.0 110.247 179.986 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.402 ' CG1' ' NE2' ' A' ' 37' ' ' GLN . 55.0 t -62.77 -44.33 99.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.199 -0.938 . . . . 0.0 110.098 179.935 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.06 -39.19 77.85 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.311 -0.868 . . . . 0.0 110.236 -179.988 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.25 -40.77 86.29 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.194 -0.941 . . . . 0.0 110.221 -179.905 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . 0.41 HG23 ' CE2' ' A' ' 63' ' ' PHE . 91.0 t -66.05 -41.04 88.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.293 -0.879 . . . . 0.0 110.355 -179.982 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 48.6 t0 -61.6 -31.86 71.95 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.245 -0.909 . . . . 0.0 110.247 -179.883 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -39.43 94.19 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.249 -0.907 . . . . 0.0 110.175 -179.9 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . 0.481 ' CB ' ' CD2' ' A' ' 67' ' ' LEU . . . -65.91 -38.35 88.48 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.188 -0.945 . . . . 0.0 110.334 -179.851 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.72 -39.53 81.09 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.174 -0.954 . . . . 0.0 110.398 -179.867 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 56.3 t -62.86 -21.57 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.155 -0.966 . . . . 0.0 110.376 -179.818 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.54 30.79 6.35 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.287 -0.883 . . . . 0.0 110.262 -179.961 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 61.6 tt0 -77.63 106.09 3.38 Favored Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.17 -0.957 . . . . 0.0 110.142 179.894 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -59.93 132.19 43.54 Favored 'Trans proline' 0 C--N 1.305 -1.748 0 O-C-N 124.054 1.555 . . . . 0.0 110.314 -179.769 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 5.1 ttt-85 . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.232 -0.917 . . . . 0.0 110.253 179.893 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ttt . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 121.249 0.547 . . . . 0.0 110.143 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -130.1 -143.25 0.25 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.283 -0.886 . . . . 0.0 110.123 179.97 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -90.76 -166.27 1.54 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.291 -0.881 . . . . 0.0 110.25 179.961 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.461 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 7.5 t -100.11 -144.23 0.33 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.169 -0.957 . . . . 0.0 110.198 179.944 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.44 ' CB ' ' O ' ' A' ' 4' ' ' THR . 1.7 t0 66.6 -168.72 0.2 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.277 -0.889 . . . . 0.0 110.196 179.905 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -50.1 -24.11 2.52 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.28 -0.887 . . . . 0.0 110.27 179.933 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.436 ' O ' HG13 ' A' ' 11' ' ' ILE . . . -62.01 -45.26 94.36 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.224 -0.923 . . . . 0.0 109.453 179.754 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.461 ' HB2' ' HA ' ' A' ' 4' ' ' THR . 1.3 tm-20 -56.06 -36.59 68.23 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.437 -0.789 . . . . 0.0 109.682 179.333 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -61.96 -48.41 80.53 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.354 -0.841 . . . . 0.0 110.04 179.866 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 44.0 t -59.44 -46.42 92.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.339 -0.851 . . . . 0.0 109.673 179.695 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.436 HG13 ' O ' ' A' ' 7' ' ' ALA . 44.7 mt -57.49 -48.49 82.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.293 -0.879 . . . . 0.0 109.431 179.536 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.76 -43.36 85.4 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.223 -0.923 . . . . 0.0 108.811 178.979 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.45 ' HB2' ' HA ' ' B' ' 12' ' ' ALA . 6.7 p -63.07 -39.19 93.98 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 178.6 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -68.57 -41.21 80.02 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.512 -0.742 . . . . 0.0 109.576 179.112 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.638 ' NH2' ' CE2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -54.47 -42.61 70.88 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.276 -0.89 . . . . 0.0 109.62 179.486 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.412 HG22 HD11 ' A' ' 16' ' ' ILE . 38.0 mt -57.64 -45.05 86.5 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 O-C-N 121.155 -0.965 . . . . 0.0 108.72 179.032 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.473 HD13 ' HB3' ' A' ' 32' ' ' GLU . 4.1 mm? -65.97 -41.7 90.82 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.449 -0.782 . . . . 0.0 109.717 178.905 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.461 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -72.15 -11.96 60.97 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.475 -0.766 . . . . 0.0 110.091 -179.958 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.461 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 1.7 t 66.32 64.59 0.51 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.339 -0.851 . . . . 0.0 110.249 -179.987 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 51.45 62.36 2.75 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.213 -0.93 . . . . 0.0 110.377 179.902 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.525 ' O ' ' NE ' ' A' ' 15' ' ' ARG . 14.9 mttt -141.76 140.77 20.58 Favored Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.316 -0.865 . . . . 0.0 109.881 179.847 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.584 ' O ' ' CD1' ' A' ' 23' ' ' TYR . 18.5 Cg_endo -62.24 -10.65 19.09 Favored 'Trans proline' 0 C--N 1.303 -1.835 0 O-C-N 123.926 1.488 . . . . 0.0 110.178 179.938 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.584 ' CD1' ' O ' ' A' ' 22' ' ' PRO . 32.0 m-85 -143.06 -173.5 3.93 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.265 -0.897 . . . . 0.0 110.255 -179.974 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.7 tt -143.66 139.37 25.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.376 -0.828 . . . . 0.0 109.993 179.863 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.8 mt -80.17 143.35 33.91 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.276 -0.89 . . . . 0.0 109.95 -179.932 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.523 ' HA ' ' CD2' ' A' ' 29' ' ' LEU . . . -62.52 -36.49 82.75 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.38 -0.825 . . . . 0.0 110.606 -179.534 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -65.48 -36.44 83.88 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.134 -0.979 . . . . 0.0 110.128 -179.892 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.471 ' O ' ' CG ' ' A' ' 32' ' ' GLU . 28.8 mt-10 -69.1 -51.11 41.97 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.12 -0.988 . . . . 0.0 110.131 -179.876 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.523 ' CD2' ' HA ' ' A' ' 26' ' ' ALA . 2.4 pp -67.62 -33.21 74.53 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.254 -0.904 . . . . 0.0 109.779 179.387 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.529 ' HA ' ' CB ' ' A' ' 38' ' ' ALA . 10.8 tpt180 -64.71 -34.84 79.26 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.261 -0.9 . . . . 0.0 110.526 -179.846 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.4 ttp85 -93.98 -9.05 38.21 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.218 -0.926 . . . . 0.0 110.63 -179.576 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.473 ' HB3' HD13 ' A' ' 17' ' ' LEU . 8.0 mm-40 -100.13 -23.44 14.85 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.11 -0.994 . . . . 0.0 111.171 -179.313 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.53 ' CD2' ' HB3' ' A' ' 37' ' ' GLN . 0.3 OUTLIER -110.87 150.43 41.82 Favored Pre-proline 0 N--CA 1.489 1.486 0 O-C-N 120.907 -1.121 . . . . 0.0 110.3 -179.753 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.44 ' HG2' ' HB2' ' A' ' 37' ' ' GLN . 6.3 Cg_exo -47.36 144.44 9.73 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 O-C-N 124.031 1.542 . . . . 0.0 109.879 179.783 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.432 ' C ' ' O ' ' A' ' 34' ' ' PRO . 35.3 Cg_endo -38.1 -47.79 2.25 Favored 'Trans proline' 0 C--N 1.304 -1.78 0 O-C-N 124.192 1.628 . . . . 0.0 110.569 -179.72 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.409 ' OD1' ' HG2' ' A' ' 35' ' ' PRO . 2.4 m-20 -66.31 -47.02 74.9 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.24 -0.912 . . . . 0.0 111.185 -179.563 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.53 ' HB3' ' CD2' ' A' ' 33' ' ' LEU . 0.9 OUTLIER -69.82 -44.43 70.0 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.062 -1.024 . . . . 0.0 110.575 -179.42 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.529 ' CB ' ' HA ' ' A' ' 30' ' ' ARG . . . -59.16 -44.46 92.11 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.28 -0.888 . . . . 0.0 110.624 -179.534 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -66.09 -43.43 87.31 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.099 -1.001 . . . . 0.0 110.712 -179.643 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -61.31 -43.74 98.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.161 -0.962 . . . . 0.0 110.5 -179.805 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.457 ' O ' ' SD ' ' A' ' 45' ' ' MET . 79.1 m -58.09 -42.41 85.54 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.165 -0.959 . . . . 0.0 110.477 -179.771 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.45 HG12 ' HB2' ' A' ' 26' ' ' ALA . 36.4 mt -65.49 -21.82 29.88 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.14 -0.975 . . . . 0.0 110.362 -179.854 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.66 -34.5 23.02 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.18 -0.95 . . . . 0.0 110.817 -179.569 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.505 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 2.0 mmp_? -74.72 -69.45 0.46 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.107 -0.996 . . . . 0.0 110.589 -179.521 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.559 ' HE1' ' CB ' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -36.28 118.14 0.69 Allowed Pre-proline 0 N--CA 1.488 1.467 0 O-C-N 121.53 -0.731 . . . . 0.0 111.412 -179.756 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.431 ' CD ' ' HB1' ' A' ' 62' ' ' ALA . 9.3 Cg_endo -70.21 -154.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.304 -1.771 0 O-C-N 124.197 1.63 . . . . 0.0 109.342 179.117 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.413 ' O ' ' C ' ' A' ' 48' ' ' TYR . . . -96.93 113.7 25.26 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.082 -1.011 . . . . 0.0 110.331 179.864 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.56 ' CD1' ' O ' ' A' ' 57' ' ' ALA . 12.9 p90 -41.88 144.77 0.39 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.407 -0.808 . . . . 0.0 110.288 -179.997 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -151.73 24.79 0.67 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.294 -0.879 . . . . 0.0 110.192 -179.872 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -106.98 -165.86 22.28 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.445 -1.462 . . . . 0.0 109.445 -179.992 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -72.87 165.31 33.14 Favored 'Trans proline' 0 C--N 1.305 -1.718 0 O-C-N 123.923 1.486 . . . . 0.0 110.261 -179.996 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.451 ' O ' ' C ' ' A' ' 53' ' ' SER . . . 79.01 7.01 88.7 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -179.986 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.451 ' C ' ' O ' ' A' ' 52' ' ' GLY . 0.0 OUTLIER -36.22 139.91 0.15 Allowed 'General case' 0 C--N 1.308 -1.238 0 O-C-N 121.612 -0.934 . . . . 0.0 110.905 -179.71 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.541 HG21 ' CB ' ' A' ' 57' ' ' ALA . 1.5 m -142.83 -169.46 0.22 Allowed Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.686 -0.634 . . . . 0.0 109.961 179.595 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.471 ' HD2' ' HB ' ' A' ' 54' ' ' VAL . 11.7 Cg_endo -93.67 115.35 0.26 Allowed 'Trans proline' 0 C--N 1.305 -1.757 0 O-C-N 123.948 1.499 . . . . 0.0 110.832 -179.515 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.87 33.6 26.66 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 110.059 -1.216 . . . . 0.0 110.059 179.458 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.56 ' O ' ' CD1' ' A' ' 48' ' ' TYR . . . -91.21 137.95 31.97 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.091 -1.24 . . . . 0.0 110.479 -179.988 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 62.3 mt -124.88 159.75 30.41 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.298 -0.876 . . . . 0.0 109.613 179.499 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.437 ' C ' ' HG2' ' A' ' 45' ' ' MET . 3.7 m-20 -106.18 110.76 23.11 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.005 -1.06 . . . . 0.0 111.234 -179.52 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.638 ' CE2' ' NH2' ' A' ' 15' ' ' ARG . 39.7 p90 -81.49 -29.77 33.55 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.425 -0.797 . . . . 0.0 110.08 179.307 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.528 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.5 -36.65 66.92 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.283 -0.886 . . . . 0.0 109.522 -179.943 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.431 ' HB1' ' CD ' ' A' ' 46' ' ' PRO . . . -68.16 -35.81 78.65 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.344 -0.848 . . . . 0.0 109.862 179.539 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.507 ' O ' ' CD1' ' A' ' 63' ' ' PHE . 2.6 t80 -72.05 -31.44 66.14 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.576 -0.703 . . . . 0.0 110.303 179.66 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 20.1 m -71.43 -48.5 49.2 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.285 -0.884 . . . . 0.0 110.409 -179.704 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.43 -43.28 97.89 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.199 -0.938 . . . . 0.0 110.37 -179.779 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -61.83 -40.78 96.48 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.196 -0.94 . . . . 0.0 110.404 -179.789 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.86 -40.03 75.39 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.152 -0.968 . . . . 0.0 110.346 -179.804 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -91.73 -24.58 19.41 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.127 -0.983 . . . . 0.0 110.263 -179.995 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.426 ' O ' ' HB3' ' A' ' 70' ' ' GLU . . . 112.97 -70.22 0.22 Allowed Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 179.888 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.426 ' HB3' ' O ' ' A' ' 69' ' ' GLY . 1.1 tp10 62.98 21.62 13.0 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.269 -1.136 . . . . 0.0 110.236 -179.981 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.9 p -128.0 -76.4 0.57 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.273 -0.892 . . . . 0.0 110.253 -179.985 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.91 122.2 31.24 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.156 -0.965 . . . . 0.0 110.192 179.981 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.655 0 O-C-N 121.178 -0.952 . . . . 0.0 110.154 179.959 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.24 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -109.76 -57.47 2.18 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.254 -1.145 . . . . 0.0 110.264 -179.936 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.448 ' CE ' ' OE1' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -59.96 -51.14 70.96 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.217 -0.927 . . . . 0.0 110.153 179.942 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.8 -35.54 68.85 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.216 -0.927 . . . . 0.0 110.059 179.935 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -62.84 -42.55 99.78 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.216 -0.928 . . . . 0.0 110.207 179.932 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . 0.45 ' HA ' ' HB2' ' A' ' 13' ' ' SER . . . -67.04 -40.96 87.28 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.294 -0.879 . . . . 0.0 110.073 179.916 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 75.1 t -61.24 -44.62 98.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.204 -0.935 . . . . 0.0 109.952 179.895 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.52 -44.33 89.5 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.19 -0.943 . . . . 0.0 110.053 179.809 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 54.3 m -63.55 -43.25 97.63 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.241 -0.912 . . . . 0.0 110.085 179.858 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 76.7 t -64.22 -41.99 94.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.298 -0.876 . . . . 0.0 110.054 179.864 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 77.6 t -61.04 -44.33 98.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.272 -0.892 . . . . 0.0 110.071 179.84 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.8 -45.97 92.33 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.162 -0.961 . . . . 0.0 110.034 179.939 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.32 -45.44 87.91 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.201 -0.937 . . . . 0.0 110.087 179.826 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 66.5 t -68.04 -40.52 83.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.231 -0.918 . . . . 0.0 110.191 179.937 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . 0.428 ' O ' HG22 ' B' ' 25' ' ' VAL . 41.6 t0 -61.87 -31.5 71.78 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.345 -0.847 . . . . 0.0 110.133 179.934 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -55.82 -50.93 69.19 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.26 -0.9 . . . . 0.0 110.078 -179.995 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.87 -39.66 90.01 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.199 -0.938 . . . . 0.0 110.091 179.785 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 10.6 ttp180 -67.44 -33.67 75.62 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.406 -0.809 . . . . 0.0 110.128 179.857 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . 0.428 HG22 ' O ' ' B' ' 21' ' ' ASP . 25.2 t -59.43 -20.39 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.294 -0.879 . . . . 0.0 110.104 -179.908 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.565 ' NH1' ' HB3' ' B' ' 26' ' ' ARG . 6.9 mtp-105 -82.54 15.3 2.61 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.337 -0.852 . . . . 0.0 110.517 -179.905 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . 0.561 ' O ' ' C ' ' B' ' 28' ' ' PRO . 0.0 OUTLIER -106.3 107.13 59.33 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.369 -0.832 . . . . 0.0 109.383 179.484 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . 0.561 ' C ' ' O ' ' B' ' 27' ' ' GLU . 82.7 Cg_exo -0.68 71.6 0.0 OUTLIER 'Trans proline' 0 N--CA 1.501 1.917 0 O-C-N 124.917 2.009 . . . . 0.0 112.328 -179.369 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . 0.52 ' N ' ' O ' ' B' ' 27' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 O-C-N 121.208 -0.932 . . . . 0.0 110.266 -179.531 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 mtt . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.201 0.524 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -159.22 178.73 9.69 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.289 -0.882 . . . . 0.0 110.356 -179.994 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -171.21 82.35 0.08 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.349 -0.845 . . . . 0.0 109.937 179.973 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 7.6 t -125.83 14.79 8.03 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.329 -0.857 . . . . 0.0 110.526 -179.761 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -140.51 108.72 5.78 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.151 -0.968 . . . . 0.0 110.526 -179.857 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 27.8 m -111.38 -44.59 3.51 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.27 -0.894 . . . . 0.0 109.989 179.75 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.636 ' CB ' ' CE2' ' A' ' 68' ' ' TYR . . . -66.52 -45.78 78.39 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.282 -0.886 . . . . 0.0 109.793 179.644 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -54.69 -36.48 64.7 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.358 -0.838 . . . . 0.0 109.758 179.552 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -61.56 -40.08 93.44 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.34 -0.85 . . . . 0.0 110.047 179.995 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.433 HG13 ' HB2' ' A' ' 64' ' ' SER . 88.3 t -58.2 -52.35 59.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.178 -0.951 . . . . 0.0 109.935 179.698 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.411 HD12 HG22 ' A' ' 11' ' ' ILE . 59.0 mt -55.47 -49.49 72.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.254 -0.904 . . . . 0.0 109.49 179.612 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.83 -40.38 79.91 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.315 -0.866 . . . . 0.0 108.876 179.119 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.0 p -66.8 -37.78 85.2 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.418 -0.801 . . . . 0.0 109.122 178.941 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.489 ' CE1' ' HE3' ' A' ' 45' ' ' MET . 3.3 m-85 -68.27 -43.66 77.28 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.317 -0.864 . . . . 0.0 109.706 179.363 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -53.35 -47.99 68.92 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.327 -0.858 . . . . 0.0 109.389 179.515 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.443 ' CG2' ' HA ' ' B' ' 9' ' ' LYS . 71.3 mt -59.09 -42.36 86.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.403 -0.811 . . . . 0.0 109.607 179.281 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.49 ' CD1' ' HB3' ' A' ' 32' ' ' GLU . 2.6 mm? -64.79 -39.13 93.09 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.414 -0.804 . . . . 0.0 109.982 179.727 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.45 ' O ' ' HG3' ' A' ' 21' ' ' LYS . . . -82.95 10.58 7.59 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.319 -0.863 . . . . 0.0 110.249 -179.974 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 61.46 56.35 2.61 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.311 -0.868 . . . . 0.0 110.239 -179.948 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.6 t0 56.85 59.31 3.56 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.225 -0.922 . . . . 0.0 110.225 179.925 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.45 ' HG3' ' O ' ' A' ' 18' ' ' ALA . 18.8 mttm -140.62 144.34 35.96 Favored Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.25 -0.906 . . . . 0.0 110.173 -179.975 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -75.03 1.06 8.17 Favored 'Trans proline' 0 C--N 1.304 -1.792 0 O-C-N 124.091 1.574 . . . . 0.0 109.998 179.562 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.455 ' O ' ' CD1' ' A' ' 23' ' ' TYR . 8.4 p90 -141.69 150.42 41.85 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.219 -0.925 . . . . 0.0 110.179 179.963 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.504 HD11 HG22 ' A' ' 24' ' ' ILE . 0.4 OUTLIER -121.38 144.09 31.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.188 -0.945 . . . . 0.0 110.002 -179.973 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.524 ' CD2' ' N ' ' A' ' 25' ' ' LEU . 4.4 mm? -85.73 145.24 27.35 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.22 -0.925 . . . . 0.0 110.302 -179.894 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.63 -45.43 94.11 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.279 -0.888 . . . . 0.0 110.181 179.894 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -61.42 -35.72 78.35 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.22 -0.925 . . . . 0.0 109.85 179.889 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.462 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -62.4 -47.2 85.17 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.264 -0.897 . . . . 0.0 109.075 179.329 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.458 HD22 HD13 ' A' ' 24' ' ' ILE . 41.8 mt -58.75 -33.46 70.29 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.424 -0.798 . . . . 0.0 109.229 178.971 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.518 ' HA ' ' CB ' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -65.73 -34.68 78.76 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.359 -0.838 . . . . 0.0 110.236 179.999 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -96.68 -31.93 12.44 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.086 -1.009 . . . . 0.0 110.832 -179.745 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.49 ' HB3' ' CD1' ' A' ' 17' ' ' LEU . 0.4 OUTLIER -76.02 -23.33 55.18 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.058 -1.026 . . . . 0.0 110.587 -179.726 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.433 HD21 ' CB ' ' A' ' 37' ' ' GLN . 0.2 OUTLIER -133.05 158.44 75.81 Favored Pre-proline 0 C--N 1.305 -1.334 0 O-C-N 121.096 -1.003 . . . . 0.0 110.403 -179.627 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.519 ' HG2' ' CG ' ' A' ' 37' ' ' GLN . 6.3 Cg_exo -50.58 134.02 39.12 Favored 'Trans proline' 0 C--N 1.305 -1.739 0 O-C-N 124.053 1.554 . . . . 0.0 110.056 179.769 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.42 ' C ' ' O ' ' A' ' 34' ' ' PRO . 33.9 Cg_endo -39.24 -35.23 0.66 Allowed 'Trans proline' 0 C--N 1.306 -1.701 0 O-C-N 124.133 1.596 . . . . 0.0 110.723 -179.636 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -65.31 -44.67 87.12 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.164 -0.96 . . . . 0.0 110.585 -179.73 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.519 ' CG ' ' HG2' ' A' ' 34' ' ' PRO . 28.6 mm100 -69.33 -38.11 78.03 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.157 -0.965 . . . . 0.0 110.549 -179.66 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.518 ' CB ' ' HA ' ' A' ' 30' ' ' ARG . . . -56.38 -42.55 78.06 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.212 -0.93 . . . . 0.0 110.549 -179.902 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 40.0 tt0 -64.27 -45.01 89.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.116 -0.99 . . . . 0.0 110.383 -179.759 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.09 -48.33 71.32 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.141 -0.974 . . . . 0.0 110.401 -179.86 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.445 ' O ' ' HG3' ' A' ' 45' ' ' MET . 54.8 m -65.75 -43.59 88.5 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.328 -0.857 . . . . 0.0 110.518 -179.846 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.454 ' CG1' ' O ' ' A' ' 38' ' ' ALA . 61.1 mt -60.26 -22.9 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.236 -0.915 . . . . 0.0 110.782 -179.56 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.96 -31.21 23.7 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.119 -0.988 . . . . 0.0 110.834 -179.509 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.566 ' HG3' ' CE1' ' A' ' 63' ' ' PHE . 0.2 OUTLIER -76.3 -65.15 0.96 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.224 -0.922 . . . . 0.0 110.589 -179.704 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.601 ' CE ' ' CB ' ' A' ' 60' ' ' TYR . 12.0 mtt -39.44 111.12 0.66 Allowed Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.379 -0.825 . . . . 0.0 110.863 -179.737 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -67.2 -155.68 0.03 OUTLIER 'Trans proline' 0 C--N 1.304 -1.775 0 O-C-N 124.018 1.536 . . . . 0.0 109.865 179.497 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -94.51 121.7 36.34 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.109 -0.994 . . . . 0.0 110.263 179.913 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -50.79 -58.78 5.11 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.375 -0.828 . . . . 0.0 110.337 -179.987 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 58.03 162.1 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.183 -0.948 . . . . 0.0 110.236 -179.957 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 164.99 -129.11 1.9 Allowed Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.962 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -92.3 2.48 3.93 Favored 'Trans proline' 0 C--N 1.305 -1.729 0 O-C-N 124.019 1.536 . . . . 0.0 110.276 179.944 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.476 ' O ' ' O ' ' A' ' 53' ' ' SER . . . 151.96 41.8 0.02 OUTLIER Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.942 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.476 ' O ' ' O ' ' A' ' 52' ' ' GLY . 12.7 p -54.39 -161.75 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.289 0 O-C-N 121.403 -1.057 . . . . 0.0 110.642 -179.633 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 30.1 m -134.22 154.29 79.94 Favored Pre-proline 0 N--CA 1.492 1.657 0 O-C-N 121.267 -0.896 . . . . 0.0 110.2 179.893 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -67.47 87.79 0.34 Allowed 'Trans proline' 0 C--N 1.305 -1.721 0 O-C-N 124.076 1.566 . . . . 0.0 110.34 -179.966 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 157.92 -27.95 0.46 Allowed Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.43 -1.468 . . . . 0.0 109.43 -179.936 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.78 107.45 4.59 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.374 -1.074 . . . . 0.0 110.151 179.974 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.514 ' HB3' ' CB ' ' A' ' 45' ' ' MET . 80.3 mt -104.11 155.72 18.47 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.211 -0.931 . . . . 0.0 110.266 179.974 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -98.97 111.14 23.62 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.249 -0.907 . . . . 0.0 110.546 -179.852 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.601 ' CB ' ' CE ' ' A' ' 45' ' ' MET . 31.7 p90 -76.22 -28.79 57.33 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.276 -0.89 . . . . 0.0 110.268 179.708 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.571 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.06 -41.41 75.02 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.233 -0.917 . . . . 0.0 110.135 -179.67 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.61 -35.56 81.17 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.238 -0.913 . . . . 0.0 109.791 179.823 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.566 ' CE1' ' HG3' ' A' ' 44' ' ' ARG . 1.5 t80 -72.28 -36.34 68.95 Favored 'General case' 0 C--N 1.298 -1.659 0 O-C-N 121.607 -0.683 . . . . 0.0 110.242 179.807 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.567 ' O ' ' CE2' ' A' ' 68' ' ' TYR . 2.7 p -63.67 -49.85 71.59 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.211 -0.93 . . . . 0.0 110.455 -179.683 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.574 ' HA ' ' CD2' ' A' ' 68' ' ' TYR . 43.3 m -60.11 -47.56 85.39 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.168 -0.957 . . . . 0.0 110.264 -179.869 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -55.98 -36.68 68.15 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.189 -0.944 . . . . 0.0 110.204 -179.971 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.527 ' CD2' ' O ' ' B' ' 19' ' ' ALA . 0.2 OUTLIER -54.73 -32.54 59.84 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.288 -0.882 . . . . 0.0 110.232 -179.952 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.636 ' CE2' ' CB ' ' A' ' 7' ' ' ALA . 1.5 m-85 -84.98 -31.78 23.36 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.238 -0.914 . . . . 0.0 110.205 -179.692 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -81.57 171.41 52.83 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.769 -1.332 . . . . 0.0 109.769 -179.81 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -115.34 6.54 14.9 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.233 -1.157 . . . . 0.0 110.218 179.928 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.4 ' O ' HD22 ' A' ' 73' ' ' LEU . 3.7 m -157.87 110.42 2.38 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.238 -0.914 . . . . 0.0 110.193 -179.961 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -92.3 139.31 30.73 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.21 -0.932 . . . . 0.0 110.254 -179.927 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.4 HD22 ' O ' ' A' ' 71' ' ' SER . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.622 0 O-C-N 121.296 -0.877 . . . . 0.0 110.194 179.922 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.322 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 1.8 pttt -94.1 50.52 1.41 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.229 -1.159 . . . . 0.0 110.185 -179.976 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.443 ' HA ' ' CG2' ' A' ' 16' ' ' ILE . 0.4 OUTLIER -63.26 -48.88 76.3 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.249 -0.907 . . . . 0.0 110.172 -179.99 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.34 -39.42 69.99 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.198 -0.939 . . . . 0.0 110.009 179.91 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -63.45 -39.78 95.39 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.314 -0.867 . . . . 0.0 110.14 179.836 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.28 -42.39 99.3 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.181 -0.949 . . . . 0.0 109.95 -179.985 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.424 ' O ' HG22 ' B' ' 17' ' ' VAL . 98.4 t -59.6 -40.4 82.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.164 -0.96 . . . . 0.0 109.712 179.5 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.41 -36.84 76.61 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.279 -0.888 . . . . 0.0 109.898 179.746 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 25.0 m -67.62 -42.77 81.85 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.275 -0.89 . . . . 0.0 110.14 179.914 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.463 ' O ' ' CG2' ' B' ' 20' ' ' VAL . 94.0 t -64.52 -40.42 88.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.299 -0.876 . . . . 0.0 110.28 179.968 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.424 HG22 ' O ' ' B' ' 13' ' ' VAL . 67.8 t -63.07 -50.19 80.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.295 -0.878 . . . . 0.0 110.51 -179.684 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.33 -39.89 94.81 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.2 -0.938 . . . . 0.0 110.716 -179.598 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.527 ' O ' ' CD2' ' A' ' 67' ' ' LEU . . . -67.28 -41.57 85.26 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.187 -0.946 . . . . 0.0 110.613 -179.509 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . 0.463 ' CG2' ' O ' ' B' ' 16' ' ' VAL . 63.7 t -67.45 -39.0 81.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.23 -0.919 . . . . 0.0 110.681 -179.526 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.02 -33.01 75.03 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.234 -0.916 . . . . 0.0 110.495 -179.744 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -56.3 -45.52 80.2 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.261 -0.899 . . . . 0.0 110.459 -179.702 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.87 -38.4 88.7 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.196 -0.94 . . . . 0.0 110.422 -179.768 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 8.4 ttt-85 -67.09 -47.93 69.74 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.193 -0.942 . . . . 0.0 110.21 -179.867 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . 0.42 ' O ' HG11 ' B' ' 25' ' ' VAL . 89.7 t -64.23 -21.14 28.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.312 -0.868 . . . . 0.0 110.292 -179.867 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 25.2 ttt85 -87.78 -87.55 0.15 Allowed 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.311 -0.868 . . . . 0.0 110.165 179.962 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -100.72 134.65 20.41 Favored Pre-proline 0 C--N 1.29 -2.021 0 O-C-N 121.695 -0.628 . . . . 0.0 110.224 179.995 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -89.79 93.03 0.31 Allowed 'Trans proline' 0 C--N 1.306 -1.677 0 O-C-N 124.036 1.545 . . . . 0.0 110.408 179.975 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.156 -0.965 . . . . 0.0 110.185 179.845 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 tpp . . . . . 0 N--CA 1.49 1.573 0 CA-C-O 121.205 0.526 . . . . 0.0 110.275 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -129.71 -168.01 1.89 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.211 -0.93 . . . . 0.0 110.299 -179.935 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -147.78 -61.43 0.26 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.256 -0.902 . . . . 0.0 110.245 179.896 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.4 t -155.89 -174.41 4.95 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.23 -0.919 . . . . 0.0 110.298 179.988 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.49 ' O ' ' N ' ' A' ' 7' ' ' ALA . 8.8 p-10 -60.51 178.53 0.21 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.294 -0.878 . . . . 0.0 110.299 -179.993 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.46 ' CB ' ' O ' ' A' ' 5' ' ' ASP . 1.8 m 67.07 -58.46 0.41 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.28 -0.888 . . . . 0.0 110.128 -179.813 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.49 ' N ' ' O ' ' A' ' 5' ' ' ASP . . . -66.59 -44.51 81.98 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.279 -0.888 . . . . 0.0 109.703 179.627 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -55.74 -36.92 67.8 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.314 -0.866 . . . . 0.0 109.702 179.618 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.42 ' O ' ' OG ' ' A' ' 13' ' ' SER . 2.9 tt0 -62.12 -48.33 80.64 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.261 -0.899 . . . . 0.0 110.08 179.957 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 73.1 t -59.86 -46.83 93.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.159 -0.963 . . . . 0.0 109.89 179.864 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 79.0 mt -56.92 -48.34 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.366 -0.834 . . . . 0.0 109.607 179.586 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.428 ' O ' HG13 ' A' ' 16' ' ' ILE . . . -57.49 -39.55 76.7 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.316 -0.865 . . . . 0.0 109.095 179.172 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.457 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 1.1 m -68.79 -39.06 80.33 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.481 -0.762 . . . . 0.0 109.124 178.955 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.578 ' CE1' ' HE2' ' A' ' 45' ' ' MET . 4.9 m-85 -68.55 -45.24 72.68 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.43 -0.794 . . . . 0.0 109.793 179.425 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.3 ttt-85 -53.02 -41.09 64.36 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.299 -0.876 . . . . 0.0 109.495 179.496 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.532 HG22 HD11 ' A' ' 16' ' ' ILE . 42.0 mt -63.47 -43.79 98.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.272 -0.892 . . . . 0.0 109.985 179.723 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 13' ' ' SER . 75.8 mt -62.98 -41.71 99.63 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.109 -0.995 . . . . 0.0 109.691 179.561 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.466 ' HB2' ' O ' ' A' ' 23' ' ' TYR . . . -75.77 1.14 15.6 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.342 -0.849 . . . . 0.0 110.132 179.757 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.463 ' O ' ' CB ' ' A' ' 20' ' ' ASP . 0.1 OUTLIER 66.69 55.16 0.79 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.177 -0.952 . . . . 0.0 110.099 -179.897 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.463 ' CB ' ' O ' ' A' ' 19' ' ' SER . 13.6 t0 65.82 65.02 0.54 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.241 -0.912 . . . . 0.0 110.14 -179.97 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.402 ' HG2' ' O ' ' A' ' 20' ' ' ASP . 26.8 mttt -148.79 143.76 17.52 Favored Pre-proline 0 N--CA 1.49 1.537 0 O-C-N 121.255 -0.903 . . . . 0.0 110.145 -179.968 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.546 ' O ' ' CD1' ' A' ' 23' ' ' TYR . 11.3 Cg_endo -73.32 -0.73 9.6 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 O-C-N 124.083 1.57 . . . . 0.0 110.068 179.495 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.546 ' CD1' ' O ' ' A' ' 22' ' ' PRO . 25.9 m-85 -139.98 158.85 43.41 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.247 -0.908 . . . . 0.0 109.842 179.863 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.523 ' CG2' HD12 ' A' ' 58' ' ' LEU . 0.4 OUTLIER -124.39 150.77 29.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.115 -0.991 . . . . 0.0 109.942 179.984 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.515 ' N ' HD11 ' A' ' 24' ' ' ILE . 15.6 mt -92.74 145.61 24.28 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.067 -1.021 . . . . 0.0 110.26 -179.842 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.45 -45.39 80.84 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.221 -0.924 . . . . 0.0 110.278 -179.862 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -61.14 -35.7 77.79 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.208 -0.932 . . . . 0.0 109.917 179.871 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 25' ' ' LEU . 21.9 mm-40 -60.15 -45.2 93.86 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.344 -0.847 . . . . 0.0 109.796 179.795 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 26.2 mt -63.15 -34.27 77.26 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.359 -0.838 . . . . 0.0 109.827 179.68 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.497 ' HA ' ' CB ' ' A' ' 38' ' ' ALA . 24.3 mtt-85 -68.88 -38.26 79.58 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.356 -0.84 . . . . 0.0 110.219 -179.927 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.5 -26.24 18.04 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.291 -0.881 . . . . 0.0 110.831 -179.568 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -89.88 -23.74 21.56 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.098 -1.001 . . . . 0.0 110.658 -179.69 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.559 ' CD2' ' CG2' ' B' ' 17' ' ' VAL . 1.3 mt -128.73 155.85 78.53 Favored Pre-proline 0 N--CA 1.488 1.451 0 O-C-N 121.19 -0.944 . . . . 0.0 110.056 -179.797 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.457 ' HD2' ' CD2' ' A' ' 33' ' ' LEU . 47.9 Cg_exo -52.56 144.4 41.86 Favored 'Trans proline' 0 C--N 1.304 -1.793 0 O-C-N 124.009 1.531 . . . . 0.0 110.302 179.972 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -41.87 -45.13 6.92 Favored 'Trans proline' 0 C--N 1.305 -1.744 0 O-C-N 124.003 1.528 . . . . 0.0 110.589 -179.842 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -58.36 -43.66 88.49 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.196 -0.94 . . . . 0.0 110.434 -179.771 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.525 ' CB ' HD21 ' A' ' 33' ' ' LEU . 75.3 mm-40 -68.97 -40.75 78.65 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.213 -0.929 . . . . 0.0 110.16 -179.959 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.497 ' CB ' ' HA ' ' A' ' 30' ' ' ARG . . . -56.54 -47.13 80.08 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.299 -0.876 . . . . 0.0 110.39 -179.956 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.2 tp60 -65.85 -46.72 77.43 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.159 -0.963 . . . . 0.0 110.252 -179.858 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -64.04 -48.01 77.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.28 -0.887 . . . . 0.0 110.209 -179.96 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.419 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 77.5 m -65.13 -47.7 76.19 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.219 -0.926 . . . . 0.0 110.159 -179.946 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 54.5 mt -58.34 -23.49 22.34 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.255 -0.903 . . . . 0.0 110.234 179.935 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.48 -41.31 16.7 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.242 -0.912 . . . . 0.0 110.33 -179.809 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.63 ' CB ' ' CD2' ' A' ' 63' ' ' PHE . 1.0 OUTLIER -64.11 -73.93 0.11 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.109 -0.994 . . . . 0.0 109.975 -179.916 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.606 ' CG ' ' HA ' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -38.47 117.21 0.96 Allowed Pre-proline 0 N--CA 1.488 1.427 0 O-C-N 121.382 -0.824 . . . . 0.0 111.473 179.847 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_endo -72.39 -154.47 0.04 OUTLIER 'Trans proline' 0 C--N 1.302 -1.871 0 O-C-N 123.829 1.436 . . . . 0.0 108.51 178.33 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.435 ' O ' ' C ' ' A' ' 48' ' ' TYR . . . -100.43 115.6 30.43 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.77 -1.206 . . . . 0.0 110.176 179.653 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.487 ' CE1' ' CZ ' ' A' ' 23' ' ' TYR . 3.7 t80 -39.65 -60.02 1.04 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.565 -0.709 . . . . 0.0 110.295 -179.946 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 61.91 160.31 0.07 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.191 -0.943 . . . . 0.0 110.07 -179.875 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 148.07 -159.02 27.9 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 179.996 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -71.06 83.57 0.93 Allowed 'Trans proline' 0 C--N 1.305 -1.721 0 O-C-N 123.97 1.511 . . . . 0.0 110.207 179.93 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.498 ' O ' ' O ' ' A' ' 53' ' ' SER . . . 109.84 -89.47 0.55 Allowed Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.918 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.498 ' O ' ' O ' ' A' ' 52' ' ' GLY . 0.7 OUTLIER 49.78 169.63 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.287 0 O-C-N 121.579 -0.953 . . . . 0.0 111.17 179.38 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 28.8 m -145.73 154.93 52.46 Favored Pre-proline 0 C--N 1.299 -1.601 0 O-C-N 121.32 -0.863 . . . . 0.0 110.262 -179.636 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -63.92 84.67 0.14 Allowed 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 124.01 1.532 . . . . 0.0 110.305 179.877 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.456 ' O ' HD22 ' A' ' 58' ' ' LEU . . . 169.44 -37.21 0.19 Allowed Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 -179.987 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -77.31 110.99 12.5 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.189 -1.183 . . . . 0.0 110.207 -179.886 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.523 HD12 ' CG2' ' A' ' 24' ' ' ILE . 0.6 OUTLIER -114.89 160.87 19.0 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.318 -0.864 . . . . 0.0 110.131 179.874 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -99.47 115.86 30.27 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.306 -0.871 . . . . 0.0 111.45 -179.17 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.606 ' HA ' ' CG ' ' A' ' 45' ' ' MET . 9.1 p90 -78.43 -21.66 48.87 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.429 -0.794 . . . . 0.0 110.145 179.114 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.564 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.85 -33.11 64.23 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.212 -0.93 . . . . 0.0 109.753 179.973 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.434 ' O ' ' CB ' ' A' ' 66' ' ' ALA . . . -65.2 -32.36 74.0 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.284 -0.885 . . . . 0.0 109.486 179.451 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.63 ' CD2' ' CB ' ' A' ' 44' ' ' ARG . 5.9 t80 -65.89 -41.94 90.92 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.742 -0.599 . . . . 0.0 110.223 179.884 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 70.1 p -68.52 -49.58 58.54 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.269 -0.895 . . . . 0.0 110.37 -179.854 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.9 m -68.51 -35.5 77.58 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.273 -0.892 . . . . 0.0 110.381 -179.881 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.434 ' CB ' ' O ' ' A' ' 62' ' ' ALA . . . -67.08 -44.01 81.14 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.241 -0.912 . . . . 0.0 110.386 -179.838 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.472 ' N ' HD21 ' A' ' 67' ' ' LEU . 3.6 mm? -68.39 -41.93 79.81 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.179 -0.951 . . . . 0.0 110.633 -179.745 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -98.98 15.37 25.95 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.068 -1.02 . . . . 0.0 110.56 -179.759 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -55.27 123.2 29.07 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.346 -1.501 . . . . 0.0 109.346 179.879 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -159.23 105.94 1.74 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.23 -1.159 . . . . 0.0 110.342 -179.966 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 66.8 m 43.75 48.01 6.7 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.268 -0.895 . . . . 0.0 110.34 179.977 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -65.85 132.22 48.16 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.168 -0.958 . . . . 0.0 110.183 179.89 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.611 0 O-C-N 121.222 -0.923 . . . . 0.0 110.243 -179.953 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 7' ' ' GLY . . . . . 0.5 ' O ' ' N ' ' B' ' 9' ' ' LYS . . . . . . . . 0 N--CA 1.489 2.194 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 . . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.442 ' CB ' ' O ' ' B' ' 7' ' ' GLY . 4.0 tptp 66.29 -63.95 0.23 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.29 -1.123 . . . . 0.0 110.16 179.966 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.5 ' N ' ' O ' ' B' ' 7' ' ' GLY . 7.7 ttmt -66.87 -37.51 84.56 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.251 -0.906 . . . . 0.0 110.184 179.993 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.65 -37.24 80.85 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.249 -0.907 . . . . 0.0 110.09 179.855 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -66.02 -41.77 90.52 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.295 -0.878 . . . . 0.0 109.97 179.895 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . 0.438 ' HB1' HD13 ' A' ' 16' ' ' ILE . . . -65.59 -40.03 92.24 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.402 -0.811 . . . . 0.0 109.958 179.752 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 57.5 t -59.72 -44.83 94.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.352 -0.843 . . . . 0.0 110.077 179.751 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.62 -39.23 93.14 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.147 -0.971 . . . . 0.0 109.946 179.875 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.71 -47.61 80.41 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.357 -0.839 . . . . 0.0 110.07 179.864 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 58.8 t -63.65 -45.51 97.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.285 -0.884 . . . . 0.0 110.028 179.884 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.559 ' CG2' ' CD2' ' A' ' 33' ' ' LEU . 24.2 t -60.74 -50.87 78.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.3 -0.875 . . . . 0.0 110.003 179.891 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.96 -40.91 67.24 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.271 -0.893 . . . . 0.0 110.091 179.815 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.79 -45.54 78.09 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.266 -0.896 . . . . 0.0 110.023 179.853 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 42.5 t -67.21 -43.1 88.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.287 -0.883 . . . . 0.0 110.049 179.855 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -57.3 -37.38 72.35 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.278 -0.888 . . . . 0.0 110.053 179.966 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -49.03 76.89 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.29 -0.881 . . . . 0.0 110.143 -179.987 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.04 -36.06 74.38 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.221 -0.924 . . . . 0.0 110.11 -179.927 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.66 -37.57 87.82 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.319 -0.863 . . . . 0.0 110.08 179.849 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 25.2 t -60.04 -21.41 21.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.253 -0.904 . . . . 0.0 110.034 179.897 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 55.52 56.69 6.01 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.389 -0.819 . . . . 0.0 110.379 179.79 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.54 151.0 80.06 Favored Pre-proline 0 N--CA 1.489 1.484 0 O-C-N 121.202 -0.937 . . . . 0.0 110.118 179.901 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -71.54 148.86 54.68 Favored 'Trans proline' 0 C--N 1.306 -1.673 0 O-C-N 123.911 1.48 . . . . 0.0 110.287 -179.965 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 28.8 ttp85 . . . . . 0 N--CA 1.492 1.641 0 O-C-N 121.245 -0.91 . . . . 0.0 110.204 179.934 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 121.145 0.498 . . . . 0.0 110.206 . . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -172.08 73.56 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.254 -0.904 . . . . 0.0 110.38 179.948 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.424 ' O ' ' O ' ' A' ' 4' ' ' THR . 30.1 t70 -160.86 66.53 0.31 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.216 -0.928 . . . . 0.0 110.309 179.775 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.424 ' O ' ' O ' ' A' ' 3' ' ' ASP . 0.2 OUTLIER 58.29 111.15 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.198 -0.939 . . . . 0.0 110.123 -179.982 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.407 ' HB3' ' HB3' ' A' ' 8' ' ' GLU . 32.6 t0 -148.45 162.25 39.98 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.285 -0.884 . . . . 0.0 110.266 -179.935 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.512 ' CG2' ' CZ ' ' A' ' 68' ' ' TYR . 2.5 m -98.63 -41.91 7.5 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.303 -0.873 . . . . 0.0 110.304 -179.937 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.38 -47.4 76.5 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.239 -0.913 . . . . 0.0 109.867 179.896 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.407 ' HB3' ' HB3' ' A' ' 5' ' ' ASP . 37.8 tt0 -56.02 -35.54 66.95 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.402 -0.811 . . . . 0.0 109.993 179.626 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 16.7 tp60 -60.62 -38.94 86.4 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.191 -0.943 . . . . 0.0 109.841 -179.931 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.564 HG11 ' CD2' ' A' ' 14' ' ' PHE . 53.9 t -61.16 -41.03 87.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.162 -0.961 . . . . 0.0 109.192 179.242 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 11.9 mm -55.26 -49.78 69.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.351 -0.843 . . . . 0.0 109.615 179.452 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.83 -43.61 94.48 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.362 -0.836 . . . . 0.0 109.324 179.331 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.7 m -66.69 -40.56 88.57 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.383 -0.823 . . . . 0.0 109.314 179.215 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.565 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 1.2 m-85 -68.38 -40.92 81.24 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.333 -0.855 . . . . 0.0 109.587 179.323 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.08 -50.19 64.9 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.362 -0.836 . . . . 0.0 109.561 179.538 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.434 HG23 ' HA ' ' B' ' 9' ' ' LYS . 68.1 mt -60.06 -40.88 84.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.295 -0.878 . . . . 0.0 109.711 179.424 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.06 -36.2 83.6 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.396 -0.815 . . . . 0.0 109.894 179.684 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.474 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -89.67 8.22 32.66 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.344 -0.847 . . . . 0.0 110.172 -179.912 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.474 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.4 OUTLIER 67.75 55.66 0.59 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.196 -0.94 . . . . 0.0 110.254 179.991 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.425 ' N ' ' OD1' ' A' ' 20' ' ' ASP . 5.8 m-20 52.28 56.67 7.39 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.285 -0.884 . . . . 0.0 110.397 179.733 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.436 ' HG3' ' O ' ' A' ' 19' ' ' SER . 68.2 mttt -138.52 140.39 27.76 Favored Pre-proline 0 N--CA 1.49 1.551 0 O-C-N 121.19 -0.944 . . . . 0.0 109.951 179.777 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.61 -11.76 18.48 Favored 'Trans proline' 0 C--N 1.305 -1.749 0 O-C-N 124.051 1.553 . . . . 0.0 110.11 179.901 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.427 ' O ' ' HB2' ' A' ' 18' ' ' ALA . 47.8 p90 -135.46 171.25 14.71 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.264 -0.897 . . . . 0.0 110.05 179.805 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.454 ' HB ' ' HB2' ' A' ' 18' ' ' ALA . 8.9 tt -146.72 158.01 10.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.231 -0.918 . . . . 0.0 110.241 -179.917 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.5 mp -91.25 145.14 24.91 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.226 -0.921 . . . . 0.0 110.197 -179.939 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.522 ' HA ' ' CD2' ' A' ' 29' ' ' LEU . . . -59.7 -39.52 84.86 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.303 -0.873 . . . . 0.0 110.328 -179.955 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.73 -35.88 81.14 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.183 -0.948 . . . . 0.0 109.921 179.742 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -69.61 -51.17 37.52 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.338 -0.851 . . . . 0.0 109.554 179.65 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.522 ' CD2' ' HA ' ' A' ' 26' ' ' ALA . 1.7 pp -67.75 -33.53 75.04 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.31 -0.869 . . . . 0.0 109.595 179.192 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.532 ' HA ' ' CB ' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -62.89 -34.47 77.48 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.352 -0.842 . . . . 0.0 110.132 179.79 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -83.68 -31.38 26.16 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.252 -0.905 . . . . 0.0 110.173 179.93 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -76.4 -23.6 54.03 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.266 -0.896 . . . . 0.0 110.287 -179.944 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.542 ' CD2' ' HB3' ' A' ' 37' ' ' GLN . 1.4 mt -112.92 151.3 43.96 Favored Pre-proline 0 C--N 1.305 -1.357 0 O-C-N 121.197 -0.939 . . . . 0.0 110.061 -179.929 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.457 ' CB ' ' HD2' ' A' ' 35' ' ' PRO . 35.2 Cg_exo -55.0 172.28 0.39 Allowed 'Trans proline' 0 C--N 1.304 -1.815 0 O-C-N 124.033 1.544 . . . . 0.0 110.232 179.946 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.457 ' HD2' ' CB ' ' A' ' 34' ' ' PRO . 30.8 Cg_endo -59.02 -45.8 26.14 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 123.952 1.501 . . . . 0.0 110.311 -179.83 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -66.3 -43.02 87.45 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.323 -0.861 . . . . 0.0 110.77 -179.807 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.542 ' HB3' ' CD2' ' A' ' 33' ' ' LEU . 4.1 mp0 -69.63 -42.64 74.05 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.156 -0.965 . . . . 0.0 110.381 -179.616 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.532 ' CB ' ' HA ' ' A' ' 30' ' ' ARG . . . -57.26 -48.66 78.29 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.297 -0.877 . . . . 0.0 110.36 -179.726 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 14.2 tm0? -66.82 -43.32 84.06 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.261 -0.899 . . . . 0.0 110.777 -179.78 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -64.91 -42.32 94.82 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.104 -0.997 . . . . 0.0 110.503 -179.521 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.481 ' O ' ' HG2' ' A' ' 45' ' ' MET . 73.6 m -65.22 -51.32 61.68 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.111 -0.993 . . . . 0.0 110.709 -179.687 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.411 HG13 HD12 ' A' ' 29' ' ' LEU . 50.6 mt -53.72 -23.6 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.181 -0.95 . . . . 0.0 110.757 -179.588 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.36 -19.14 31.89 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.117 -0.989 . . . . 0.0 110.649 -179.65 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.594 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 18.4 mmt180 -89.56 -69.99 0.69 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.228 -0.92 . . . . 0.0 110.834 -179.495 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.517 ' CB ' ' O ' ' A' ' 59' ' ' ASP . 9.4 ptp -46.89 110.02 1.18 Allowed Pre-proline 0 N--CA 1.488 1.464 0 O-C-N 121.136 -0.978 . . . . 0.0 110.639 -179.408 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.526 ' HD2' ' CB ' ' A' ' 62' ' ' ALA . 9.6 Cg_endo -63.37 -157.64 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.622 0 O-C-N 124.132 1.596 . . . . 0.0 110.184 179.882 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.45 ' O ' ' C ' ' A' ' 48' ' ' TYR . . . -75.57 128.77 35.99 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.22 -0.925 . . . . 0.0 110.369 -179.794 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.581 ' CE2' ' HB2' ' A' ' 53' ' ' SER . 28.7 p90 -39.24 -39.93 0.69 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.536 -0.727 . . . . 0.0 110.502 179.858 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.52 ' N ' ' CG ' ' A' ' 48' ' ' TYR . 0.1 OUTLIER 60.47 93.1 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.205 -0.935 . . . . 0.0 110.204 -179.943 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -165.26 179.1 39.95 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 -179.919 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -87.66 -66.76 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.759 0 O-C-N 124.096 1.577 . . . . 0.0 110.195 179.954 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.481 ' O ' ' O ' ' A' ' 53' ' ' SER . . . -81.88 61.92 4.6 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 179.896 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.581 ' HB2' ' CE2' ' A' ' 48' ' ' TYR . 38.8 t -54.5 -159.93 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.387 -1.067 . . . . 0.0 111.011 -179.53 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.528 ' CG2' ' HB3' ' A' ' 57' ' ' ALA . 15.7 m -155.64 169.47 10.32 Favored Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.424 -0.798 . . . . 0.0 109.795 179.836 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.463 ' HD2' ' HB ' ' A' ' 54' ' ' VAL . 2.7 Cg_endo -52.22 87.94 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.754 0 O-C-N 123.946 1.498 . . . . 0.0 110.224 179.861 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.519 ' N ' ' O ' ' A' ' 54' ' ' VAL . . . 73.54 94.11 0.11 Allowed Glycine 0 N--CA 1.492 2.382 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 -179.975 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.537 ' HB2' ' CG ' ' A' ' 48' ' ' TYR . . . -121.12 140.75 51.55 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.276 -1.131 . . . . 0.0 110.575 -179.973 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.3 mt -129.88 160.39 33.67 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.374 -0.829 . . . . 0.0 109.81 179.582 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.517 ' O ' ' CB ' ' A' ' 45' ' ' MET . 1.3 t70 -110.39 110.76 21.66 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.063 -1.023 . . . . 0.0 110.673 -179.789 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.565 ' HB2' ' CD2' ' A' ' 14' ' ' PHE . 40.6 p90 -75.86 -24.24 55.73 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.211 -0.931 . . . . 0.0 109.33 179.231 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.404 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -62.54 -44.4 96.45 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.469 -0.769 . . . . 0.0 109.617 179.67 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.526 ' CB ' ' HD2' ' A' ' 46' ' ' PRO . . . -61.56 -32.81 72.91 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.254 -0.904 . . . . 0.0 109.917 179.682 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.594 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 1.2 t80 -71.4 -39.78 70.94 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.52 -0.737 . . . . 0.0 110.241 179.881 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.466 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 3.6 t -61.05 -50.1 74.7 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.264 -0.898 . . . . 0.0 110.609 -179.69 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.43 -35.3 77.41 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.216 -0.928 . . . . 0.0 110.447 -179.783 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.0 -46.3 68.35 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.208 -0.933 . . . . 0.0 110.786 -179.542 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.564 HD13 ' CG ' ' A' ' 68' ' ' TYR . 2.5 pp -70.84 -33.01 70.21 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.097 -1.002 . . . . 0.0 110.752 -179.477 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.564 ' CG ' HD13 ' A' ' 67' ' ' LEU . 0.4 OUTLIER -99.55 7.73 45.07 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.26 -0.9 . . . . 0.0 110.391 179.975 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -116.75 133.36 10.64 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 -179.995 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -106.74 175.35 5.53 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.268 -1.136 . . . . 0.0 110.19 179.998 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -82.96 -33.74 26.61 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.269 -0.895 . . . . 0.0 110.162 179.994 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -98.38 119.72 37.56 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.229 -0.919 . . . . 0.0 110.2 -179.926 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.579 0 O-C-N 121.16 -0.963 . . . . 0.0 110.124 179.938 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.251 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -164.64 40.23 0.08 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.242 -1.152 . . . . 0.0 110.139 179.901 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.434 ' HA ' HG23 ' A' ' 16' ' ' ILE . 1.5 tttp -62.26 -48.84 78.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.244 -0.91 . . . . 0.0 110.089 179.892 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.67 -45.55 77.71 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.329 -0.857 . . . . 0.0 110.213 179.881 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -63.45 -41.13 98.65 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.317 -0.864 . . . . 0.0 110.068 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.25 -33.7 76.07 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.309 -0.869 . . . . 0.0 110.167 -179.965 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 58.6 t -64.36 -41.96 93.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.278 -0.889 . . . . 0.0 110.093 -179.973 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.04 -35.65 79.23 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.228 -0.92 . . . . 0.0 110.415 -179.974 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 28.7 m -62.31 -44.01 97.5 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.175 -0.953 . . . . 0.0 110.522 -179.862 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 84.2 t -68.74 -42.54 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.201 -0.937 . . . . 0.0 110.578 -179.728 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 89.9 t -58.28 -44.83 88.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.098 -1.001 . . . . 0.0 110.503 -179.86 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.91 -38.49 91.27 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.316 -0.865 . . . . 0.0 110.285 -179.823 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.99 -46.06 82.99 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.169 -0.957 . . . . 0.0 110.39 -179.935 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 76.1 t -65.45 -42.33 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.239 -0.913 . . . . 0.0 110.309 -179.86 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -58.48 -41.62 85.68 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.25 -0.906 . . . . 0.0 110.202 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . 0.45 ' O ' HG11 ' B' ' 25' ' ' VAL . 3.5 tm0? -60.49 -47.84 84.38 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.219 -0.925 . . . . 0.0 110.005 -179.944 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.88 -35.09 80.01 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.296 -0.877 . . . . 0.0 110.195 179.875 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . 0.449 ' NH1' ' HG2' ' B' ' 24' ' ' ARG . 17.8 ttp85 -63.62 -45.27 91.08 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.233 -0.917 . . . . 0.0 110.456 -179.857 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . 0.51 HG11 ' N ' ' B' ' 26' ' ' ARG . 2.7 p -62.71 -20.8 26.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.178 -0.952 . . . . 0.0 110.306 -179.881 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.51 ' N ' HG11 ' B' ' 25' ' ' VAL . 1.2 mtm180 -93.22 -45.62 7.77 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-O 122.001 0.905 . . . . 0.0 110.677 -179.649 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . 0.421 ' HA ' ' HD3' ' B' ' 28' ' ' PRO . 39.2 tt0 -90.12 133.61 33.18 Favored Pre-proline 0 C--N 1.285 -2.197 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.281 -179.61 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' B' ' 27' ' ' GLU . 3.1 Cg_exo -82.56 118.02 2.79 Favored 'Trans proline' 0 C--N 1.306 -1.682 0 O-C-N 124.044 1.549 . . . . 0.0 110.184 179.981 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.139 -0.976 . . . . 0.0 110.225 179.971 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.517 HG22 ' CE2' ' A' ' 68' ' ' TYR . 1.6 m . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.099 0.476 . . . . 0.0 110.107 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -70.28 -44.23 68.81 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.074 -1.017 . . . . 0.0 109.476 179.42 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -62.02 -36.09 80.51 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.471 -0.768 . . . . 0.0 109.906 179.449 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -60.79 -43.08 98.58 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.33 -0.856 . . . . 0.0 110.097 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.518 HG12 ' HD2' ' A' ' 14' ' ' PHE . 62.0 t -66.06 -42.81 92.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.116 -0.99 . . . . 0.0 109.631 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.615 HG23 ' HE1' ' A' ' 60' ' ' TYR . 61.9 mt -61.45 -49.67 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.298 -0.876 . . . . 0.0 109.318 179.314 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.65 -39.09 92.79 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.377 -0.827 . . . . 0.0 109.228 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.2 m -68.18 -44.18 76.47 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.41 -0.806 . . . . 0.0 109.479 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.57 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 0.6 OUTLIER -65.7 -42.59 91.01 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.307 -0.87 . . . . 0.0 109.497 179.386 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.19 -42.91 70.22 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.343 -0.848 . . . . 0.0 109.416 179.308 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 17.0 mt -60.55 -44.85 97.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.35 -0.843 . . . . 0.0 109.583 179.509 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.859 HD12 ' HB3' ' A' ' 32' ' ' GLU . 2.5 mm? -65.09 -40.67 94.94 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.359 -0.838 . . . . 0.0 109.966 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.826 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -75.51 1.3 14.53 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.298 -0.876 . . . . 0.0 110.311 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.478 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.1 OUTLIER 67.0 69.18 0.4 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.209 -0.932 . . . . 0.0 110.303 179.866 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 47.04 56.21 7.07 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.243 -0.911 . . . . 0.0 110.28 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.538 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 18.5 mttp -134.34 143.49 47.12 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.16 -0.963 . . . . 0.0 110.023 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -73.83 -0.05 8.91 Favored 'Trans proline' 0 C--N 1.304 -1.815 0 O-C-N 124.04 1.547 . . . . 0.0 110.122 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.538 ' CZ ' ' HD3' ' A' ' 21' ' ' LYS . 23.1 p90 -145.94 163.18 35.96 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.237 -0.914 . . . . 0.0 110.22 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.826 HG12 ' HB2' ' A' ' 18' ' ' ALA . 0.3 OUTLIER -127.07 142.14 44.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.301 -0.874 . . . . 0.0 109.735 179.89 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.485 ' H ' HD13 ' A' ' 24' ' ' ILE . 44.1 mt -88.59 152.26 21.95 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.242 -0.911 . . . . 0.0 110.352 -179.653 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.26 -44.32 95.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.36 -0.837 . . . . 0.0 110.069 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -60.19 -34.97 74.35 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.365 -0.834 . . . . 0.0 110.242 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.466 ' HB3' HD11 ' A' ' 24' ' ' ILE . 9.0 mm-40 -61.87 -49.59 75.65 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.23 -0.919 . . . . 0.0 109.931 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.468 HD21 HG13 ' A' ' 24' ' ' ILE . 9.1 mt -59.53 -34.17 72.3 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.264 -0.898 . . . . 0.0 109.814 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.17 -42.26 93.86 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.329 -0.857 . . . . 0.0 110.174 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -91.33 -20.36 21.94 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.198 -0.938 . . . . 0.0 110.456 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.859 ' HB3' HD12 ' A' ' 17' ' ' LEU . 17.0 mm-40 -98.68 -23.76 15.32 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.08 -1.012 . . . . 0.0 110.409 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.432 HD22 ' HB3' ' A' ' 37' ' ' GLN . 0.3 OUTLIER -128.16 147.72 64.65 Favored Pre-proline 0 N--CA 1.487 1.393 0 O-C-N 121.165 -0.959 . . . . 0.0 110.066 179.962 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.497 ' O ' ' N ' ' A' ' 37' ' ' GLN . 5.9 Cg_exo -43.59 131.03 7.32 Favored 'Trans proline' 0 C--N 1.304 -1.782 0 O-C-N 123.89 1.469 . . . . 0.0 109.679 179.402 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.429 ' C ' ' O ' ' A' ' 34' ' ' PRO . 12.0 Cg_exo -36.8 -42.38 0.77 Allowed 'Trans proline' 0 C--N 1.306 -1.67 0 O-C-N 124.254 1.66 . . . . 0.0 110.619 -179.392 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -65.94 -36.64 83.89 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.352 -0.843 . . . . 0.0 110.857 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.665 ' HG3' HG11 ' B' ' 20' ' ' VAL . 1.8 mp0 -69.09 -44.5 72.35 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.064 -1.023 . . . . 0.0 110.784 -179.262 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.734 ' O ' HD12 ' A' ' 42' ' ' ILE . . . -58.66 -47.24 85.14 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.195 -0.94 . . . . 0.0 110.707 -179.564 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.4 tp60 -60.3 -49.43 77.63 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.227 -0.92 . . . . 0.0 110.995 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 51.6 t80 -61.84 -48.0 82.55 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.009 -1.057 . . . . 0.0 110.436 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.447 ' O ' ' SD ' ' A' ' 45' ' ' MET . 69.8 m -65.35 -49.51 69.08 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.256 -0.902 . . . . 0.0 110.64 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.734 HD12 ' O ' ' A' ' 38' ' ' ALA . 18.6 mt -44.45 -24.66 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.12 -0.988 . . . . 0.0 110.535 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -84.15 -41.28 17.22 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.173 -0.955 . . . . 0.0 110.743 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.532 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 1.5 mmt-85 -64.11 -72.62 0.14 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.12 -0.987 . . . . 0.0 110.59 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.468 ' CB ' ' O ' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -48.01 116.9 5.1 Favored Pre-proline 0 N--CA 1.489 1.475 0 O-C-N 121.14 -0.975 . . . . 0.0 110.394 -179.841 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.581 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 10.5 Cg_endo . . . . . 0 C--N 1.305 -1.728 0 O-C-N 124.14 1.6 . . . . 0.0 110.45 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.794 ' O ' HD23 ' A' ' 58' ' ' LEU . . . . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 121.252 0.549 . . . . 0.0 110.194 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.794 HD23 ' O ' ' A' ' 57' ' ' ALA . 25.1 mt -135.88 147.54 48.23 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.197 -0.94 . . . . 0.0 110.147 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.468 ' O ' ' CB ' ' A' ' 45' ' ' MET . 0.7 OUTLIER -103.37 111.83 24.43 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.19 -0.944 . . . . 0.0 110.291 179.916 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.615 ' HE1' HG23 ' A' ' 11' ' ' ILE . 8.0 p90 -81.66 -19.81 40.9 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.275 -0.89 . . . . 0.0 109.63 179.534 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.53 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -61.48 -40.76 95.73 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.415 -0.803 . . . . 0.0 109.853 179.787 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.581 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -66.53 -36.21 82.13 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.211 -0.931 . . . . 0.0 109.662 179.645 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.532 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 2.4 t80 -72.07 -34.75 68.95 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.722 -0.611 . . . . 0.0 110.18 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.3 p -60.91 -42.4 97.98 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.331 -0.856 . . . . 0.0 110.38 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 8.5 t -64.14 -36.86 85.43 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.218 -0.926 . . . . 0.0 110.486 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.7 -41.0 84.28 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.211 -0.931 . . . . 0.0 110.473 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.5 -44.07 89.32 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.208 -0.933 . . . . 0.0 110.187 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.517 ' CE2' HG22 ' A' ' 6' ' ' THR . 39.4 m-85 . . . . . 0 N--CA 1.49 1.531 0 O-C-N 121.237 -0.914 . . . . 0.0 110.473 -179.772 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 5.6 tttt . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.194 0.521 . . . . 0.0 110.072 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 14.5 tttt -67.86 -46.71 70.96 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.297 -0.877 . . . . 0.0 110.148 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.1 -41.08 71.18 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.259 -0.901 . . . . 0.0 109.816 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -60.55 -40.3 91.09 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.299 -0.876 . . . . 0.0 109.71 179.548 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 12' ' ' ALA . . . . . 0.538 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -63.19 -42.12 99.28 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.425 -0.797 . . . . 0.0 110.028 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.777 ' O ' HG23 ' B' ' 17' ' ' VAL . 46.6 t -61.28 -40.59 86.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.212 -0.93 . . . . 0.0 109.703 179.654 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.0 -39.24 77.78 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.259 -0.901 . . . . 0.0 109.499 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.7 m -68.82 -47.21 66.63 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.384 -0.822 . . . . 0.0 109.576 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.622 ' O ' HG23 ' B' ' 20' ' ' VAL . 26.4 t -63.46 -45.54 97.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.316 -0.865 . . . . 0.0 109.595 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.777 HG23 ' O ' ' B' ' 13' ' ' VAL . 49.4 t -62.45 -49.68 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.263 -0.898 . . . . 0.0 109.437 179.283 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.1 -43.07 77.74 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.363 -0.836 . . . . 0.0 109.924 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.18 -36.75 82.45 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.278 -0.888 . . . . 0.0 109.906 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.665 HG11 ' HG3' ' A' ' 37' ' ' GLN . 55.4 t -65.29 -41.43 91.39 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 121.187 -0.946 . . . . 0.0 109.713 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.3 -31.66 72.29 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.349 -0.844 . . . . 0.0 110.129 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.25 -51.23 70.84 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.232 -0.917 . . . . 0.0 110.087 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.26 -34.36 77.83 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.223 -0.923 . . . . 0.0 109.858 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.3 ttt180 . . . . . 0 N--CA 1.492 1.652 0 O-C-N 121.405 -0.809 . . . . 0.0 110.474 -179.811 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.676 HG21 ' CE1' ' A' ' 68' ' ' TYR . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 121.28 0.562 . . . . 0.0 110.245 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.33 -47.45 76.48 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.287 -0.883 . . . . 0.0 109.866 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -54.59 -36.34 64.31 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.382 -0.824 . . . . 0.0 109.828 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.415 ' O ' ' OG ' ' A' ' 13' ' ' SER . 4.2 tp60 -61.63 -48.05 82.63 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.322 -0.861 . . . . 0.0 110.151 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.477 HG12 ' CD2' ' A' ' 14' ' ' PHE . 12.6 t -64.3 -43.08 97.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.139 -0.975 . . . . 0.0 109.9 179.804 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 30.6 mt -62.0 -48.31 89.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 121.273 -0.892 . . . . 0.0 109.621 179.547 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.51 -41.01 79.95 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.223 -0.923 . . . . 0.0 109.006 179.257 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.449 ' HB3' HG23 ' B' ' 16' ' ' VAL . 3.7 m -68.16 -39.09 82.68 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.431 -0.793 . . . . 0.0 109.371 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.499 ' CG ' ' HB2' ' A' ' 60' ' ' TYR . 2.6 m-85 -68.58 -45.35 72.29 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.386 -0.822 . . . . 0.0 109.73 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 11.3 tpp85 -53.72 -41.18 66.74 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.345 -0.847 . . . . 0.0 109.55 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 42.5 mt -62.37 -44.54 99.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.401 -0.812 . . . . 0.0 109.922 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.661 HD22 ' HB3' ' A' ' 32' ' ' GLU . 56.8 mt -64.84 -41.75 95.48 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.344 -0.848 . . . . 0.0 109.861 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.677 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -67.86 -7.88 31.74 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.304 -0.872 . . . . 0.0 110.106 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.8 t 62.43 68.79 0.64 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.268 -0.895 . . . . 0.0 110.302 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 58.36 53.79 6.12 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.245 -0.909 . . . . 0.0 110.189 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.677 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 18.8 mtmt -141.9 143.36 28.23 Favored Pre-proline 0 N--CA 1.489 1.51 0 O-C-N 121.209 -0.932 . . . . 0.0 110.078 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -78.58 5.39 5.59 Favored 'Trans proline' 0 C--N 1.304 -1.787 0 O-C-N 124.078 1.568 . . . . 0.0 109.96 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.475 ' CD1' ' N ' ' A' ' 23' ' ' TYR . 28.9 p90 -145.3 159.83 42.43 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.279 -0.888 . . . . 0.0 109.963 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.817 HD12 HD23 ' A' ' 29' ' ' LEU . 0.3 OUTLIER -126.71 143.21 40.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.154 -0.966 . . . . 0.0 109.882 179.816 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.455 ' H ' HD13 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -100.66 150.64 22.53 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.29 -0.881 . . . . 0.0 110.407 -179.756 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.0 -33.12 66.83 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.283 -0.886 . . . . 0.0 109.74 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -61.53 -40.07 93.32 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.335 -0.853 . . . . 0.0 109.67 179.691 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.503 ' HB3' HD11 ' A' ' 24' ' ' ILE . 0.6 OUTLIER -68.56 -48.44 64.27 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.389 -0.819 . . . . 0.0 109.794 179.568 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.956 ' CD1' HD12 ' A' ' 33' ' ' LEU . 4.3 mm? -60.78 -34.24 74.2 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.198 -0.939 . . . . 0.0 109.738 179.612 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.0 mmm-85 -68.96 -34.72 75.8 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.36 -0.837 . . . . 0.0 110.109 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.64 -14.6 27.92 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.344 -0.847 . . . . 0.0 110.579 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.661 ' HB3' HD22 ' A' ' 17' ' ' LEU . 21.1 mm-40 -106.7 -23.53 12.4 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.078 -1.014 . . . . 0.0 110.693 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.956 HD12 ' CD1' ' A' ' 29' ' ' LEU . 6.4 mt -122.61 164.6 25.6 Favored Pre-proline 0 N--CA 1.488 1.431 0 O-C-N 121.073 -1.017 . . . . 0.0 110.249 -179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.442 ' CD ' HD23 ' A' ' 33' ' ' LEU . 33.8 Cg_exo -66.11 144.81 76.95 Favored 'Trans proline' 0 C--N 1.305 -1.761 0 O-C-N 124.036 1.545 . . . . 0.0 109.908 179.759 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.433 ' C ' ' O ' ' A' ' 34' ' ' PRO . 19.4 Cg_endo -40.48 -44.96 4.44 Favored 'Trans proline' 0 C--N 1.304 -1.802 0 O-C-N 124.032 1.543 . . . . 0.0 110.414 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.72 -37.49 86.57 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.244 -0.91 . . . . 0.0 110.729 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.522 ' HG2' HG22 ' B' ' 17' ' ' VAL . 0.0 OUTLIER -69.26 -45.83 68.76 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.137 -0.977 . . . . 0.0 110.554 -179.579 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.55 -44.21 96.39 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.156 -0.965 . . . . 0.0 110.582 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.9 tp60 -66.1 -46.53 77.3 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.096 -1.003 . . . . 0.0 110.473 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -63.28 -45.99 88.87 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.239 -0.913 . . . . 0.0 110.342 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.45 ' SG ' ' O ' ' A' ' 37' ' ' GLN . 74.9 m -60.93 -44.34 97.34 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.253 -0.904 . . . . 0.0 110.54 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 25.5 mt -53.88 -24.2 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.2 -0.937 . . . . 0.0 110.305 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.9 tttm -81.06 -19.43 43.79 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.127 -0.983 . . . . 0.0 110.227 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.591 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 26.4 mmt180 -92.24 -68.5 0.79 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.277 -0.889 . . . . 0.0 110.304 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.469 ' HB2' ' O ' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -55.55 109.6 1.73 Allowed Pre-proline 0 N--CA 1.489 1.489 0 O-C-N 121.186 -0.946 . . . . 0.0 110.324 179.907 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.622 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 19.7 Cg_exo . . . . . 0 C--N 1.304 -1.791 0 O-C-N 124.076 1.566 . . . . 0.0 110.217 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 121.26 0.552 . . . . 0.0 110.284 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.1 mt -121.66 160.15 25.05 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.24 -0.912 . . . . 0.0 110.015 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.529 ' OD2' ' HB2' ' A' ' 62' ' ' ALA . 6.2 t0 -97.6 111.61 23.81 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.252 -0.905 . . . . 0.0 110.349 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.605 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 11.2 p90 -79.6 -23.42 42.69 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.27 -0.894 . . . . 0.0 109.279 179.354 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.605 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -60.01 -42.96 95.41 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.395 -0.816 . . . . 0.0 109.657 179.584 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.622 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -60.79 -32.83 72.16 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.247 -0.908 . . . . 0.0 109.868 179.648 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.591 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 1.3 t80 -71.63 -36.77 70.86 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.687 -0.633 . . . . 0.0 110.372 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.2 m -61.47 -38.89 88.89 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.147 -0.971 . . . . 0.0 110.457 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 44.8 p -68.37 -42.36 79.26 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.205 -0.934 . . . . 0.0 110.418 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -63.65 -38.11 89.87 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.216 -0.928 . . . . 0.0 110.619 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.77 -42.3 88.65 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.146 -0.971 . . . . 0.0 110.529 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.676 ' CE1' HG21 ' A' ' 6' ' ' THR . 28.3 m-85 . . . . . 0 N--CA 1.492 1.637 0 O-C-N 121.181 -0.949 . . . . 0.0 110.431 -179.701 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.281 0.562 . . . . 0.0 110.176 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.95 -48.49 71.16 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.276 -0.89 . . . . 0.0 110.035 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.15 -37.43 66.95 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.28 -0.887 . . . . 0.0 109.883 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -66.23 -40.2 90.09 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.274 -0.891 . . . . 0.0 109.804 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.42 -43.78 98.01 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.259 -0.901 . . . . 0.0 109.649 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.502 ' O ' HG23 ' B' ' 17' ' ' VAL . 76.6 t -58.78 -40.34 79.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.193 -0.942 . . . . 0.0 109.485 179.293 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.06 -38.85 92.82 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.46 -0.775 . . . . 0.0 109.966 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 57.2 m -69.12 -45.53 69.95 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.396 -0.815 . . . . 0.0 110.172 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.72 HG11 HD11 ' A' ' 33' ' ' LEU . 70.3 t -62.47 -46.95 95.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.214 -0.928 . . . . 0.0 109.983 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.522 HG22 ' HG2' ' A' ' 37' ' ' GLN . 77.3 t -60.56 -49.15 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.182 -0.949 . . . . 0.0 110.009 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.5 -39.39 76.38 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.303 -0.873 . . . . 0.0 110.107 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.86 -45.39 78.32 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.309 -0.869 . . . . 0.0 110.116 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 53.3 t -61.85 -41.68 91.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.306 -0.871 . . . . 0.0 110.132 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.07 -38.51 91.48 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.299 -0.875 . . . . 0.0 110.169 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -55.83 -41.35 74.14 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.193 -0.942 . . . . 0.0 110.295 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.5 -42.53 95.76 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.214 -0.929 . . . . 0.0 110.282 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.2 mmm-85 . . . . . 0 N--CA 1.49 1.551 0 O-C-N 121.3 -0.875 . . . . 0.0 110.317 -179.848 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.453 ' HB ' ' CZ ' ' A' ' 68' ' ' TYR . 9.5 p . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 121.242 0.544 . . . . 0.0 110.1 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.02 -44.82 83.22 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.201 -0.937 . . . . 0.0 109.431 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.74 ' HA ' HD12 ' A' ' 11' ' ' ILE . 18.0 tt0 -60.49 -36.2 77.74 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.407 -0.808 . . . . 0.0 109.591 179.314 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -61.8 -48.56 80.07 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.3 -0.875 . . . . 0.0 110.322 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.788 HG12 ' CD2' ' A' ' 14' ' ' PHE . 46.6 t -58.54 -41.22 81.32 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.08 -1.012 . . . . 0.0 109.589 179.574 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.74 HD12 ' HA ' ' A' ' 8' ' ' GLU . 64.8 mt -61.3 -45.66 98.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.412 -0.805 . . . . 0.0 109.472 179.336 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.22 -47.2 83.51 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.32 -0.863 . . . . 0.0 109.144 179.145 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.468 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 14.2 m -62.92 -39.26 94.03 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.284 -0.885 . . . . 0.0 109.009 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.788 ' CD2' HG12 ' A' ' 10' ' ' VAL . 1.2 m-85 -66.98 -43.29 83.38 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.434 -0.791 . . . . 0.0 109.41 179.23 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.554 ' CD ' ' HA ' ' A' ' 20' ' ' ASP . 0.0 OUTLIER -53.18 -43.11 66.85 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.29 -0.881 . . . . 0.0 109.009 179.184 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.59 HD12 ' HB2' ' B' ' 12' ' ' ALA . 39.7 mt -58.89 -44.81 91.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.463 -0.773 . . . . 0.0 109.432 179.117 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 13' ' ' SER . 33.2 mt -65.05 -41.99 94.66 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.232 -0.917 . . . . 0.0 109.779 179.567 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.685 ' HB1' ' O ' ' A' ' 23' ' ' TYR . . . -76.33 -2.07 29.9 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.421 -0.799 . . . . 0.0 110.195 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.455 ' O ' ' C ' ' A' ' 20' ' ' ASP . 0.4 OUTLIER 64.93 77.37 0.31 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.317 -0.864 . . . . 0.0 110.328 179.783 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.554 ' HA ' ' CD ' ' A' ' 15' ' ' ARG . 4.6 p-10 37.44 45.36 0.56 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.593 -0.692 . . . . 0.0 110.517 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 18' ' ' ALA . 10.7 mmtt -122.08 144.89 42.5 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.351 -0.843 . . . . 0.0 110.116 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -65.5 -8.2 18.4 Favored 'Trans proline' 0 C--N 1.304 -1.783 0 O-C-N 124.218 1.641 . . . . 0.0 110.209 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.685 ' O ' ' HB1' ' A' ' 18' ' ' ALA . 19.5 p90 -143.85 167.53 22.1 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.315 -0.866 . . . . 0.0 110.288 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.754 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -123.19 140.66 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.303 -0.873 . . . . 0.0 109.767 179.797 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.754 ' N ' HD13 ' A' ' 24' ' ' ILE . 3.3 mp -81.47 149.96 28.51 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.142 -0.974 . . . . 0.0 110.216 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.511 ' HA ' HD11 ' A' ' 42' ' ' ILE . . . -61.47 -40.03 93.06 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.368 -0.832 . . . . 0.0 110.268 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -63.59 -36.28 83.29 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.219 -0.926 . . . . 0.0 109.899 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.553 ' HB3' HD11 ' A' ' 24' ' ' ILE . 2.6 mm-40 -60.62 -37.53 81.73 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.248 -0.907 . . . . 0.0 109.3 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.713 HD12 ' CD1' ' A' ' 42' ' ' ILE . 22.9 mt -66.53 -36.33 82.42 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.394 -0.816 . . . . 0.0 109.606 179.401 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.0 mtt85 -68.81 -34.53 75.68 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.331 -0.856 . . . . 0.0 110.116 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.402 ' NH1' ' HG2' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -93.9 -18.67 21.71 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.293 -0.88 . . . . 0.0 110.773 -179.499 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.47 ' CG ' ' O ' ' A' ' 28' ' ' GLU . 12.6 mm-40 -99.55 -23.61 15.03 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.025 -1.047 . . . . 0.0 110.745 -179.616 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.797 HD11 HG11 ' B' ' 16' ' ' VAL . 2.3 mt -128.63 141.83 42.86 Favored Pre-proline 0 N--CA 1.488 1.475 0 O-C-N 121.055 -1.028 . . . . 0.0 110.12 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.592 ' HD2' HD23 ' A' ' 33' ' ' LEU . 31.6 Cg_exo -43.58 130.91 7.28 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.825 1.434 . . . . 0.0 109.634 179.51 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.458 ' C ' ' O ' ' A' ' 34' ' ' PRO . 32.3 Cg_exo -35.18 -38.95 0.2 Allowed 'Trans proline' 0 C--N 1.308 -1.598 0 O-C-N 124.274 1.671 . . . . 0.0 110.904 -179.522 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.15 -43.9 85.7 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.35 -0.843 . . . . 0.0 110.954 -179.83 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.71 ' HB3' HD22 ' A' ' 33' ' ' LEU . 2.5 mp0 -70.02 -42.02 73.52 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.081 -1.012 . . . . 0.0 110.99 -179.301 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.496 ' O ' HG12 ' A' ' 42' ' ' ILE . . . -55.87 -45.83 78.44 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.245 -0.909 . . . . 0.0 110.662 -179.375 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -54.53 -46.86 73.64 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.111 -0.993 . . . . 0.0 110.68 -179.507 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -63.16 -47.01 84.48 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.094 -1.004 . . . . 0.0 110.551 -179.638 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.486 ' O ' ' HG2' ' A' ' 45' ' ' MET . 84.3 m -65.33 -48.36 73.3 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.15 -0.969 . . . . 0.0 110.681 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.713 ' CD1' HD12 ' A' ' 29' ' ' LEU . 15.9 mm -47.58 -31.06 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.127 -0.983 . . . . 0.0 110.876 -179.529 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 10.2 tttt -85.01 -36.7 21.11 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.105 -0.997 . . . . 0.0 110.374 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.569 ' HG3' ' CE1' ' A' ' 63' ' ' PHE . 9.3 mmp_? -60.13 -73.42 0.09 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.34 -0.85 . . . . 0.0 110.271 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.668 ' HE2' ' HA ' ' A' ' 60' ' ' TYR . 21.2 ptp -56.73 138.97 77.24 Favored Pre-proline 0 N--CA 1.488 1.453 0 O-C-N 121.213 -0.929 . . . . 0.0 110.301 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.517 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 20.5 Cg_endo . . . . . 0 C--N 1.306 -1.694 0 O-C-N 123.963 1.507 . . . . 0.0 110.504 -179.769 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 121.287 0.565 . . . . 0.0 110.335 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.403 ' HA ' ' O ' ' A' ' 46' ' ' PRO . 1.2 mp -114.95 159.54 20.61 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.306 -0.871 . . . . 0.0 109.725 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.483 ' O ' ' HB2' ' A' ' 45' ' ' MET . 4.9 m-20 -108.39 110.61 22.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.024 -1.048 . . . . 0.0 110.479 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.668 ' HA ' ' HE2' ' A' ' 45' ' ' MET . 15.0 p90 -73.35 -26.7 61.13 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.336 -0.852 . . . . 0.0 110.14 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.558 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.13 -36.36 68.16 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.273 -0.892 . . . . 0.0 109.983 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.517 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -68.12 -34.41 76.33 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.248 -0.907 . . . . 0.0 109.885 179.616 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.569 ' CE1' ' HG3' ' A' ' 44' ' ' ARG . 2.7 t80 -71.77 -33.44 68.61 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.591 -0.693 . . . . 0.0 110.246 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.7 p -58.26 -48.19 81.2 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.302 -0.874 . . . . 0.0 110.383 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.3 t -68.55 -38.65 80.97 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.223 -0.923 . . . . 0.0 110.324 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.16 -31.03 71.63 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.235 -0.916 . . . . 0.0 110.367 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.605 HD21 ' HB2' ' B' ' 23' ' ' ALA . 0.5 OUTLIER -69.25 -43.27 74.31 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.243 -0.911 . . . . 0.0 110.326 -179.823 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.453 ' CZ ' ' HB ' ' A' ' 6' ' ' THR . 29.5 m-85 . . . . . 0 N--CA 1.492 1.639 0 O-C-N 121.185 -0.947 . . . . 0.0 110.236 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.199 0.523 . . . . 0.0 110.231 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.418 ' HA ' HG21 ' A' ' 16' ' ' ILE . 8.6 ttpt -58.19 -47.29 83.87 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.183 -0.948 . . . . 0.0 110.101 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.69 -37.8 74.11 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.197 -0.939 . . . . 0.0 110.128 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -63.65 -40.21 96.28 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.183 -0.948 . . . . 0.0 110.217 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 12' ' ' ALA . . . . . 0.59 ' HB2' HD12 ' A' ' 16' ' ' ILE . . . -62.43 -43.07 99.69 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.284 -0.885 . . . . 0.0 110.036 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 87.4 t -62.71 -40.36 88.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.176 -0.952 . . . . 0.0 109.753 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.64 -36.3 82.38 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.421 -0.799 . . . . 0.0 110.182 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 34.8 m -69.85 -40.22 75.92 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.269 -0.894 . . . . 0.0 110.252 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.797 HG11 HD11 ' A' ' 33' ' ' LEU . 57.6 t -69.01 -41.74 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.254 -0.904 . . . . 0.0 110.243 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 18.6 t -60.9 -44.41 97.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.286 -0.884 . . . . 0.0 110.101 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.35 -44.77 93.89 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.235 -0.915 . . . . 0.0 110.197 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.93 -45.76 87.78 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.237 -0.914 . . . . 0.0 110.082 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.57 HG23 ' O ' ' B' ' 16' ' ' VAL . 88.3 t -61.45 -47.23 94.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.349 -0.844 . . . . 0.0 110.16 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 21' ' ' ASP . . . . . 0.54 ' HA ' ' HD3' ' B' ' 24' ' ' ARG . 15.0 t70 -55.72 -31.89 62.88 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.124 -0.985 . . . . 0.0 109.709 179.718 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -64.35 -36.49 84.3 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.422 -0.799 . . . . 0.0 110.353 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 23' ' ' ALA . . . . . 0.605 ' HB2' HD21 ' A' ' 67' ' ' LEU . . . -60.33 -40.38 90.42 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.33 -0.856 . . . . 0.0 110.451 -179.623 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 24' ' ' ARG . . . . . 0.54 ' HD3' ' HA ' ' B' ' 21' ' ' ASP . 0.2 OUTLIER . . . . . 0 N--CA 1.493 1.693 0 O-C-N 121.082 -1.011 . . . . 0.0 109.726 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.424 HG22 ' OH ' ' A' ' 68' ' ' TYR . 1.2 m . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 121.144 0.497 . . . . 0.0 110.171 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.74 -40.39 97.07 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.267 -0.896 . . . . 0.0 109.264 179.49 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -54.31 -34.44 60.96 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.541 -0.724 . . . . 0.0 109.459 179.053 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -60.08 -40.86 91.02 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.428 -0.795 . . . . 0.0 110.213 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.63 HG12 ' HD2' ' A' ' 14' ' ' PHE . 96.3 t -58.16 -42.42 83.2 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.052 -1.03 . . . . 0.0 109.453 179.514 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.528 HG23 ' HE1' ' A' ' 60' ' ' TYR . 75.3 mt -62.42 -49.29 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.394 -0.816 . . . . 0.0 109.368 179.292 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.09 -46.68 87.66 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.425 -0.797 . . . . 0.0 109.259 179.159 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 45.4 m -63.35 -40.41 97.2 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.339 -0.851 . . . . 0.0 109.223 179.204 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.63 ' HD2' HG12 ' A' ' 10' ' ' VAL . 1.6 m-85 -68.5 -41.2 80.38 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.396 -0.815 . . . . 0.0 109.569 179.221 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.18 -45.95 68.73 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.287 -0.883 . . . . 0.0 109.425 179.477 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.423 HG21 ' HA ' ' B' ' 9' ' ' LYS . 9.6 mt -58.24 -44.58 88.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.314 -0.866 . . . . 0.0 109.286 179.361 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.441 HD21 HD12 ' A' ' 33' ' ' LEU . 4.5 mp -64.97 -39.0 92.82 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.374 -0.829 . . . . 0.0 109.796 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.624 ' HB2' ' HB ' ' A' ' 24' ' ' ILE . . . -81.62 9.66 7.3 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.327 -0.858 . . . . 0.0 110.254 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 60.72 50.02 5.84 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.155 -0.966 . . . . 0.0 110.278 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.1 t70 59.38 58.76 2.88 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.334 -0.854 . . . . 0.0 110.43 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.9 mttp -139.68 141.67 28.82 Favored Pre-proline 0 N--CA 1.49 1.541 0 O-C-N 121.299 -0.876 . . . . 0.0 109.9 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -61.64 -11.79 21.97 Favored 'Trans proline' 0 C--N 1.304 -1.778 0 O-C-N 124.076 1.566 . . . . 0.0 109.913 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 43.4 p90 -138.92 167.45 22.0 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.35 -0.844 . . . . 0.0 110.094 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.67 HD13 ' CD2' ' A' ' 29' ' ' LEU . 9.2 tt -144.67 158.78 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.267 -0.896 . . . . 0.0 110.214 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 16.1 mt -88.14 141.36 28.62 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.277 -0.89 . . . . 0.0 110.099 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.556 ' HB2' ' CD1' ' A' ' 58' ' ' LEU . . . -58.57 -33.7 70.24 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.247 -0.908 . . . . 0.0 110.343 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -62.71 -38.81 91.93 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.205 -0.935 . . . . 0.0 110.134 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -58.59 -40.76 84.07 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.215 -0.928 . . . . 0.0 109.489 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.67 ' CD2' HD13 ' A' ' 24' ' ' ILE . 2.1 mm? -59.37 -36.06 75.06 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.319 -0.863 . . . . 0.0 109.6 179.432 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 44.0 mtt180 -69.14 -34.72 75.45 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.381 -0.824 . . . . 0.0 110.506 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.0 ttt180 -87.26 -18.01 31.21 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.289 -0.882 . . . . 0.0 111.032 -179.322 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -101.73 -23.66 14.19 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.98 -1.075 . . . . 0.0 110.967 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.501 ' CD2' ' HB3' ' A' ' 37' ' ' GLN . 0.1 OUTLIER -126.93 164.87 32.39 Favored Pre-proline 0 C--N 1.303 -1.455 0 O-C-N 121.019 -1.05 . . . . 0.0 110.365 -179.805 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.465 ' HD2' HD23 ' A' ' 33' ' ' LEU . 30.9 Cg_exo -58.08 138.57 86.61 Favored 'Trans proline' 0 C--N 1.302 -1.904 0 O-C-N 124.173 1.617 . . . . 0.0 109.882 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.422 ' C ' ' O ' ' A' ' 34' ' ' PRO . 16.0 Cg_exo -40.11 -40.67 2.86 Favored 'Trans proline' 0 C--N 1.303 -1.817 0 O-C-N 124.052 1.554 . . . . 0.0 110.438 -179.643 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.426 ' OD1' ' CD ' ' A' ' 37' ' ' GLN . 1.4 p30 -65.94 -41.77 90.86 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.242 -0.911 . . . . 0.0 110.896 -179.578 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.501 ' HB3' ' CD2' ' A' ' 33' ' ' LEU . 0.4 OUTLIER -69.35 -39.51 78.08 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.021 -1.049 . . . . 0.0 110.763 -179.382 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.628 ' O ' HD12 ' A' ' 42' ' ' ILE . . . -61.32 -43.53 98.71 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.135 -0.978 . . . . 0.0 110.871 -179.481 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -64.22 -47.67 78.81 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.064 -1.023 . . . . 0.0 110.818 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.61 -43.15 97.73 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.126 -0.984 . . . . 0.0 110.511 -179.611 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.447 ' O ' ' HG2' ' A' ' 45' ' ' MET . 72.7 m -65.05 -49.64 69.33 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.257 -0.902 . . . . 0.0 110.579 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.628 HD12 ' O ' ' A' ' 38' ' ' ALA . 27.5 mt -61.44 -17.6 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.156 -0.965 . . . . 0.0 110.279 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -84.64 -19.67 32.55 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.103 -0.998 . . . . 0.0 110.293 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.435 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 5.1 mmt85 -88.99 -69.69 0.69 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.179 -0.95 . . . . 0.0 110.096 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.488 ' HE2' ' CA ' ' A' ' 60' ' ' TYR . 13.7 ptp -45.65 135.35 6.1 Favored Pre-proline 0 N--CA 1.488 1.43 0 O-C-N 121.243 -0.911 . . . . 0.0 110.248 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 45' ' ' MET . 23.0 Cg_exo . . . . . 0 C--N 1.305 -1.75 0 O-C-N 123.968 1.509 . . . . 0.0 110.308 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.176 0.512 . . . . 0.0 110.091 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.556 ' CD1' ' HB2' ' A' ' 26' ' ' ALA . 1.5 mt -119.42 159.93 23.28 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.21 -0.931 . . . . 0.0 110.337 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.439 ' O ' ' HB2' ' A' ' 45' ' ' MET . 3.4 m-20 -114.44 113.58 24.68 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.29 -0.881 . . . . 0.0 110.047 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.528 ' HE1' HG23 ' A' ' 11' ' ' ILE . 18.7 p90 -77.7 -22.08 51.02 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.247 -0.908 . . . . 0.0 110.205 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.446 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.26 -36.54 68.68 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.244 -0.91 . . . . 0.0 109.958 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.02 -34.68 76.96 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.277 -0.889 . . . . 0.0 109.865 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.451 ' O ' ' HB2' ' A' ' 67' ' ' LEU . 3.3 t80 -72.06 -29.2 63.9 Favored 'General case' 0 C--N 1.298 -1.674 0 O-C-N 121.578 -0.701 . . . . 0.0 109.938 179.579 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.2 p -65.39 -46.73 78.93 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.355 -0.841 . . . . 0.0 110.115 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 47.5 m -66.36 -43.82 84.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.338 -0.851 . . . . 0.0 109.994 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.95 -31.91 73.38 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.341 -0.849 . . . . 0.0 110.154 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.861 HD21 ' HB2' ' B' ' 23' ' ' ALA . 0.5 OUTLIER -63.4 -41.06 98.73 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.215 -0.928 . . . . 0.0 110.248 -179.966 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.424 ' OH ' HG22 ' A' ' 6' ' ' THR . 35.0 m-85 . . . . . 0 N--CA 1.489 1.499 0 O-C-N 121.289 -0.882 . . . . 0.0 110.369 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 8.2 mmtt . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 121.173 0.511 . . . . 0.0 110.295 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.423 ' HA ' HG21 ' A' ' 16' ' ' ILE . 3.0 tttt -63.67 -33.51 75.79 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.271 -0.893 . . . . 0.0 110.213 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.53 -42.73 99.71 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.258 -0.901 . . . . 0.0 110.14 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -61.16 -41.03 96.04 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.214 -0.929 . . . . 0.0 110.085 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.51 -45.21 91.72 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.287 -0.883 . . . . 0.0 110.189 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.465 HG13 ' HG ' ' A' ' 33' ' ' LEU . 71.3 t -60.82 -42.47 92.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.297 -0.877 . . . . 0.0 110.207 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.1 -38.71 80.16 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.249 -0.907 . . . . 0.0 110.182 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 65.3 m -66.49 -38.51 87.44 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.27 -0.894 . . . . 0.0 110.075 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.925 ' O ' HG23 ' B' ' 20' ' ' VAL . 74.0 t -69.91 -46.48 73.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.332 -0.855 . . . . 0.0 110.18 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 80.2 t -58.35 -46.55 89.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.278 -0.889 . . . . 0.0 110.093 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.34 -43.68 98.26 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.268 -0.895 . . . . 0.0 110.071 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.02 -45.63 84.71 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.277 -0.89 . . . . 0.0 110.174 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.925 HG23 ' O ' ' B' ' 16' ' ' VAL . 43.2 t -59.21 -45.32 92.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.328 -0.858 . . . . 0.0 110.165 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 21' ' ' ASP . . . . . 0.536 ' HA ' ' HG2' ' B' ' 24' ' ' ARG . 12.8 t70 -60.52 -32.92 71.93 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.274 -0.891 . . . . 0.0 110.238 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -66.82 -40.82 88.16 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.206 -0.934 . . . . 0.0 110.478 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 23' ' ' ALA . . . . . 0.861 ' HB2' HD21 ' A' ' 67' ' ' LEU . . . -65.98 -42.65 89.56 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.247 -0.908 . . . . 0.0 110.961 -179.451 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 24' ' ' ARG . . . . . 0.536 ' HG2' ' HA ' ' B' ' 21' ' ' ASP . 3.0 ptp180 . . . . . 0 N--CA 1.493 1.68 0 O-C-N 121.048 -1.032 . . . . 0.0 110.76 -179.505 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.1 m . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 121.21 0.529 . . . . 0.0 110.213 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.82 -44.53 85.34 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.22 -0.925 . . . . 0.0 109.582 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 29.1 tp10 -54.56 -35.93 63.81 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.384 -0.822 . . . . 0.0 109.889 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -60.91 -43.02 99.16 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.376 -0.828 . . . . 0.0 110.26 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.486 HG12 ' HD2' ' A' ' 14' ' ' PHE . 45.0 t -59.98 -49.76 82.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.148 -0.97 . . . . 0.0 109.915 179.653 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 46.2 mt -55.08 -49.15 74.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.322 -0.861 . . . . 0.0 109.44 179.598 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.29 -43.26 83.02 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.297 -0.877 . . . . 0.0 109.096 179.123 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.2 m -66.7 -38.92 87.72 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.374 -0.829 . . . . 0.0 109.308 179.162 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.596 ' HB3' ' CE1' ' A' ' 60' ' ' TYR . 1.2 m-85 -67.83 -40.79 83.71 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.311 -0.868 . . . . 0.0 109.412 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -55.47 -48.9 73.8 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.315 -0.865 . . . . 0.0 109.526 179.284 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 37.7 mt -57.99 -42.2 82.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.391 -0.818 . . . . 0.0 109.917 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.505 ' CD1' ' HB3' ' A' ' 32' ' ' GLU . 2.7 mm? -65.09 -41.63 94.81 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.337 -0.852 . . . . 0.0 110.074 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.796 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -78.76 0.24 27.65 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.41 -0.806 . . . . 0.0 110.151 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.493 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 68.65 60.43 0.37 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.332 -0.855 . . . . 0.0 110.502 179.801 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.9 t70 59.04 52.34 6.38 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.202 -0.936 . . . . 0.0 110.42 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.5 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 32.8 mmtt -134.64 143.1 45.1 Favored Pre-proline 0 N--CA 1.489 1.503 0 O-C-N 121.198 -0.939 . . . . 0.0 110.07 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_endo -72.49 -1.68 10.62 Favored 'Trans proline' 0 C--N 1.305 -1.722 0 O-C-N 124.032 1.543 . . . . 0.0 109.988 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 46.9 p90 -143.92 164.38 30.73 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.276 -0.89 . . . . 0.0 110.142 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.796 HG12 ' HB2' ' A' ' 18' ' ' ALA . 0.4 OUTLIER -129.08 149.44 33.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.211 -0.931 . . . . 0.0 110.034 -179.816 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.671 ' H ' HD13 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -91.68 143.95 26.02 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.225 -0.922 . . . . 0.0 110.205 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.47 -45.44 84.81 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.29 -0.881 . . . . 0.0 110.268 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -59.42 -36.0 75.05 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.323 -0.861 . . . . 0.0 110.395 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.425 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 4.7 tt0 -65.17 -42.82 93.3 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.298 -0.876 . . . . 0.0 110.166 -179.775 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.58 HD11 HG21 ' A' ' 24' ' ' ILE . 25.3 mt -64.01 -35.7 81.58 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.201 -0.937 . . . . 0.0 109.914 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.4 ttm-85 -67.99 -34.8 77.23 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.417 -0.802 . . . . 0.0 110.104 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 22.7 ttt-85 -90.84 -26.21 19.51 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.346 -0.846 . . . . 0.0 110.661 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.505 ' HB3' ' CD1' ' A' ' 17' ' ' LEU . 3.5 mm-40 -92.33 -23.58 19.21 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.226 -0.921 . . . . 0.0 111.235 -179.157 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.679 HD22 ' HB3' ' A' ' 37' ' ' GLN . 0.3 OUTLIER -124.26 164.78 27.88 Favored Pre-proline 0 N--CA 1.49 1.563 0 O-C-N 120.899 -1.126 . . . . 0.0 110.526 -179.562 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.662 ' HD2' HD23 ' A' ' 33' ' ' LEU . 34.3 Cg_exo -63.44 145.46 92.37 Favored 'Trans proline' 0 C--N 1.307 -1.652 0 O-C-N 124.072 1.564 . . . . 0.0 110.178 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -43.87 -35.75 7.32 Favored 'Trans proline' 0 C--N 1.302 -1.876 0 O-C-N 124.081 1.569 . . . . 0.0 110.472 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.97 -47.38 74.79 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.089 -1.007 . . . . 0.0 110.725 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.73 ' HG2' HG22 ' B' ' 17' ' ' VAL . 1.4 mp0 -69.81 -42.96 72.99 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.112 -0.993 . . . . 0.0 110.455 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.466 ' O ' ' CG1' ' A' ' 42' ' ' ILE . . . -56.64 -44.13 80.96 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.248 -0.908 . . . . 0.0 110.476 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -63.38 -49.12 75.1 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.185 -0.947 . . . . 0.0 110.321 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -66.44 -47.93 71.59 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.232 -0.918 . . . . 0.0 110.2 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.403 ' SG ' HG21 ' B' ' 20' ' ' VAL . 71.1 m -63.95 -43.6 95.36 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.207 -0.933 . . . . 0.0 110.147 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.466 ' CG1' ' O ' ' A' ' 38' ' ' ALA . 48.6 mt -61.4 -24.01 32.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.246 -0.908 . . . . 0.0 109.998 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.62 -41.94 15.87 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.212 -0.93 . . . . 0.0 110.224 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.593 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 2.4 mmp_? -66.99 -64.3 0.88 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.193 -0.942 . . . . 0.0 110.106 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.623 ' HE1' ' HB3' ' A' ' 60' ' ' TYR . 1.9 ttm -36.04 101.59 0.22 Allowed Pre-proline 0 N--CA 1.494 1.743 0 O-C-N 121.581 -0.699 . . . . 0.0 111.029 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.434 ' HD3' ' O ' ' A' ' 44' ' ' ARG . 12.7 Cg_endo . . . . . 0 C--N 1.305 -1.746 0 O-C-N 124.0 1.526 . . . . 0.0 109.781 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.186 0.517 . . . . 0.0 110.15 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.431 ' HB3' ' HG2' ' A' ' 45' ' ' MET . 58.3 mt -122.11 156.75 32.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.253 -0.904 . . . . 0.0 110.159 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.509 ' OD1' ' HB3' ' A' ' 61' ' ' ALA . 7.3 t70 -103.91 110.98 23.32 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.135 -0.978 . . . . 0.0 110.583 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.623 ' HB3' ' HE1' ' A' ' 45' ' ' MET . 20.5 p90 -71.36 -25.93 62.59 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.208 -0.933 . . . . 0.0 109.09 179.073 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.581 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.16 -41.48 75.49 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.493 -0.755 . . . . 0.0 109.563 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.471 ' HB2' ' OD2' ' A' ' 59' ' ' ASP . . . -62.1 -37.5 85.3 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.301 -0.875 . . . . 0.0 109.611 179.378 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.593 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 2.6 t80 -71.87 -38.87 69.96 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.643 -0.661 . . . . 0.0 110.008 179.561 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.7 p -60.11 -47.13 87.18 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.339 -0.851 . . . . 0.0 110.294 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.41 -35.73 81.8 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.328 -0.858 . . . . 0.0 110.227 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.01 -32.74 59.54 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.289 -0.882 . . . . 0.0 110.179 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.775 HD21 ' HB2' ' B' ' 23' ' ' ALA . 0.4 OUTLIER -55.16 -38.0 67.72 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.204 -0.935 . . . . 0.0 110.278 179.962 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 . . . . . 0 N--CA 1.491 1.62 0 O-C-N 121.197 -0.939 . . . . 0.0 110.357 -179.874 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 121.241 0.543 . . . . 0.0 110.261 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.727 ' O ' HG23 ' B' ' 13' ' ' VAL . 7.5 ttmt -68.14 -33.14 73.94 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.246 -0.909 . . . . 0.0 110.188 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.7 96.96 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.255 -0.903 . . . . 0.0 110.072 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -63.5 -40.48 97.18 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.201 -0.937 . . . . 0.0 110.03 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 12' ' ' ALA . . . . . 0.606 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -66.7 -43.53 84.12 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.285 -0.885 . . . . 0.0 110.032 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.727 HG23 ' O ' ' B' ' 9' ' ' LYS . 59.3 t -63.08 -44.14 99.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.433 -0.792 . . . . 0.0 110.108 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.05 -41.61 92.68 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.268 -0.895 . . . . 0.0 109.921 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 99.9 m -62.6 -42.91 99.85 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.211 -0.931 . . . . 0.0 109.932 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.671 ' O ' HG23 ' B' ' 20' ' ' VAL . 56.7 t -65.17 -45.34 94.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.389 -0.819 . . . . 0.0 109.974 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.73 HG22 ' HG2' ' A' ' 37' ' ' GLN . 76.1 t -60.28 -47.01 94.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.302 -0.874 . . . . 0.0 109.883 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.3 -42.83 82.5 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.288 -0.882 . . . . 0.0 110.04 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.25 -40.63 86.27 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.348 -0.845 . . . . 0.0 109.859 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.671 HG23 ' O ' ' B' ' 16' ' ' VAL . 98.6 t -64.9 -47.28 88.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.308 -0.87 . . . . 0.0 110.113 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 54.2 t0 -64.9 -32.51 74.26 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.262 -0.899 . . . . 0.0 110.087 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -58.21 -48.32 80.71 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.233 -0.917 . . . . 0.0 110.123 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 23' ' ' ALA . . . . . 0.775 ' HB2' HD21 ' A' ' 67' ' ' LEU . . . -60.92 -38.89 87.36 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.318 -0.864 . . . . 0.0 110.37 -179.817 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 . . . . . 0 N--CA 1.492 1.65 0 O-C-N 121.169 -0.957 . . . . 0.0 110.318 -179.993 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.2 p . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.166 0.507 . . . . 0.0 110.17 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.73 -48.83 73.16 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.208 -0.932 . . . . 0.0 109.874 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.689 ' HA ' HD12 ' A' ' 11' ' ' ILE . 0.9 OUTLIER -54.75 -36.16 64.52 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.402 -0.811 . . . . 0.0 110.055 179.643 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -61.19 -43.98 98.02 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.272 -0.892 . . . . 0.0 110.226 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.541 HG12 ' HD2' ' A' ' 14' ' ' PHE . 73.2 t -58.07 -45.64 88.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.14 -0.975 . . . . 0.0 109.686 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.689 HD12 ' HA ' ' A' ' 8' ' ' GLU . 36.8 mt -58.05 -47.2 87.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.404 -0.81 . . . . 0.0 109.335 179.389 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.56 -44.01 84.92 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.324 -0.86 . . . . 0.0 108.907 179.104 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.515 ' HA ' ' HB1' ' B' ' 12' ' ' ALA . 46.5 m -65.23 -40.13 93.66 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.373 -0.829 . . . . 0.0 108.976 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.541 ' HD2' HG12 ' A' ' 10' ' ' VAL . 3.1 m-85 -68.53 -41.34 80.05 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.432 -0.793 . . . . 0.0 109.509 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.0 ttt180 -53.5 -45.37 69.64 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.39 -0.819 . . . . 0.0 109.547 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.489 HD12 ' HB2' ' B' ' 12' ' ' ALA . 56.0 mt -61.53 -42.98 96.07 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 O-C-N 121.285 -0.884 . . . . 0.0 109.784 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.418 HD11 HG22 ' B' ' 13' ' ' VAL . 2.7 mp -63.68 -40.47 96.9 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.34 -0.85 . . . . 0.0 109.9 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.433 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -79.53 4.72 14.93 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.377 -0.827 . . . . 0.0 110.218 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.433 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.4 OUTLIER 65.21 58.91 0.85 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.219 -0.926 . . . . 0.0 110.243 -179.986 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 54.51 63.99 1.97 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.263 -0.898 . . . . 0.0 110.345 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.1 mttp -144.86 143.12 19.87 Favored Pre-proline 0 N--CA 1.49 1.542 0 O-C-N 121.266 -0.896 . . . . 0.0 110.007 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -69.89 -4.41 14.05 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 O-C-N 124.037 1.546 . . . . 0.0 110.082 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 50.1 p90 -138.66 165.39 27.04 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.276 -0.89 . . . . 0.0 109.873 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.621 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -139.86 138.53 38.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.165 -0.959 . . . . 0.0 110.277 -179.773 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.646 HD23 ' HB2' ' A' ' 27' ' ' GLU . 5.4 tp -80.3 147.98 30.92 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.281 -0.887 . . . . 0.0 109.911 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.648 ' HB1' ' CD1' ' A' ' 42' ' ' ILE . . . -62.05 -26.85 68.5 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.233 -0.917 . . . . 0.0 110.143 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.646 ' HB2' HD23 ' A' ' 25' ' ' LEU . 4.9 mp0 -70.56 -36.21 73.51 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.334 -0.854 . . . . 0.0 110.318 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.503 ' HB2' HD11 ' A' ' 24' ' ' ILE . 10.6 mt-10 -67.91 -50.18 57.66 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.232 -0.917 . . . . 0.0 110.254 -179.623 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.745 HD12 ' C ' ' A' ' 29' ' ' LEU . 1.2 pp -66.54 -33.81 76.5 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.196 -0.94 . . . . 0.0 109.703 179.787 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.572 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -62.37 -35.73 80.05 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.36 -0.838 . . . . 0.0 109.977 179.908 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.82 -8.53 30.82 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.416 -0.802 . . . . 0.0 110.472 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -98.38 -23.27 15.67 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.1 -1.0 . . . . 0.0 110.673 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.729 HD11 HG11 ' B' ' 16' ' ' VAL . 2.9 mt -120.07 155.77 55.27 Favored Pre-proline 0 N--CA 1.488 1.453 0 O-C-N 121.159 -0.963 . . . . 0.0 110.464 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.492 ' HD2' HD23 ' A' ' 33' ' ' LEU . 51.4 Cg_exo -54.92 144.06 69.22 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 O-C-N 124.022 1.538 . . . . 0.0 110.271 179.702 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.409 ' C ' ' O ' ' A' ' 34' ' ' PRO . 26.5 Cg_endo -39.81 -42.41 3.04 Favored 'Trans proline' 0 C--N 1.304 -1.788 0 O-C-N 124.104 1.581 . . . . 0.0 110.59 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.07 -46.88 76.15 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.293 -0.88 . . . . 0.0 111.102 -179.433 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.827 ' NE2' HG13 ' B' ' 17' ' ' VAL . 33.3 mm-40 -69.53 -41.42 76.01 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.021 -1.05 . . . . 0.0 110.741 -179.291 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.572 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -56.08 -42.01 76.02 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.165 -0.96 . . . . 0.0 110.678 -179.513 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -60.11 -47.9 83.97 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.11 -0.994 . . . . 0.0 110.743 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -58.56 -44.23 89.65 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.189 -0.945 . . . . 0.0 110.559 -179.629 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 72.0 m -65.26 -42.54 93.14 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.173 -0.954 . . . . 0.0 110.358 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.648 ' CD1' ' HB1' ' A' ' 26' ' ' ALA . 1.1 mm -67.67 -21.64 27.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 O-C-N 121.259 -0.901 . . . . 0.0 110.474 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.81 -30.28 28.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.272 -0.892 . . . . 0.0 111.068 -179.303 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.553 ' HG2' ' CE1' ' A' ' 63' ' ' PHE . 1.1 mpt_? -94.32 -64.14 1.11 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.982 -1.074 . . . . 0.0 111.082 -179.229 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.562 ' CE ' ' HB3' ' A' ' 60' ' ' TYR . 5.5 ttm -30.0 112.15 0.29 Allowed Pre-proline 0 N--CA 1.497 1.886 0 O-C-N 121.796 -0.565 . . . . 0.0 111.305 -179.615 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.484 ' O ' HD23 ' A' ' 58' ' ' LEU . 18.9 Cg_endo . . . . . 0 C--N 1.308 -1.595 0 O-C-N 124.232 1.648 . . . . 0.0 110.395 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.289 0.566 . . . . 0.0 110.251 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.484 HD23 ' O ' ' A' ' 46' ' ' PRO . 1.4 mt -124.17 160.33 28.1 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.322 -0.861 . . . . 0.0 110.054 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.472 ' C ' ' HG3' ' A' ' 45' ' ' MET . 2.1 m-20 -113.91 112.03 22.68 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.144 -0.973 . . . . 0.0 110.694 -179.713 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.562 ' HB3' ' CE ' ' A' ' 45' ' ' MET . 14.2 p90 -73.67 -21.16 60.35 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.402 -0.811 . . . . 0.0 109.784 179.67 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.533 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.64 -36.73 67.34 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.36 -0.838 . . . . 0.0 109.466 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.45 -36.37 78.91 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.352 -0.842 . . . . 0.0 109.424 179.271 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.553 ' CE1' ' HG2' ' A' ' 44' ' ' ARG . 6.5 t80 -71.83 -35.42 69.9 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.787 -0.571 . . . . 0.0 110.06 179.612 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 32.1 t -58.35 -47.51 83.54 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.249 -0.907 . . . . 0.0 109.974 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 11.2 m -62.62 -36.9 84.26 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.197 -0.939 . . . . 0.0 109.901 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.63 -37.84 82.78 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.261 -0.899 . . . . 0.0 109.959 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.96 -42.7 90.52 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.27 -0.894 . . . . 0.0 110.123 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 . . . . . 0 N--CA 1.489 1.516 0 O-C-N 121.204 -0.935 . . . . 0.0 110.27 -179.963 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 31.7 mttp . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.248 0.547 . . . . 0.0 110.131 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.463 ' O ' HG23 ' B' ' 13' ' ' VAL . 5.4 ttpt -57.95 -49.48 76.64 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.245 -0.909 . . . . 0.0 110.121 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.88 -38.27 78.44 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.322 -0.861 . . . . 0.0 110.116 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -64.85 -40.71 95.59 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.25 -0.906 . . . . 0.0 110.102 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 12' ' ' ALA . . . . . 0.515 ' HB1' ' HA ' ' A' ' 13' ' ' SER . . . -66.43 -41.9 88.48 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.251 -0.906 . . . . 0.0 110.136 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.463 HG23 ' O ' ' B' ' 9' ' ' LYS . 93.2 t -61.4 -42.18 92.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.204 -0.935 . . . . 0.0 110.135 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.75 -40.87 96.65 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.262 -0.899 . . . . 0.0 110.172 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 14.6 m -62.79 -48.91 77.1 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.272 -0.892 . . . . 0.0 110.082 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.729 HG11 HD11 ' A' ' 33' ' ' LEU . 80.4 t -60.38 -47.23 93.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.25 -0.906 . . . . 0.0 110.084 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.827 HG13 ' NE2' ' A' ' 37' ' ' GLN . 58.2 t -60.58 -48.26 89.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.25 -0.906 . . . . 0.0 110.119 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.2 -44.09 92.25 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.224 -0.922 . . . . 0.0 109.943 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.23 -44.87 78.42 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.361 -0.837 . . . . 0.0 109.934 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.597 HG23 ' O ' ' B' ' 16' ' ' VAL . 99.5 t -67.26 -43.58 88.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.248 -0.907 . . . . 0.0 110.107 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -57.57 -35.8 70.84 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.282 -0.886 . . . . 0.0 110.116 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -55.03 -45.17 75.17 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.295 -0.878 . . . . 0.0 110.106 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.86 -37.32 85.85 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.347 -0.845 . . . . 0.0 110.192 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.281 -0.887 . . . . 0.0 110.108 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.218 0.533 . . . . 0.0 110.264 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.99 -46.89 88.91 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.271 -0.893 . . . . 0.0 109.843 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.846 ' HA ' HD12 ' A' ' 11' ' ' ILE . 1.8 tt0 -54.28 -36.56 63.77 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.308 -0.87 . . . . 0.0 109.536 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 10.5 tp60 -62.44 -46.34 88.97 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.328 -0.858 . . . . 0.0 109.949 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.58 HG12 ' CD2' ' A' ' 14' ' ' PHE . 38.4 t -58.7 -41.48 82.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.342 -0.849 . . . . 0.0 109.963 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.846 HD12 ' HA ' ' A' ' 8' ' ' GLU . 51.0 mt -57.92 -49.58 80.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.328 -0.858 . . . . 0.0 109.427 179.531 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.91 -38.33 75.66 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 119.573 -0.851 . . . . 0.0 108.873 178.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.1 m -68.0 -40.55 83.0 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.486 -0.759 . . . . 0.0 109.294 179.048 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.58 ' CD2' HG12 ' A' ' 10' ' ' VAL . 4.1 m-85 -68.23 -41.35 81.36 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.303 -0.873 . . . . 0.0 109.649 179.467 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -54.43 -44.82 72.77 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.284 -0.885 . . . . 0.0 109.452 179.36 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.415 HG21 ' HA ' ' B' ' 9' ' ' LYS . 46.4 mt -62.22 -40.97 89.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.343 -0.848 . . . . 0.0 109.83 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.407 HD13 ' HA ' ' A' ' 17' ' ' LEU . 2.9 mm? -64.74 -41.69 95.74 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.218 -0.926 . . . . 0.0 109.829 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.7 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -81.76 4.24 22.77 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.323 -0.86 . . . . 0.0 110.201 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.456 ' HB3' ' O ' ' A' ' 18' ' ' ALA . 4.9 t 65.09 64.45 0.63 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.199 -0.938 . . . . 0.0 110.278 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 54.94 60.12 3.66 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.267 -0.896 . . . . 0.0 110.368 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.573 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 18.1 mttm -141.66 142.95 27.44 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.3 -0.875 . . . . 0.0 110.01 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -76.07 2.69 6.86 Favored 'Trans proline' 0 C--N 1.304 -1.803 0 O-C-N 124.147 1.604 . . . . 0.0 110.178 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.573 ' CZ ' ' HD3' ' A' ' 21' ' ' LYS . 32.9 p90 -143.7 155.08 44.09 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.307 -0.871 . . . . 0.0 110.107 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.832 HD12 HD23 ' A' ' 29' ' ' LEU . 0.4 OUTLIER -129.18 147.88 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.268 -0.895 . . . . 0.0 110.016 -179.871 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.765 ' H ' HD13 ' A' ' 24' ' ' ILE . 8.0 mp -92.14 146.37 23.78 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.134 -0.979 . . . . 0.0 110.431 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.14 -43.02 99.53 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.345 -0.847 . . . . 0.0 110.304 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -56.28 -39.6 72.92 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.252 -0.905 . . . . 0.0 109.834 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.45 ' HG3' ' OE1' ' A' ' 32' ' ' GLU . 0.7 OUTLIER -63.66 -45.44 90.17 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.427 -0.796 . . . . 0.0 109.523 179.724 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.832 HD23 HD12 ' A' ' 24' ' ' ILE . 3.1 mm? -58.32 -34.29 70.43 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.392 -0.818 . . . . 0.0 109.72 179.633 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 28.1 mtp180 -69.1 -34.78 75.64 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.354 -0.842 . . . . 0.0 110.652 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 10.1 ttt180 -93.88 -25.57 17.26 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.127 -0.983 . . . . 0.0 111.085 -179.176 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.45 ' OE1' ' HG3' ' A' ' 28' ' ' GLU . 2.7 mp0 -90.91 -23.34 20.52 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.0 -1.063 . . . . 0.0 111.197 -179.162 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.783 HD23 ' HD2' ' A' ' 34' ' ' PRO . 0.3 OUTLIER -128.61 160.86 60.59 Favored Pre-proline 0 N--CA 1.489 1.492 0 O-C-N 120.94 -1.1 . . . . 0.0 110.559 -179.606 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.783 ' HD2' HD23 ' A' ' 33' ' ' LEU . 28.0 Cg_exo -58.77 144.12 98.49 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 O-C-N 124.035 1.545 . . . . 0.0 110.241 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -46.64 -30.6 9.12 Favored 'Trans proline' 0 C--N 1.304 -1.78 0 O-C-N 124.093 1.575 . . . . 0.0 110.43 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -65.75 -47.37 75.48 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.22 -0.925 . . . . 0.0 110.556 -179.73 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.621 ' HG2' HG22 ' B' ' 17' ' ' VAL . 2.0 mp0 -69.66 -38.32 77.05 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.197 -0.94 . . . . 0.0 110.254 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.22 -44.03 79.16 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.319 -0.863 . . . . 0.0 110.293 -179.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -64.88 -45.09 87.46 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.254 -0.904 . . . . 0.0 110.317 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -65.6 -47.21 76.48 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.166 -0.959 . . . . 0.0 110.39 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 62.8 m -65.36 -42.74 92.46 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.242 -0.911 . . . . 0.0 110.502 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 68.6 mt -71.68 -16.26 18.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.238 -0.914 . . . . 0.0 110.535 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.9 tptt -84.64 -17.55 38.25 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.221 -0.924 . . . . 0.0 110.263 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.609 ' HB2' ' CD2' ' A' ' 63' ' ' PHE . 4.9 mtt85 -105.13 -66.54 0.97 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.321 -0.862 . . . . 0.0 110.563 -179.628 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.536 ' HE2' ' HA ' ' A' ' 60' ' ' TYR . 3.1 ttm -26.35 108.98 0.2 Allowed Pre-proline 0 N--CA 1.499 1.985 0 O-C-N 121.877 -0.515 . . . . 0.0 111.495 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.484 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 10.8 Cg_endo . . . . . 0 C--N 1.307 -1.646 0 O-C-N 123.971 1.511 . . . . 0.0 110.227 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.435 ' HB1' ' HB2' ' A' ' 23' ' ' TYR . . . . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 121.265 0.555 . . . . 0.0 110.12 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.805 HD22 ' N ' ' A' ' 58' ' ' LEU . 3.0 mm? -92.89 160.54 14.86 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.289 -0.882 . . . . 0.0 109.965 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.533 ' N ' ' HG2' ' A' ' 45' ' ' MET . 0.7 OUTLIER -105.89 110.16 22.36 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.09 -1.006 . . . . 0.0 110.741 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.554 ' CD1' ' CB ' ' A' ' 14' ' ' PHE . 28.6 p90 -77.49 -19.26 56.16 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.672 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.93 -42.59 76.36 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.126 -0.984 . . . . 0.0 108.474 178.93 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.484 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -61.92 -31.96 72.32 Favored 'General case' 0 N--CA 1.488 1.444 0 CA-C-O 121.931 0.872 . . . . 0.0 108.961 178.451 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.891 ' CE1' HD12 ' A' ' 67' ' ' LEU . 25.7 t80 -60.59 -41.98 95.8 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.792 -0.567 . . . . 0.0 110.412 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.404 ' OG ' ' N ' ' A' ' 65' ' ' SER . 6.2 p -63.1 -50.68 69.56 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.147 -0.971 . . . . 0.0 110.456 -179.626 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.404 ' N ' ' OG ' ' A' ' 64' ' ' SER . 16.0 m -69.54 -35.68 75.67 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.145 -0.972 . . . . 0.0 110.43 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.36 -39.56 81.77 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.35 -0.844 . . . . 0.0 110.872 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.891 HD12 ' CE1' ' A' ' 63' ' ' PHE . 1.3 mt -75.09 -44.06 49.49 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.079 -1.013 . . . . 0.0 110.485 -179.619 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 . . . . . 0 N--CA 1.491 1.601 0 O-C-N 121.2 -0.938 . . . . 0.0 110.397 -179.822 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 121.258 0.552 . . . . 0.0 110.095 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.415 ' HA ' HG21 ' A' ' 16' ' ' ILE . 0.1 OUTLIER -66.06 -40.14 90.67 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.256 -0.903 . . . . 0.0 110.194 179.839 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.43 -43.98 79.96 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.323 -0.861 . . . . 0.0 110.113 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -60.33 -40.85 92.11 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.285 -0.884 . . . . 0.0 110.093 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.86 -45.23 82.93 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.303 -0.873 . . . . 0.0 110.14 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.857 ' O ' HG23 ' B' ' 17' ' ' VAL . 76.5 t -57.77 -42.44 81.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.292 -0.88 . . . . 0.0 110.121 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.97 -40.13 96.78 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.246 -0.909 . . . . 0.0 110.132 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 42.8 m -63.87 -43.74 95.18 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.227 -0.921 . . . . 0.0 110.16 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.574 ' O ' HG23 ' B' ' 20' ' ' VAL . 66.2 t -65.97 -43.61 92.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.263 -0.898 . . . . 0.0 110.096 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.857 HG23 ' O ' ' B' ' 13' ' ' VAL . 31.9 t -63.77 -45.83 96.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.294 -0.879 . . . . 0.0 110.111 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.13 -37.07 83.74 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.258 -0.901 . . . . 0.0 110.041 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.99 -42.68 89.5 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.301 -0.874 . . . . 0.0 110.178 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.574 HG23 ' O ' ' B' ' 16' ' ' VAL . 69.3 t -65.42 -40.73 89.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.252 -0.905 . . . . 0.0 110.141 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.75 -35.98 82.81 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.379 -0.825 . . . . 0.0 110.089 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.2 -43.62 95.78 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.402 -0.811 . . . . 0.0 110.186 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.92 -35.25 80.56 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.23 -0.919 . . . . 0.0 110.474 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 5.4 ttt180 . . . . . 0 N--CA 1.493 1.679 0 O-C-N 121.124 -0.985 . . . . 0.0 110.359 -179.829 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.835 HG22 ' OH ' ' A' ' 68' ' ' TYR . 1.7 m . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.16 0.505 . . . . 0.0 110.23 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.85 -47.56 80.24 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.226 -0.921 . . . . 0.0 109.814 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -54.45 -36.05 63.67 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.31 -0.869 . . . . 0.0 109.797 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -61.66 -37.6 84.63 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.346 -0.847 . . . . 0.0 110.285 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.497 HG12 ' CD2' ' A' ' 14' ' ' PHE . 17.0 t -58.15 -50.55 77.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.172 -0.955 . . . . 0.0 109.646 179.818 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 23.4 mt -55.01 -49.95 67.13 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 121.276 -0.89 . . . . 0.0 109.153 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.07 -39.31 78.22 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.352 -0.843 . . . . 0.0 108.739 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.46 ' HA ' ' HB1' ' B' ' 12' ' ' ALA . 72.5 m -66.84 -41.11 87.95 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.46 -0.775 . . . . 0.0 109.087 179.023 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.585 ' HB3' ' CE2' ' A' ' 60' ' ' TYR . 5.1 m-85 -67.24 -41.42 85.67 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.368 -0.832 . . . . 0.0 109.322 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.7 ttt-85 -54.52 -44.62 72.91 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.427 -0.796 . . . . 0.0 109.632 179.385 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.631 HD12 ' HB2' ' B' ' 12' ' ' ALA . 44.3 mt -60.93 -44.65 98.41 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.368 -0.832 . . . . 0.0 109.953 179.724 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.492 HD21 HG23 ' B' ' 13' ' ' VAL . 3.2 mm? -64.41 -39.78 94.5 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.224 -0.923 . . . . 0.0 109.84 179.788 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.504 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -77.09 -4.26 43.47 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.306 -0.871 . . . . 0.0 110.044 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.463 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 66.93 63.34 0.47 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.266 -0.896 . . . . 0.0 110.359 179.895 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 55.59 62.16 2.55 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.276 -0.89 . . . . 0.0 110.432 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.504 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 19.3 mttt -144.73 143.89 22.72 Favored Pre-proline 0 N--CA 1.49 1.563 0 O-C-N 121.329 -0.857 . . . . 0.0 109.887 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -73.72 -0.25 9.13 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 O-C-N 123.938 1.494 . . . . 0.0 110.094 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 13.6 p90 -146.38 155.66 42.76 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.286 -0.884 . . . . 0.0 110.283 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.656 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -124.18 142.22 41.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.427 -0.795 . . . . 0.0 109.754 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.656 ' N ' HD13 ' A' ' 24' ' ' ILE . 3.8 mp -80.23 136.54 36.48 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.136 -0.977 . . . . 0.0 110.003 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.32 -41.02 96.33 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.268 -0.895 . . . . 0.0 109.912 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.15 -42.77 77.49 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.38 -0.825 . . . . 0.0 109.541 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.449 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 64.0 tt0 -69.41 -42.39 75.13 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.501 -0.749 . . . . 0.0 109.648 179.541 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.663 HD21 ' CB ' ' A' ' 41' ' ' CYS . 1.2 tp -62.56 -41.4 98.89 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.412 -0.805 . . . . 0.0 108.92 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.936 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -62.43 -33.65 75.22 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.652 -0.655 . . . . 0.0 110.257 179.619 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.3 ttm180 -96.72 -24.8 15.79 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.355 -0.841 . . . . 0.0 111.504 -179.03 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.449 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 7.7 mm-40 -80.06 -21.55 43.3 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.815 -1.178 . . . . 0.0 111.073 -179.088 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.535 HD23 ' HD3' ' A' ' 34' ' ' PRO . 7.3 mt -116.72 169.65 6.96 Favored Pre-proline 0 C--N 1.303 -1.426 0 O-C-N 120.939 -1.101 . . . . 0.0 111.164 -179.076 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.558 ' CB ' ' HD2' ' A' ' 35' ' ' PRO . 35.3 Cg_exo -58.41 -149.39 0.01 OUTLIER 'Trans proline' 0 C--N 1.307 -1.62 0 O-C-N 124.225 1.645 . . . . 0.0 109.984 179.668 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.558 ' HD2' ' CB ' ' A' ' 34' ' ' PRO . 10.8 Cg_endo -96.24 -44.19 0.02 OUTLIER 'Trans proline' 0 C--N 1.308 -1.603 0 O-C-N 123.647 1.34 . . . . 0.0 110.451 179.686 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.2 -41.17 90.57 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.309 -0.869 . . . . 0.0 111.096 -179.631 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.774 ' HG2' HG22 ' B' ' 17' ' ' VAL . 10.7 mp0 -69.68 -44.82 69.67 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.061 -1.024 . . . . 0.0 111.011 -179.252 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.936 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -62.58 -46.76 86.85 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.306 -0.871 . . . . 0.0 110.769 -179.391 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 15.0 tm0? -65.86 -43.99 86.79 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.177 -0.952 . . . . 0.0 111.067 -179.354 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -65.51 -42.39 92.1 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.065 -1.022 . . . . 0.0 110.631 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.663 ' CB ' HD21 ' A' ' 29' ' ' LEU . 34.9 m -58.08 -50.51 73.2 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.189 -0.944 . . . . 0.0 110.548 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.438 HD12 ' O ' ' A' ' 38' ' ' ALA . 0.5 OUTLIER -58.4 -22.36 19.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.107 -0.995 . . . . 0.0 110.131 -179.924 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -82.15 -15.41 53.43 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.136 -0.978 . . . . 0.0 110.609 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.55 ' HG3' ' CE1' ' A' ' 63' ' ' PHE . 0.8 OUTLIER -113.68 -60.03 1.94 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.033 -1.042 . . . . 0.0 110.682 -179.818 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.564 ' CE ' ' HB3' ' A' ' 60' ' ' TYR . 3.0 ttm -35.3 100.37 0.19 Allowed Pre-proline 0 N--CA 1.495 1.804 0 O-C-N 121.547 -0.72 . . . . 0.0 111.085 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.504 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 18.7 Cg_exo . . . . . 0 C--N 1.305 -1.757 0 O-C-N 124.099 1.578 . . . . 0.0 110.073 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.667 ' C ' HD22 ' A' ' 58' ' ' LEU . . . . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 121.353 0.597 . . . . 0.0 110.361 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.786 HD22 ' N ' ' A' ' 58' ' ' LEU . 3.3 mm? -105.94 160.29 15.38 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.25 -0.907 . . . . 0.0 109.511 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.483 ' C ' ' HG3' ' A' ' 45' ' ' MET . 1.7 m-20 -113.71 111.02 21.12 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.111 -0.993 . . . . 0.0 111.055 -179.365 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.585 ' CE2' ' HB3' ' A' ' 14' ' ' PHE . 15.6 p90 -76.35 -22.76 54.49 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.376 -0.828 . . . . 0.0 109.901 179.422 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.55 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.79 -38.91 70.56 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.341 -0.849 . . . . 0.0 109.632 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.504 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -68.3 -34.68 76.6 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.208 -0.932 . . . . 0.0 109.424 179.376 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.55 ' CE1' ' HG3' ' A' ' 44' ' ' ARG . 4.4 t80 -72.0 -35.84 69.57 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.655 -0.653 . . . . 0.0 110.044 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.5 p -60.83 -49.88 75.71 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.234 -0.916 . . . . 0.0 110.333 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 66.0 p -64.98 -43.84 91.28 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.162 -0.962 . . . . 0.0 110.218 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.48 -31.63 69.52 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.305 -0.872 . . . . 0.0 110.216 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.572 ' CD2' ' HB2' ' B' ' 23' ' ' ALA . 0.6 OUTLIER -65.61 -36.97 85.27 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.203 -0.935 . . . . 0.0 110.202 -179.926 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.835 ' OH ' HG22 ' A' ' 6' ' ' THR . 11.1 m-85 . . . . . 0 N--CA 1.491 1.596 0 O-C-N 121.291 -0.881 . . . . 0.0 110.203 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.279 0.562 . . . . 0.0 110.17 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.76 -45.3 94.5 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.164 -0.96 . . . . 0.0 110.15 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.9 -35.72 69.3 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.232 -0.917 . . . . 0.0 110.042 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -65.26 -45.49 84.34 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.259 -0.901 . . . . 0.0 110.126 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 12' ' ' ALA . . . . . 0.631 ' HB2' HD12 ' A' ' 16' ' ' ILE . . . -62.91 -39.16 93.72 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.248 -0.907 . . . . 0.0 110.106 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.771 ' O ' HG23 ' B' ' 17' ' ' VAL . 25.1 t -62.45 -42.73 96.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.357 -0.839 . . . . 0.0 110.154 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.7 -40.24 83.06 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.264 -0.898 . . . . 0.0 110.097 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.3 m -62.36 -48.19 80.88 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.32 -0.863 . . . . 0.0 110.203 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.407 ' O ' HG23 ' B' ' 20' ' ' VAL . 46.7 t -64.07 -43.62 97.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.247 -0.908 . . . . 0.0 110.268 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.774 HG22 ' HG2' ' A' ' 37' ' ' GLN . 45.2 t -63.01 -49.31 84.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.244 -0.91 . . . . 0.0 110.317 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.34 -32.67 74.15 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.186 -0.946 . . . . 0.0 110.305 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.47 -44.88 77.53 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.198 -0.939 . . . . 0.0 110.411 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.407 HG23 ' O ' ' B' ' 16' ' ' VAL . 97.6 t -67.17 -42.52 88.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.237 -0.914 . . . . 0.0 110.361 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -65.14 -31.73 73.07 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.255 -0.903 . . . . 0.0 110.447 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -64.16 -49.54 71.7 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.173 -0.954 . . . . 0.0 110.573 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 23' ' ' ALA . . . . . 0.572 ' HB2' ' CD2' ' A' ' 67' ' ' LEU . . . -65.19 -34.69 78.97 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.101 -0.999 . . . . 0.0 110.505 -179.774 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.7 ttp85 . . . . . 0 N--CA 1.492 1.629 0 O-C-N 121.289 -0.882 . . . . 0.0 110.634 -179.681 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.64 ' CG2' ' CZ ' ' A' ' 68' ' ' TYR . 31.3 m . . . . . 0 N--CA 1.493 1.691 0 CA-C-O 121.336 0.588 . . . . 0.0 109.985 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.7 -38.29 89.83 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.181 -0.949 . . . . 0.0 109.098 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -59.14 -35.05 72.81 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.585 -0.697 . . . . 0.0 109.57 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.408 ' O ' ' OG ' ' A' ' 13' ' ' SER . 1.8 tt0 -60.87 -44.29 97.25 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.338 -0.851 . . . . 0.0 110.311 -179.507 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.44 HG12 ' CD2' ' A' ' 14' ' ' PHE . 95.7 t -65.66 -41.46 90.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 120.978 -1.076 . . . . 0.0 109.846 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 75.2 mt -65.54 -47.47 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.273 -0.892 . . . . 0.0 109.448 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.76 -45.99 85.16 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.338 -0.851 . . . . 0.0 108.763 179.159 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.498 ' HB2' ' CG2' ' B' ' 16' ' ' VAL . 1.5 p -63.12 -42.98 99.63 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.416 -0.803 . . . . 0.0 108.949 178.826 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.44 ' CD2' HG12 ' A' ' 10' ' ' VAL . 1.1 m-85 -63.61 -41.8 98.28 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.319 -0.863 . . . . 0.0 109.266 179.2 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.625 ' NH2' ' CE2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -55.98 -41.49 74.86 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.482 -0.761 . . . . 0.0 109.321 179.14 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.642 HD12 ' HB2' ' B' ' 12' ' ' ALA . 77.1 mt -61.82 -45.08 99.47 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 O-C-N 121.355 -0.84 . . . . 0.0 109.953 179.545 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.447 HD22 ' HB3' ' A' ' 32' ' ' GLU . 19.9 mt -65.09 -41.31 95.12 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.183 -0.948 . . . . 0.0 110.092 179.718 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.492 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -73.52 -0.26 14.57 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.253 -0.905 . . . . 0.0 110.229 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.476 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 0.1 OUTLIER 56.71 54.59 7.13 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.216 -0.927 . . . . 0.0 110.381 179.834 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.476 ' HB2' ' O ' ' A' ' 19' ' ' SER . 0.8 OUTLIER 58.43 45.25 16.93 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.255 -0.903 . . . . 0.0 110.384 179.765 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.533 ' O ' ' NH2' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -113.15 145.78 33.86 Favored Pre-proline 0 N--CA 1.494 1.746 0 O-C-N 121.15 -0.969 . . . . 0.0 110.267 179.849 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.576 ' HG2' ' CE2' ' A' ' 23' ' ' TYR . 12.3 Cg_endo -61.25 -11.39 18.92 Favored 'Trans proline' 0 C--N 1.303 -1.838 0 O-C-N 123.971 1.511 . . . . 0.0 109.843 179.292 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.576 ' CE2' ' HG2' ' A' ' 22' ' ' PRO . 8.4 p90 -150.2 170.82 18.05 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.243 -0.911 . . . . 0.0 110.292 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.827 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.3 OUTLIER -123.11 145.09 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.329 -0.857 . . . . 0.0 109.878 179.906 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.827 ' N ' HD13 ' A' ' 24' ' ' ILE . 0.4 OUTLIER -94.44 146.75 23.86 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.157 -0.964 . . . . 0.0 110.281 -179.739 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.514 ' HB2' HD11 ' A' ' 58' ' ' LEU . . . -62.42 -34.49 76.87 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.214 -0.929 . . . . 0.0 110.009 179.864 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -70.43 -34.17 72.16 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.357 -0.84 . . . . 0.0 110.223 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.48 ' O ' ' HG2' ' A' ' 32' ' ' GLU . 1.5 tp10 -66.32 -50.94 61.94 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.334 -0.854 . . . . 0.0 110.297 -179.711 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.875 HD12 ' N ' ' A' ' 30' ' ' ARG . 4.4 pp -66.94 -33.57 75.86 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.086 -1.009 . . . . 0.0 109.081 179.243 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.875 ' N ' HD12 ' A' ' 29' ' ' LEU . 4.6 mtt-85 -55.82 -34.8 65.69 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.432 -0.793 . . . . 0.0 109.795 179.304 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -92.81 -18.68 22.57 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.366 -0.834 . . . . 0.0 110.373 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 28' ' ' GLU . 43.8 mm-40 -92.35 -23.32 19.28 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.122 -0.986 . . . . 0.0 110.53 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.605 HD22 ' HB3' ' A' ' 37' ' ' GLN . 0.5 OUTLIER -122.62 144.28 42.03 Favored Pre-proline 0 N--CA 1.487 1.388 0 O-C-N 121.158 -0.964 . . . . 0.0 110.342 -179.791 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.441 ' O ' ' C ' ' A' ' 35' ' ' PRO . 2.4 Cg_endo -46.42 136.54 15.34 Favored 'Trans proline' 0 C--N 1.305 -1.743 0 O-C-N 123.945 1.497 . . . . 0.0 109.67 179.545 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.441 ' C ' ' O ' ' A' ' 34' ' ' PRO . 26.5 Cg_exo -38.07 -37.75 0.66 Allowed 'Trans proline' 0 C--N 1.304 -1.78 0 O-C-N 124.112 1.585 . . . . 0.0 110.784 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -65.93 -47.64 74.04 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.242 -0.911 . . . . 0.0 110.862 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.605 ' HB3' HD22 ' A' ' 33' ' ' LEU . 2.2 mp0 -70.31 -45.55 66.02 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.176 -0.953 . . . . 0.0 110.714 -179.548 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.72 ' HB1' ' CD1' ' A' ' 29' ' ' LEU . . . -55.98 -44.74 78.83 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.279 -0.888 . . . . 0.0 110.663 -179.45 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.8 -40.29 79.55 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.238 -0.914 . . . . 0.0 110.664 -179.627 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.11 -45.43 85.17 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.159 -0.963 . . . . 0.0 110.573 -179.769 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.51 ' O ' ' HG2' ' A' ' 45' ' ' MET . 49.2 m -65.29 -51.44 60.69 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.178 -0.951 . . . . 0.0 110.731 -179.616 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.589 HD11 ' HG3' ' A' ' 30' ' ' ARG . 97.3 mt -45.26 -27.89 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.098 -1.001 . . . . 0.0 110.29 -179.68 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.8 tttp -86.14 -37.36 18.84 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.307 -0.871 . . . . 0.0 110.245 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.598 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 19.1 mmt180 -69.11 -76.47 0.09 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.358 -0.839 . . . . 0.0 110.75 -179.491 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.559 ' CB ' ' O ' ' A' ' 59' ' ' ASP . 2.8 ptp -39.42 102.73 0.26 Allowed Pre-proline 0 N--CA 1.493 1.675 0 O-C-N 121.417 -0.802 . . . . 0.0 110.41 -179.225 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.958 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 13.6 Cg_endo . . . . . 0 C--N 1.307 -1.634 0 O-C-N 124.448 1.762 . . . . 0.0 110.986 -179.341 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.405 ' HB1' ' HB2' ' A' ' 23' ' ' TYR . . . . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 121.386 0.612 . . . . 0.0 110.354 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.514 HD11 ' HB2' ' A' ' 26' ' ' ALA . 64.8 mt -132.7 153.48 51.1 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.277 -0.889 . . . . 0.0 109.666 179.759 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.559 ' O ' ' CB ' ' A' ' 45' ' ' MET . 12.6 t0 -86.98 109.62 19.5 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.033 -1.042 . . . . 0.0 110.326 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.625 ' CE2' ' NH2' ' A' ' 15' ' ' ARG . 26.1 p90 -83.57 -21.96 32.49 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.327 -0.858 . . . . 0.0 109.123 179.17 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.429 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -67.46 -37.72 83.36 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.454 -0.779 . . . . 0.0 109.548 179.472 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.958 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -63.66 -33.02 74.7 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.148 -0.97 . . . . 0.0 109.846 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.598 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 4.1 t80 -71.84 -34.48 69.32 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.503 -0.748 . . . . 0.0 110.163 179.699 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 33.7 p -66.44 -49.77 65.61 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.238 -0.914 . . . . 0.0 110.458 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.74 -39.56 93.83 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.202 -0.936 . . . . 0.0 110.308 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.88 -36.38 80.15 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.246 -0.909 . . . . 0.0 110.329 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.563 HD21 ' O ' ' B' ' 19' ' ' ALA . 0.4 OUTLIER -58.57 -42.25 87.55 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.162 -0.961 . . . . 0.0 110.251 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.64 ' CZ ' ' CG2' ' A' ' 6' ' ' THR . 10.5 m-85 . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.316 -0.865 . . . . 0.0 110.218 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 121.169 0.509 . . . . 0.0 110.241 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.557 ' HA ' HG21 ' A' ' 16' ' ' ILE . 0.6 OUTLIER -58.19 -44.54 88.12 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.166 -0.959 . . . . 0.0 110.051 179.859 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.98 -34.89 78.48 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.266 -0.897 . . . . 0.0 109.982 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -65.55 -40.41 92.83 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.259 -0.9 . . . . 0.0 109.924 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 12' ' ' ALA . . . . . 0.706 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -62.89 -39.38 94.3 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.322 -0.861 . . . . 0.0 109.871 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.841 ' O ' HG23 ' B' ' 17' ' ' VAL . 99.4 t -60.37 -41.59 87.86 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.349 -0.844 . . . . 0.0 109.883 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.78 -42.27 95.22 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.321 -0.862 . . . . 0.0 110.061 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 22.2 m -61.91 -46.07 90.96 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.215 -0.928 . . . . 0.0 110.061 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.706 HG23 ' O ' ' B' ' 12' ' ' ALA . 21.1 t -64.39 -41.76 93.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.228 -0.92 . . . . 0.0 110.014 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.841 HG23 ' O ' ' B' ' 13' ' ' VAL . 91.0 t -60.09 -46.23 94.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.275 -0.891 . . . . 0.0 110.136 179.771 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.17 -42.21 98.17 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.238 -0.913 . . . . 0.0 110.18 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.563 ' O ' HD21 ' A' ' 67' ' ' LEU . . . -65.37 -43.82 89.52 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.256 -0.902 . . . . 0.0 110.212 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.507 HG22 ' HZ ' ' A' ' 63' ' ' PHE . 55.7 t -67.46 -45.57 85.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.256 -0.902 . . . . 0.0 110.169 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -57.25 -33.47 67.62 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.349 -0.844 . . . . 0.0 110.241 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.03 -45.88 90.22 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.248 -0.908 . . . . 0.0 110.211 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -58.51 -35.02 71.61 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.175 -0.953 . . . . 0.0 110.198 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 44.7 ttt180 . . . . . 0 N--CA 1.491 1.589 0 O-C-N 121.218 -0.926 . . . . 0.0 110.185 -179.99 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.994 HG22 ' CE2' ' A' ' 68' ' ' TYR . 1.9 m . . . . . 0 N--CA 1.491 1.621 0 CA-C-O 121.181 0.515 . . . . 0.0 110.375 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -68.36 -39.6 81.76 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.258 -0.901 . . . . 0.0 109.831 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.62 ' HA ' HD12 ' A' ' 11' ' ' ILE . 5.8 tm-20 -67.39 -36.45 81.33 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.392 -0.817 . . . . 0.0 109.9 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 6.0 tp60 -61.29 -45.97 92.24 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.327 -0.858 . . . . 0.0 110.139 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.747 HG12 ' HD2' ' A' ' 14' ' ' PHE . 75.6 t -58.05 -44.88 88.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.24 -0.913 . . . . 0.0 110.071 179.844 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.62 HD12 ' HA ' ' A' ' 8' ' ' GLU . 73.1 mt -54.78 -48.51 73.12 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.239 -0.913 . . . . 0.0 109.716 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.74 -42.67 84.39 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.173 -0.954 . . . . 0.0 109.099 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.438 ' HB2' ' CG2' ' B' ' 16' ' ' VAL . 2.2 m -68.1 -39.75 82.77 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.496 -0.753 . . . . 0.0 109.356 179.134 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.747 ' HD2' HG12 ' A' ' 10' ' ' VAL . 2.4 m-85 -68.58 -42.09 78.73 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.307 -0.871 . . . . 0.0 109.528 179.293 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.3 ttt-85 -53.34 -46.78 69.63 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.284 -0.885 . . . . 0.0 109.42 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.604 HD12 ' HB2' ' B' ' 12' ' ' ALA . 37.8 mt -59.42 -42.54 87.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.352 -0.842 . . . . 0.0 109.571 179.446 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.663 HD11 ' CG2' ' B' ' 13' ' ' VAL . 4.4 mp -63.99 -41.55 97.47 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.358 -0.839 . . . . 0.0 109.806 179.742 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.632 ' HB1' ' O ' ' A' ' 23' ' ' TYR . . . -74.45 -2.81 27.19 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.342 -0.849 . . . . 0.0 110.141 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.43 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.3 OUTLIER 65.29 74.69 0.38 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.263 -0.898 . . . . 0.0 110.258 -179.921 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.8 t0 49.04 59.08 4.7 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.264 -0.897 . . . . 0.0 110.317 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.583 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 11.2 mttt -148.6 144.81 18.88 Favored Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.19 -0.944 . . . . 0.0 110.169 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -77.25 4.33 5.96 Favored 'Trans proline' 0 C--N 1.305 -1.748 0 O-C-N 124.063 1.559 . . . . 0.0 110.117 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.632 ' O ' ' HB1' ' A' ' 18' ' ' ALA . 48.8 p90 -148.99 175.34 11.39 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.208 -0.932 . . . . 0.0 110.319 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.6 tt -151.33 156.96 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.274 -0.891 . . . . 0.0 110.119 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.2 mp -89.26 149.05 23.25 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.264 -0.897 . . . . 0.0 110.258 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.502 ' O ' ' HG ' ' A' ' 29' ' ' LEU . . . -58.03 -34.79 70.45 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.27 -0.894 . . . . 0.0 110.028 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -70.76 -34.11 71.49 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.269 -0.894 . . . . 0.0 110.018 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.453 ' O ' ' CG ' ' A' ' 32' ' ' GLU . 3.8 tp10 -62.5 -50.97 69.27 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.3 -0.875 . . . . 0.0 110.513 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.769 HD12 ' C ' ' A' ' 29' ' ' LEU . 3.5 pp -66.98 -33.16 74.96 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.006 -1.059 . . . . 0.0 109.295 179.444 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.76 ' N ' HD12 ' A' ' 29' ' ' LEU . 3.2 ttt85 -58.18 -34.75 70.68 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.394 -0.816 . . . . 0.0 109.61 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.8 ttt180 -91.62 -29.85 16.67 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.433 -0.792 . . . . 0.0 110.196 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.453 ' CG ' ' O ' ' A' ' 28' ' ' GLU . 5.0 mm-40 -82.2 -23.56 35.39 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.174 -0.954 . . . . 0.0 110.26 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.755 HD23 ' HD2' ' A' ' 34' ' ' PRO . 6.5 mt -119.96 146.9 43.15 Favored Pre-proline 0 N--CA 1.489 1.476 0 O-C-N 121.257 -0.902 . . . . 0.0 110.094 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.755 ' HD2' HD23 ' A' ' 33' ' ' LEU . 1.1 Cg_endo -53.67 158.19 8.62 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 O-C-N 123.938 1.493 . . . . 0.0 110.284 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -50.54 -39.44 55.35 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 124.108 1.583 . . . . 0.0 110.69 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.97 -46.46 81.39 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.21 -0.932 . . . . 0.0 110.445 -179.793 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.574 ' CB ' HD22 ' A' ' 33' ' ' LEU . 58.5 mm-40 -69.66 -38.33 77.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.25 -0.906 . . . . 0.0 110.686 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.617 ' HA ' HD13 ' A' ' 29' ' ' LEU . . . -57.46 -42.12 81.91 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.203 -0.936 . . . . 0.0 110.798 -179.497 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.5 tp60 -60.69 -47.08 87.87 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.179 -0.951 . . . . 0.0 110.692 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -66.0 -43.87 86.49 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.21 -0.931 . . . . 0.0 110.586 -179.599 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.453 ' HB3' HD22 ' A' ' 29' ' ' LEU . 3.2 m -62.67 -42.91 99.88 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.223 -0.923 . . . . 0.0 111.005 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.73 HG13 HD21 ' A' ' 29' ' ' LEU . 68.6 mt -75.2 -12.35 14.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.067 -1.021 . . . . 0.0 110.524 -179.435 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.88 -16.07 49.01 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.23 -0.919 . . . . 0.0 111.129 -179.359 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.514 ' O ' ' C ' ' A' ' 45' ' ' MET . 1.1 mpp_? -117.26 -56.66 2.22 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.086 -1.009 . . . . 0.0 110.997 -179.479 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.539 ' HE2' ' HA ' ' A' ' 60' ' ' TYR . 3.9 ttm -29.48 94.52 0.06 OUTLIER Pre-proline 0 N--CA 1.498 1.964 0 O-C-N 121.691 -0.63 . . . . 0.0 111.531 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.471 ' N ' ' O ' ' A' ' 44' ' ' ARG . 11.5 Cg_endo . . . . . 0 C--N 1.307 -1.641 0 O-C-N 124.121 1.59 . . . . 0.0 110.363 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.565 ' C ' HD22 ' A' ' 58' ' ' LEU . . . . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 121.293 0.568 . . . . 0.0 110.227 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.849 HD22 ' N ' ' A' ' 58' ' ' LEU . 2.1 mm? -112.77 156.4 22.91 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.226 -0.921 . . . . 0.0 109.785 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.485 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.6 OUTLIER -111.53 110.46 20.89 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.068 -1.02 . . . . 0.0 110.441 -179.855 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.539 ' HA ' ' HE2' ' A' ' 45' ' ' MET . 18.4 p90 -75.02 -21.75 58.89 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.263 -0.898 . . . . 0.0 109.593 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.519 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.9 -39.15 71.17 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.295 -0.878 . . . . 0.0 109.457 179.723 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.47 -32.33 73.2 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.34 -0.85 . . . . 0.0 109.087 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.473 ' O ' ' HB3' ' A' ' 67' ' ' LEU . 2.0 t80 -61.78 -38.53 88.39 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-O 121.192 0.52 . . . . 0.0 110.35 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 25.1 m -56.79 -49.67 74.62 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.329 -0.857 . . . . 0.0 110.825 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.0 m -66.18 -36.16 82.36 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.076 -1.015 . . . . 0.0 110.74 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.88 -30.12 56.08 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.145 -0.972 . . . . 0.0 110.842 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.543 ' O ' HD12 ' A' ' 67' ' ' LEU . 0.3 OUTLIER -78.18 -46.77 19.64 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.066 -1.021 . . . . 0.0 109.945 -179.632 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.994 ' CE2' HG22 ' A' ' 6' ' ' THR . 12.4 m-85 . . . . . 0 N--CA 1.492 1.652 0 C-N-CA 119.939 -0.705 . . . . 0.0 110.463 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.44 ' HE3' HD13 ' A' ' 16' ' ' ILE . 1.5 ttpt . . . . . 0 N--CA 1.492 1.649 0 CA-C-O 121.142 0.496 . . . . 0.0 110.143 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 1.4 ttmt -58.75 -40.25 83.29 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.122 -0.986 . . . . 0.0 110.001 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.06 -35.43 80.21 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.24 -0.912 . . . . 0.0 109.888 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.6 tm-20 -65.96 -40.32 91.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.373 -0.83 . . . . 0.0 110.144 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 12' ' ' ALA . . . . . 0.604 ' HB2' HD12 ' A' ' 16' ' ' ILE . . . -62.54 -41.76 99.09 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.338 -0.851 . . . . 0.0 110.068 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.766 ' O ' HG23 ' B' ' 17' ' ' VAL . 58.1 t -63.36 -40.55 89.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.264 -0.897 . . . . 0.0 109.892 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.77 -39.04 87.33 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.369 -0.832 . . . . 0.0 110.276 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 23.7 m -66.15 -43.67 86.36 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.212 -0.93 . . . . 0.0 110.312 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.438 ' CG2' ' HB2' ' A' ' 13' ' ' SER . 61.5 t -67.53 -40.41 84.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.283 -0.886 . . . . 0.0 110.363 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.766 HG23 ' O ' ' B' ' 13' ' ' VAL . 98.8 t -58.14 -49.0 83.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.233 -0.917 . . . . 0.0 110.498 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.44 -38.83 92.4 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.24 -0.912 . . . . 0.0 110.276 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.45 -46.04 74.24 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.261 -0.9 . . . . 0.0 110.145 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.554 HG11 ' OE1' ' A' ' 37' ' ' GLN . 83.8 t -67.49 -45.92 84.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.291 -0.881 . . . . 0.0 110.091 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 21' ' ' ASP . . . . . 0.401 ' HB2' ' O ' ' B' ' 17' ' ' VAL . 2.5 t70 -57.46 -38.23 74.13 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.204 -0.935 . . . . 0.0 110.194 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.27 -45.32 72.41 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.226 -0.921 . . . . 0.0 109.946 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 23' ' ' ALA . . . . . 0.417 ' HB2' HD13 ' A' ' 67' ' ' LEU . . . -64.52 -38.81 92.32 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.372 -0.83 . . . . 0.0 109.84 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 22.1 ttt-85 . . . . . 0 N--CA 1.49 1.573 0 O-C-N 121.232 -0.918 . . . . 0.0 109.928 179.767 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.548 ' CG2' ' CE1' ' A' ' 68' ' ' TYR . 3.4 m . . . . . 0 N--CA 1.493 1.699 0 CA-C-O 121.268 0.556 . . . . 0.0 110.076 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -66.57 -44.43 82.29 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.243 -0.91 . . . . 0.0 109.64 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -58.83 -36.52 74.65 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.482 -0.761 . . . . 0.0 109.914 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.49 -47.68 84.52 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.324 -0.86 . . . . 0.0 110.113 -179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.517 HG12 ' CD2' ' A' ' 14' ' ' PHE . 24.5 t -57.98 -51.18 73.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.289 -0.882 . . . . 0.0 109.784 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.404 HG23 ' HE1' ' A' ' 60' ' ' TYR . 16.5 mt -57.88 -49.7 80.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.392 -0.818 . . . . 0.0 109.621 179.516 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.91 -41.89 83.6 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.289 -0.882 . . . . 0.0 109.183 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 65.3 m -67.96 -37.09 81.14 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.392 -0.817 . . . . 0.0 109.33 179.177 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.591 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 2.1 m-85 -67.91 -44.14 77.61 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.31 -0.869 . . . . 0.0 109.644 179.452 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.68 -48.12 72.79 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.266 -0.896 . . . . 0.0 109.608 179.531 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 60.8 mt -60.33 -42.95 92.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.313 -0.867 . . . . 0.0 109.776 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.604 HD12 ' CD ' ' A' ' 32' ' ' GLU . 1.8 mm? -62.5 -40.54 97.03 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.32 -0.863 . . . . 0.0 109.915 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.486 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -82.9 7.62 14.87 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.394 -0.816 . . . . 0.0 110.295 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.486 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.8 OUTLIER 67.37 66.27 0.4 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.208 -0.933 . . . . 0.0 110.278 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.454 ' N ' ' OD1' ' A' ' 20' ' ' ASP . 1.0 OUTLIER 49.52 62.03 2.84 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.273 -0.892 . . . . 0.0 110.38 179.906 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.598 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 25.6 mttm -140.84 141.96 26.4 Favored Pre-proline 0 N--CA 1.488 1.454 0 O-C-N 121.235 -0.916 . . . . 0.0 110.074 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -72.02 -1.03 9.39 Favored 'Trans proline' 0 C--N 1.305 -1.748 0 O-C-N 124.059 1.558 . . . . 0.0 110.211 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.598 ' CZ ' ' HD3' ' A' ' 21' ' ' LYS . 39.6 p90 -142.07 162.39 35.61 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.287 -0.883 . . . . 0.0 110.035 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.832 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -128.1 140.6 48.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.151 -0.968 . . . . 0.0 110.238 -179.84 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.832 ' N ' HD13 ' A' ' 24' ' ' ILE . 1.1 mt -80.33 144.61 32.63 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.265 -0.897 . . . . 0.0 110.167 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.496 ' HA ' ' CD2' ' A' ' 29' ' ' LEU . . . -62.65 -36.54 83.16 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.338 -0.851 . . . . 0.0 110.296 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -68.25 -34.6 76.51 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.105 -0.997 . . . . 0.0 109.936 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.484 ' O ' ' CG ' ' A' ' 32' ' ' GLU . 62.2 mt-10 -65.88 -50.36 64.8 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.29 -0.881 . . . . 0.0 110.003 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.55 HD12 ' CB ' ' A' ' 38' ' ' ALA . 1.7 pp -67.2 -32.99 74.43 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.2 -0.938 . . . . 0.0 109.933 179.62 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.636 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 6.8 mtt180 -66.35 -34.16 77.35 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.28 -0.887 . . . . 0.0 110.639 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 31' ' ' ARG . 1.5 ttt180 -95.36 -25.54 16.25 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.176 -0.953 . . . . 0.0 111.614 -178.705 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.648 ' HG3' HD12 ' A' ' 33' ' ' LEU . 15.5 pt-20 -92.13 -24.16 19.19 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.815 -1.178 . . . . 0.0 111.204 -178.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.694 HD23 ' CB ' ' A' ' 37' ' ' GLN . 0.1 OUTLIER -108.63 141.89 24.27 Favored Pre-proline 0 N--CA 1.492 1.643 0 O-C-N 121.043 -1.035 . . . . 0.0 110.427 -179.972 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.423 ' O ' ' C ' ' A' ' 35' ' ' PRO . 23.1 Cg_exo -44.54 137.7 8.23 Favored 'Trans proline' 0 C--N 1.303 -1.818 0 O-C-N 124.2 1.632 . . . . 0.0 109.765 179.664 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.423 ' C ' ' O ' ' A' ' 34' ' ' PRO . 37.1 Cg_endo -39.6 -38.49 1.66 Allowed 'Trans proline' 0 C--N 1.305 -1.721 0 O-C-N 124.039 1.547 . . . . 0.0 110.378 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -66.21 -45.71 79.8 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.275 -0.89 . . . . 0.0 110.665 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.694 ' CB ' HD23 ' A' ' 33' ' ' LEU . 52.4 mm-40 -69.97 -42.56 73.0 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.171 -0.955 . . . . 0.0 110.797 -179.429 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.636 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -63.54 -48.76 76.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.107 -0.995 . . . . 0.0 110.521 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.9 tm0? -56.24 -43.08 78.31 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.196 -0.94 . . . . 0.0 110.499 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -66.27 -42.88 87.85 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.228 -0.92 . . . . 0.0 110.285 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 45' ' ' MET . 84.5 m -65.0 -50.93 64.38 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.273 -0.892 . . . . 0.0 110.446 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.539 ' CD1' HD21 ' A' ' 29' ' ' LEU . 19.0 mm -40.41 -32.07 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.291 -0.881 . . . . 0.0 110.325 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.48 -42.19 14.69 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.377 -0.827 . . . . 0.0 110.805 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.586 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 3.9 mmt180 -63.7 -74.71 0.09 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.205 -0.934 . . . . 0.0 110.499 -179.405 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.532 ' HE2' ' CA ' ' A' ' 60' ' ' TYR . 6.8 ptp -56.82 119.48 30.29 Favored Pre-proline 0 N--CA 1.489 1.479 0 O-C-N 121.05 -1.031 . . . . 0.0 110.2 -179.723 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 45' ' ' MET . 11.8 Cg_exo . . . . . 0 C--N 1.305 -1.726 0 O-C-N 123.972 1.511 . . . . 0.0 110.236 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.69 ' C ' HD22 ' A' ' 58' ' ' LEU . . . . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.187 0.518 . . . . 0.0 110.174 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.841 HD22 ' N ' ' A' ' 58' ' ' LEU . 2.5 mm? -116.62 159.61 21.92 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.307 -0.87 . . . . 0.0 110.08 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.453 ' O ' ' HB2' ' A' ' 45' ' ' MET . 88.1 m-20 -109.32 114.36 27.97 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.248 -0.907 . . . . 0.0 110.183 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.591 ' HB2' ' CD2' ' A' ' 14' ' ' PHE . 23.8 p90 -84.31 -24.85 29.67 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.246 -0.909 . . . . 0.0 110.094 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.501 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.26 -35.9 67.94 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.243 -0.911 . . . . 0.0 109.93 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.99 -33.0 73.8 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.289 -0.882 . . . . 0.0 109.972 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.586 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 1.8 t80 -71.66 -32.75 68.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.558 -0.714 . . . . 0.0 110.053 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.8 t -66.27 -47.31 74.08 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.279 -0.888 . . . . 0.0 110.325 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.7 t -65.51 -36.83 85.0 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.192 -0.943 . . . . 0.0 110.357 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -75.21 -28.81 60.1 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.185 -0.947 . . . . 0.0 110.272 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.824 HD21 ' HB1' ' B' ' 19' ' ' ALA . 0.4 OUTLIER -78.48 -45.25 22.54 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.214 -0.929 . . . . 0.0 109.584 179.966 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.548 ' CE1' ' CG2' ' A' ' 6' ' ' THR . 17.4 m-85 . . . . . 0 N--CA 1.492 1.627 0 O-C-N 121.485 -0.76 . . . . 0.0 110.281 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 4.8 mttt . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 121.229 0.537 . . . . 0.0 110.086 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 14.1 ttmt -61.56 -49.56 76.18 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.269 -0.894 . . . . 0.0 110.083 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.15 -38.14 67.87 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.222 -0.924 . . . . 0.0 109.945 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -66.09 -40.06 90.51 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.286 -0.884 . . . . 0.0 109.814 179.664 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.7 -37.05 84.95 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.32 -0.863 . . . . 0.0 110.07 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.63 ' O ' HG23 ' B' ' 17' ' ' VAL . 76.6 t -62.49 -40.85 89.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.215 -0.928 . . . . 0.0 109.826 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.28 -38.07 82.44 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.345 -0.847 . . . . 0.0 109.999 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 56.3 m -62.93 -50.33 71.24 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.37 -0.831 . . . . 0.0 110.059 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 92.8 t -62.32 -43.91 98.6 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.318 -0.864 . . . . 0.0 110.053 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.63 HG23 ' O ' ' B' ' 13' ' ' VAL . 93.5 t -59.83 -45.24 95.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.256 -0.903 . . . . 0.0 110.038 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.47 -38.06 89.69 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.179 -0.951 . . . . 0.0 110.094 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.824 ' HB1' HD21 ' A' ' 67' ' ' LEU . . . -64.66 -44.15 91.32 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.256 -0.902 . . . . 0.0 110.178 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.56 HG22 ' CZ ' ' A' ' 63' ' ' PHE . 56.4 t -66.16 -39.78 85.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.238 -0.914 . . . . 0.0 110.265 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -65.46 -31.51 72.64 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.192 -0.942 . . . . 0.0 110.234 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -62.59 -38.21 89.23 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.283 -0.885 . . . . 0.0 110.318 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.74 -39.19 93.68 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.202 -0.936 . . . . 0.0 110.38 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.642 0 O-C-N 121.246 -0.909 . . . . 0.0 109.965 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.298 0.571 . . . . 0.0 110.233 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.11 -47.69 83.48 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.235 -0.915 . . . . 0.0 109.82 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -54.4 -36.23 63.71 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.422 -0.799 . . . . 0.0 109.791 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -61.46 -44.58 96.85 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.401 -0.812 . . . . 0.0 110.281 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.544 HG12 ' CD2' ' A' ' 14' ' ' PHE . 41.7 t -62.64 -41.27 91.54 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.14 -0.975 . . . . 0.0 109.967 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 58.6 mt -59.3 -47.11 91.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.32 -0.862 . . . . 0.0 109.743 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.63 -42.59 83.69 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.265 -0.897 . . . . 0.0 109.055 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.454 ' O ' ' HB1' ' B' ' 12' ' ' ALA . 0.0 OUTLIER -67.74 -38.42 83.5 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.437 -0.789 . . . . 0.0 109.21 178.914 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.544 ' CD2' HG12 ' A' ' 10' ' ' VAL . 0.9 OUTLIER -68.42 -43.22 77.64 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.33 -0.857 . . . . 0.0 109.647 179.284 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.1 ttt180 -53.42 -46.42 69.78 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.264 -0.898 . . . . 0.0 109.565 179.479 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.496 HG21 ' HA ' ' B' ' 9' ' ' LYS . 42.7 mt -58.13 -45.01 88.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.23 -0.918 . . . . 0.0 109.705 179.562 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.447 HD11 ' CG2' ' B' ' 13' ' ' VAL . 1.3 mp -63.13 -41.65 99.35 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.396 -0.815 . . . . 0.0 109.74 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.564 ' HB2' ' HB ' ' A' ' 24' ' ' ILE . . . -75.92 -1.78 27.14 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.319 -0.863 . . . . 0.0 110.04 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 67.61 62.43 0.43 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.29 -0.881 . . . . 0.0 110.446 179.997 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' A' ' 19' ' ' SER . 87.0 m-20 54.1 61.22 3.15 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.257 -0.902 . . . . 0.0 110.362 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.418 ' HE3' ' O ' ' A' ' 18' ' ' ALA . 39.2 mtmt -149.03 142.71 16.3 Favored Pre-proline 0 N--CA 1.489 1.495 0 O-C-N 121.297 -0.877 . . . . 0.0 109.86 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -69.9 -3.57 12.37 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 O-C-N 123.981 1.516 . . . . 0.0 110.095 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 33.1 p90 -145.74 159.16 43.58 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.252 -0.905 . . . . 0.0 110.154 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.564 ' HB ' ' HB2' ' A' ' 18' ' ' ALA . 10.5 tt -136.15 153.84 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.213 -0.929 . . . . 0.0 110.216 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.438 HD23 ' HA ' ' A' ' 25' ' ' LEU . 39.9 mt -80.86 134.3 35.74 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.196 -0.94 . . . . 0.0 110.234 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.412 ' HB2' ' CD1' ' A' ' 58' ' ' LEU . . . -55.52 -40.12 71.39 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.231 -0.918 . . . . 0.0 109.875 179.728 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -61.68 -38.29 87.27 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.319 -0.863 . . . . 0.0 109.729 179.622 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.432 ' HG2' ' OE2' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -68.66 -43.73 75.59 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.297 -0.877 . . . . 0.0 109.229 179.315 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.763 ' CD1' HD12 ' A' ' 33' ' ' LEU . 0.8 OUTLIER -64.27 -39.95 94.98 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.513 -0.742 . . . . 0.0 109.199 179.124 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.639 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -58.38 -34.77 71.08 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.544 -0.722 . . . . 0.0 110.236 179.826 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.8 ttt85 -93.12 -17.93 23.2 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.258 -0.901 . . . . 0.0 110.441 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.432 ' OE2' ' HG2' ' A' ' 28' ' ' GLU . 0.4 OUTLIER -88.56 -23.25 23.2 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.168 -0.957 . . . . 0.0 110.352 -179.893 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.763 HD12 ' CD1' ' A' ' 29' ' ' LEU . 13.1 mt -123.61 143.93 42.99 Favored Pre-proline 0 C--N 1.304 -1.381 0 O-C-N 121.231 -0.918 . . . . 0.0 110.383 -179.51 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.429 ' HD2' ' HB2' ' A' ' 37' ' ' GLN . 30.3 Cg_exo -46.62 145.19 6.68 Favored 'Trans proline' 0 C--N 1.305 -1.747 0 O-C-N 123.951 1.5 . . . . 0.0 109.918 179.714 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.424 ' O ' ' HB2' ' A' ' 39' ' ' GLN . 27.8 Cg_endo -42.12 -40.47 6.48 Favored 'Trans proline' 0 C--N 1.304 -1.802 0 O-C-N 123.94 1.495 . . . . 0.0 110.371 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -65.77 -46.92 76.97 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.226 -0.921 . . . . 0.0 110.578 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.474 ' OE1' HG13 ' B' ' 17' ' ' VAL . 1.2 mp0 -69.41 -43.63 73.03 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.219 -0.926 . . . . 0.0 110.289 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.639 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -61.19 -48.13 82.95 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.366 -0.834 . . . . 0.0 110.5 -179.651 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.432 ' O ' ' HB2' ' A' ' 43' ' ' LYS . 9.8 tt0 -57.51 -48.04 80.34 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.174 -0.954 . . . . 0.0 110.106 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -64.02 -41.56 97.42 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.262 -0.899 . . . . 0.0 110.241 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 66.9 m -64.53 -50.77 66.04 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.212 -0.93 . . . . 0.0 110.257 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.493 HG13 HD21 ' A' ' 29' ' ' LEU . 64.2 mt -66.72 -14.42 17.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.269 -0.895 . . . . 0.0 109.955 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.541 ' HD3' ' CZ ' ' A' ' 44' ' ' ARG . 9.8 tttp -73.55 -16.23 61.27 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.379 -0.825 . . . . 0.0 110.253 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.649 ' CB ' ' CD1' ' A' ' 63' ' ' PHE . 5.1 mpt_? -119.06 -58.42 1.94 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.358 -0.839 . . . . 0.0 110.647 -179.6 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.629 ' HE2' ' HA ' ' A' ' 60' ' ' TYR . 3.9 ttm -26.96 90.99 0.05 OUTLIER Pre-proline 0 N--CA 1.499 1.994 0 O-C-N 121.973 -0.454 . . . . 0.0 111.529 -179.663 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.52 ' N ' ' O ' ' A' ' 44' ' ' ARG . 18.1 Cg_endo . . . . . 0 C--N 1.305 -1.728 0 O-C-N 124.141 1.601 . . . . 0.0 110.172 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.551 0 CA-C-O 121.284 0.564 . . . . 0.0 110.205 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.439 ' HB3' ' HG2' ' A' ' 45' ' ' MET . 45.0 mt -130.05 160.15 34.56 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.237 -0.914 . . . . 0.0 109.997 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.486 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.8 OUTLIER -113.38 110.77 20.86 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.086 -1.008 . . . . 0.0 110.706 179.925 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.629 ' HA ' ' HE2' ' A' ' 45' ' ' MET . 18.3 p90 -73.01 -28.12 62.18 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.26 -0.9 . . . . 0.0 109.512 179.283 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.612 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.09 -43.42 78.02 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.445 -0.784 . . . . 0.0 109.881 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.466 ' HB3' ' OD1' ' A' ' 59' ' ' ASP . . . -62.34 -33.3 74.44 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.252 -0.905 . . . . 0.0 109.798 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.649 ' CD1' ' CB ' ' A' ' 44' ' ' ARG . 4.0 t80 -72.12 -34.58 68.7 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.605 -0.684 . . . . 0.0 110.207 179.761 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.28 -49.67 74.73 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.259 -0.901 . . . . 0.0 110.388 -179.716 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.1 t -58.46 -39.06 78.9 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.178 -0.951 . . . . 0.0 110.293 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.06 -39.76 75.47 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.32 -0.863 . . . . 0.0 110.245 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.632 HD11 ' CZ ' ' A' ' 63' ' ' PHE . 1.8 mt -59.91 -40.04 87.44 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.24 -0.913 . . . . 0.0 110.277 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 . . . . . 0 N--CA 1.492 1.632 0 O-C-N 121.238 -0.914 . . . . 0.0 110.252 -179.922 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 121.191 0.52 . . . . 0.0 110.218 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.496 ' HA ' HG21 ' A' ' 16' ' ' ILE . 1.4 ttpt -62.39 -42.3 99.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.23 -0.919 . . . . 0.0 110.011 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.31 -36.11 75.04 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.265 -0.897 . . . . 0.0 109.911 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.42 -42.16 83.68 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.253 -0.904 . . . . 0.0 109.938 179.739 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 12' ' ' ALA . . . . . 0.561 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -62.72 -40.89 98.6 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.299 -0.875 . . . . 0.0 109.445 179.494 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.596 ' O ' HG23 ' B' ' 17' ' ' VAL . 73.7 t -63.36 -40.39 88.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.356 -0.84 . . . . 0.0 109.493 179.307 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.71 -35.82 79.15 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.39 -0.819 . . . . 0.0 110.074 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 2.4 m -70.07 -47.22 62.82 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.214 -0.929 . . . . 0.0 110.319 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.561 HG23 ' O ' ' B' ' 12' ' ' ALA . 23.1 t -62.33 -43.09 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.248 -0.908 . . . . 0.0 110.352 -179.757 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.596 HG23 ' O ' ' B' ' 13' ' ' VAL . 88.1 t -62.08 -51.04 77.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.276 -0.89 . . . . 0.0 110.334 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.68 -40.16 86.89 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.213 -0.929 . . . . 0.0 110.286 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.85 -41.21 97.84 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.201 -0.937 . . . . 0.0 110.196 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.47 HG23 ' O ' ' B' ' 16' ' ' VAL . 71.5 t -66.79 -41.29 87.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.191 -0.943 . . . . 0.0 110.223 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -64.58 -39.59 94.0 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.273 -0.892 . . . . 0.0 110.307 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -58.44 -47.52 83.7 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.085 -1.009 . . . . 0.0 110.308 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 23' ' ' ALA . . . . . 0.499 ' HB2' HD22 ' A' ' 67' ' ' LEU . . . -57.3 -40.8 78.6 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.31 -0.869 . . . . 0.0 110.345 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 3.4 mmm-85 . . . . . 0 N--CA 1.492 1.629 0 O-C-N 121.262 -0.899 . . . . 0.0 110.192 -179.878 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.221 0.534 . . . . 0.0 110.208 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.504 ' O ' HD12 ' A' ' 11' ' ' ILE . . . -63.55 -50.01 71.19 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.243 -0.91 . . . . 0.0 109.821 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -36.7 65.53 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.392 -0.817 . . . . 0.0 109.942 179.674 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.1 tp60 -61.61 -37.49 84.12 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.232 -0.917 . . . . 0.0 110.2 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.435 HG12 ' HD2' ' A' ' 14' ' ' PHE . 66.9 t -58.13 -43.49 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.163 -0.961 . . . . 0.0 109.951 179.805 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.504 HD12 ' O ' ' A' ' 7' ' ' ALA . 2.2 mp -62.77 -48.66 87.05 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.278 -0.889 . . . . 0.0 109.54 179.541 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.69 -42.31 83.39 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.213 -0.93 . . . . 0.0 109.095 179.184 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.418 ' HA ' ' HB1' ' B' ' 12' ' ' ALA . 4.7 p -66.68 -39.14 88.0 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.394 -0.816 . . . . 0.0 109.046 178.945 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.541 ' HB3' ' CZ ' ' A' ' 60' ' ' TYR . 1.1 m-85 -68.6 -41.91 78.92 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.374 -0.829 . . . . 0.0 109.522 179.039 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.9 ttt180 -54.12 -44.02 70.97 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.341 -0.849 . . . . 0.0 109.629 179.463 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.635 HG21 ' HA ' ' B' ' 9' ' ' LYS . 68.3 mt -62.63 -44.93 99.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.409 -0.807 . . . . 0.0 109.859 179.607 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.404 HD23 HD12 ' A' ' 33' ' ' LEU . 6.4 mp -65.0 -34.4 78.36 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.373 -0.829 . . . . 0.0 109.899 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.491 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -81.07 -1.62 44.9 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.32 -0.863 . . . . 0.0 110.162 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.414 ' HB3' ' O ' ' A' ' 18' ' ' ALA . 8.8 t 59.01 74.75 0.43 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.251 -0.905 . . . . 0.0 110.206 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 47.77 62.63 2.37 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.267 -0.896 . . . . 0.0 110.208 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.586 ' HD2' ' CZ ' ' A' ' 23' ' ' TYR . 0.8 OUTLIER -145.96 142.91 18.34 Favored Pre-proline 0 N--CA 1.489 1.493 0 O-C-N 121.239 -0.913 . . . . 0.0 110.144 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -76.37 3.2 6.51 Favored 'Trans proline' 0 C--N 1.303 -1.831 0 O-C-N 124.094 1.576 . . . . 0.0 110.127 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.586 ' CZ ' ' HD2' ' A' ' 21' ' ' LYS . 9.1 p90 -148.91 167.9 24.5 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.224 -0.922 . . . . 0.0 110.228 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.718 HD13 ' H ' ' A' ' 25' ' ' LEU . 0.3 OUTLIER -129.11 145.48 35.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.19 -0.944 . . . . 0.0 110.053 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.718 ' H ' HD13 ' A' ' 24' ' ' ILE . 4.7 mt -89.42 151.18 22.16 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.236 -0.915 . . . . 0.0 110.235 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.82 -39.35 91.49 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.229 -0.92 . . . . 0.0 110.046 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -65.52 -34.9 79.33 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.298 -0.876 . . . . 0.0 110.077 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.454 ' HB3' HD11 ' A' ' 24' ' ' ILE . 12.2 mm-40 -62.07 -46.42 89.17 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.399 -0.813 . . . . 0.0 110.15 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.404 HD21 HG13 ' A' ' 24' ' ' ILE . 21.7 mt -59.86 -35.38 74.67 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.237 -0.914 . . . . 0.0 109.961 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.2 mmm-85 -69.06 -35.74 76.87 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.299 -0.876 . . . . 0.0 110.696 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -90.1 -29.79 18.09 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.149 -0.969 . . . . 0.0 110.71 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.434 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 3.1 mm-40 -91.61 -23.19 19.94 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.107 -0.996 . . . . 0.0 110.57 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.924 HD22 ' HB3' ' A' ' 37' ' ' GLN . 0.3 OUTLIER -128.48 144.95 53.97 Favored Pre-proline 0 N--CA 1.489 1.48 0 O-C-N 121.073 -1.017 . . . . 0.0 110.385 -179.715 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.781 ' HD2' HD23 ' A' ' 33' ' ' LEU . 2.6 Cg_endo -49.01 142.09 20.8 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 O-C-N 124.082 1.57 . . . . 0.0 110.107 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -43.31 -33.56 4.01 Favored 'Trans proline' 0 C--N 1.304 -1.792 0 O-C-N 124.005 1.529 . . . . 0.0 110.611 -179.792 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -65.38 -47.11 77.52 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.112 -0.992 . . . . 0.0 110.341 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.924 ' HB3' HD22 ' A' ' 33' ' ' LEU . 1.7 mp0 -70.18 -42.1 72.85 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.189 -0.945 . . . . 0.0 110.355 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.28 -42.61 77.74 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.258 -0.901 . . . . 0.0 110.62 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -60.53 -48.55 81.29 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.168 -0.957 . . . . 0.0 110.429 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -63.51 -46.74 84.69 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.162 -0.961 . . . . 0.0 110.471 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 89.0 m -65.3 -41.06 94.47 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.257 -0.902 . . . . 0.0 110.623 -179.615 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 63.0 mt -67.85 -23.03 28.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.183 -0.948 . . . . 0.0 110.601 -179.703 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -84.79 -23.54 29.12 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.191 -0.943 . . . . 0.0 110.783 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.502 ' HG2' ' CE1' ' A' ' 63' ' ' PHE . 0.7 OUTLIER -92.49 -56.91 2.85 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.108 -0.995 . . . . 0.0 110.641 -179.544 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.565 ' HE1' ' HB3' ' A' ' 60' ' ' TYR . 0.6 OUTLIER -33.98 103.57 0.23 Allowed Pre-proline 0 N--CA 1.496 1.839 0 O-C-N 121.606 -0.684 . . . . 0.0 111.059 -179.845 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.426 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 32.2 Cg_exo . . . . . 0 C--N 1.307 -1.65 0 O-C-N 124.122 1.59 . . . . 0.0 110.359 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 121.311 0.577 . . . . 0.0 110.356 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.459 ' HB3' ' HB3' ' A' ' 45' ' ' MET . 15.0 mt -127.86 154.31 45.62 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.331 -0.856 . . . . 0.0 109.871 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.483 ' C ' ' HG3' ' A' ' 45' ' ' MET . 5.5 m-20 -105.23 110.87 23.4 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.105 -0.997 . . . . 0.0 110.552 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.565 ' HB3' ' HE1' ' A' ' 45' ' ' MET . 22.2 p90 -80.42 -21.22 42.43 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.322 -0.861 . . . . 0.0 109.759 179.542 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.509 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.9 -37.85 69.42 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.372 -0.83 . . . . 0.0 109.808 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.426 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -65.06 -33.75 76.78 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.246 -0.909 . . . . 0.0 109.642 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.502 ' CE1' ' HG2' ' A' ' 44' ' ' ARG . 1.5 t80 -71.91 -35.93 69.83 Favored 'General case' 0 C--N 1.299 -1.597 0 O-C-N 121.553 -0.717 . . . . 0.0 109.874 179.539 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.34 -49.61 76.58 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.279 -0.888 . . . . 0.0 110.074 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 41.8 m -64.3 -36.85 85.44 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.183 -0.948 . . . . 0.0 110.05 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.47 -34.43 72.39 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.297 -0.877 . . . . 0.0 110.024 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.59 HD21 ' HB2' ' B' ' 23' ' ' ALA . 0.2 OUTLIER -61.38 -44.75 96.62 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.285 -0.884 . . . . 0.0 109.955 179.891 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 . . . . . 0 N--CA 1.489 1.521 0 O-C-N 121.298 -0.876 . . . . 0.0 110.129 179.676 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.453 ' O ' ' HG3' ' B' ' 8' ' ' LYS . 5.5 ptpp? . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 121.218 0.532 . . . . 0.0 110.264 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.635 ' HA ' HG21 ' A' ' 16' ' ' ILE . 3.4 ttmt -57.66 -49.18 77.34 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.191 -0.943 . . . . 0.0 109.882 179.874 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.69 -33.84 64.53 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.252 -0.905 . . . . 0.0 109.612 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.66 -40.55 84.51 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.352 -0.843 . . . . 0.0 109.878 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 12' ' ' ALA . . . . . 0.599 ' HB2' HD12 ' A' ' 16' ' ' ILE . . . -62.66 -42.78 99.8 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.324 -0.86 . . . . 0.0 109.715 179.682 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.92 ' O ' HG23 ' B' ' 17' ' ' VAL . 70.2 t -59.48 -40.46 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.358 -0.839 . . . . 0.0 109.593 179.464 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.9 -41.41 87.15 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.402 -0.811 . . . . 0.0 109.893 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.11 -44.95 94.21 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.357 -0.839 . . . . 0.0 110.129 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.445 ' O ' HG23 ' B' ' 20' ' ' VAL . 95.6 t -64.31 -42.9 96.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.302 -0.873 . . . . 0.0 109.921 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.92 HG23 ' O ' ' B' ' 13' ' ' VAL . 22.1 t -61.29 -48.21 89.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.311 -0.868 . . . . 0.0 110.025 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.71 -45.87 90.76 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.249 -0.907 . . . . 0.0 109.995 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.01 -45.57 88.35 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.254 -0.904 . . . . 0.0 110.048 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.445 HG23 ' O ' ' B' ' 16' ' ' VAL . 46.9 t -62.6 -43.02 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.156 -0.965 . . . . 0.0 109.887 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.09 -36.85 75.83 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.252 -0.905 . . . . 0.0 109.972 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.63 -44.52 96.07 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.318 -0.864 . . . . 0.0 109.903 179.838 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 23' ' ' ALA . . . . . 0.59 ' HB2' HD21 ' A' ' 67' ' ' LEU . . . -63.1 -35.08 79.08 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.308 -0.87 . . . . 0.0 110.258 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 44.3 ttt180 . . . . . 0 N--CA 1.492 1.654 0 O-C-N 121.311 -0.868 . . . . 0.0 110.369 -179.855 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 121.276 0.56 . . . . 0.0 110.035 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -66.91 -44.84 79.72 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.307 -0.871 . . . . 0.0 109.681 179.706 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -54.66 -35.71 63.82 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.426 -0.796 . . . . 0.0 109.789 179.44 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -60.9 -45.33 95.06 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.295 -0.878 . . . . 0.0 109.986 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.518 HG12 ' HD2' ' A' ' 14' ' ' PHE . 61.8 t -63.87 -43.83 97.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.183 -0.948 . . . . 0.0 109.46 179.472 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 86.3 mt -60.67 -45.7 97.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.389 -0.819 . . . . 0.0 109.369 179.293 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.54 -41.67 81.4 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.327 -0.858 . . . . 0.0 108.778 179.12 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.546 ' HA ' ' HB1' ' B' ' 12' ' ' ALA . 2.6 m -68.03 -39.53 83.1 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 178.687 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.587 ' HB3' ' CZ ' ' A' ' 60' ' ' TYR . 2.6 m-85 -68.47 -41.96 79.41 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.481 -0.762 . . . . 0.0 109.506 179.205 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -53.39 -45.84 69.43 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.298 -0.876 . . . . 0.0 109.436 179.428 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.471 HG21 ' HA ' ' B' ' 9' ' ' LYS . 49.7 mt -62.34 -41.3 91.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.415 -0.803 . . . . 0.0 109.711 179.387 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.404 HD11 HG22 ' B' ' 13' ' ' VAL . 2.2 mp -65.02 -38.58 91.38 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.313 -0.867 . . . . 0.0 110.0 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.515 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -85.5 3.68 39.28 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.311 -0.868 . . . . 0.0 110.334 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.473 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 0.1 OUTLIER 60.6 61.39 1.73 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.248 -0.908 . . . . 0.0 110.379 179.949 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' A' ' 19' ' ' SER . 1.2 m-20 56.13 61.94 2.55 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.218 -0.926 . . . . 0.0 110.439 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.515 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 89.8 mttt -144.84 138.68 14.58 Favored Pre-proline 0 N--CA 1.489 1.494 0 O-C-N 121.287 -0.883 . . . . 0.0 109.733 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -68.3 -3.69 11.36 Favored 'Trans proline' 0 C--N 1.304 -1.8 0 O-C-N 124.008 1.53 . . . . 0.0 110.44 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 18.5 p90 -138.79 156.52 47.28 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.173 -0.954 . . . . 0.0 110.145 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.798 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -128.93 138.19 55.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.259 -0.9 . . . . 0.0 110.235 -179.803 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.798 ' N ' HD13 ' A' ' 24' ' ' ILE . 0.8 OUTLIER -80.54 141.9 34.67 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.277 -0.889 . . . . 0.0 110.41 -179.862 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.21 -40.63 94.71 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.37 -0.831 . . . . 0.0 110.455 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -55.97 -36.78 68.22 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.273 -0.892 . . . . 0.0 110.516 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.413 ' HB3' HD11 ' A' ' 24' ' ' ILE . 1.9 tt0 -67.42 -45.55 75.79 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.198 -0.939 . . . . 0.0 109.888 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.67 ' HG ' HD12 ' A' ' 24' ' ' ILE . 20.4 mt -60.77 -36.68 79.57 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.241 -0.912 . . . . 0.0 109.756 179.697 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.0 tpt180 -62.21 -34.63 76.84 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.33 -0.856 . . . . 0.0 109.643 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 7.4 ttp180 -92.92 -35.91 13.07 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.325 -0.86 . . . . 0.0 110.212 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -77.98 -23.76 48.27 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.334 -0.853 . . . . 0.0 110.744 -179.67 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.675 HD22 ' HB3' ' A' ' 37' ' ' GLN . 0.2 OUTLIER -125.46 163.5 38.17 Favored Pre-proline 0 N--CA 1.487 1.409 0 O-C-N 121.094 -1.004 . . . . 0.0 110.422 -179.622 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.485 ' HB2' ' OD2' ' A' ' 36' ' ' ASP . 39.6 Cg_exo -64.58 149.58 89.63 Favored 'Trans proline' 0 C--N 1.305 -1.754 0 O-C-N 124.035 1.545 . . . . 0.0 110.101 179.774 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -43.72 -44.85 11.29 Favored 'Trans proline' 0 C--N 1.304 -1.8 0 O-C-N 124.035 1.545 . . . . 0.0 110.418 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.49 ' OD1' ' NE2' ' A' ' 37' ' ' GLN . 3.4 p30 -65.89 -40.06 91.22 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.174 -0.954 . . . . 0.0 110.68 -179.729 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.675 ' HB3' HD22 ' A' ' 33' ' ' LEU . 76.0 mm-40 -70.07 -38.54 75.77 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.007 -1.058 . . . . 0.0 110.434 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.2 -42.44 93.53 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.162 -0.961 . . . . 0.0 110.363 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.414 ' O ' ' HB2' ' A' ' 43' ' ' LYS . 2.6 tt0 -58.54 -48.98 79.07 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.182 -0.949 . . . . 0.0 110.213 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -66.33 -48.08 71.42 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.242 -0.911 . . . . 0.0 110.17 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 89.6 m -65.39 -43.08 91.78 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.414 -0.804 . . . . 0.0 110.531 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 83.8 mt -71.2 -21.17 21.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.164 -0.96 . . . . 0.0 110.364 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 39' ' ' GLN . 38.5 ttmt -84.31 -43.59 14.64 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.176 -0.952 . . . . 0.0 110.382 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.613 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 1.6 mmp_? -68.83 -62.87 1.2 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.198 -0.939 . . . . 0.0 110.459 -179.806 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.678 ' HE1' ' HB3' ' A' ' 60' ' ' TYR . 2.3 ttm -30.43 118.1 0.33 Allowed Pre-proline 0 N--CA 1.494 1.768 0 O-C-N 121.853 -0.529 . . . . 0.0 111.336 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.565 ' O ' HD23 ' A' ' 58' ' ' LEU . 9.6 Cg_endo . . . . . 0 C--N 1.306 -1.694 0 O-C-N 124.084 1.571 . . . . 0.0 110.321 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.437 ' C ' ' HG ' ' A' ' 58' ' ' LEU . . . . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 121.247 0.546 . . . . 0.0 110.135 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.565 HD23 ' O ' ' A' ' 46' ' ' PRO . 1.1 mt -135.54 160.34 38.78 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.245 -0.91 . . . . 0.0 110.29 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.454 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.5 OUTLIER -107.16 111.26 23.6 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.34 -0.85 . . . . 0.0 110.138 179.759 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.678 ' HB3' ' HE1' ' A' ' 45' ' ' MET . 17.9 p90 -72.57 -23.69 61.0 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.286 -0.883 . . . . 0.0 110.081 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.516 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.88 -35.81 66.92 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.251 -0.906 . . . . 0.0 109.787 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.2 -34.26 75.93 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.285 -0.885 . . . . 0.0 109.821 179.521 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.613 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 12.1 t80 -72.04 -34.81 69.07 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.633 -0.667 . . . . 0.0 110.292 179.761 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.4 m -57.04 -49.72 74.95 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.21 -0.932 . . . . 0.0 110.461 -179.67 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.2 m -57.89 -35.71 71.39 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.171 -0.956 . . . . 0.0 110.614 -179.693 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.17 -46.09 82.24 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.13 -0.981 . . . . 0.0 110.635 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.469 HD21 ' CE1' ' A' ' 63' ' ' PHE . 0.1 OUTLIER -62.08 -43.54 98.61 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.253 -0.904 . . . . 0.0 110.593 -179.695 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 . . . . . 0 N--CA 1.493 1.71 0 O-C-N 121.182 -0.948 . . . . 0.0 110.509 -179.633 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.286 0.565 . . . . 0.0 110.203 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.759 ' O ' HG23 ' B' ' 13' ' ' VAL . 0.0 OUTLIER -70.81 -51.01 29.45 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.206 -0.934 . . . . 0.0 110.027 179.945 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.34 -40.57 71.37 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.258 -0.901 . . . . 0.0 109.943 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -65.63 -40.77 92.92 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.331 -0.856 . . . . 0.0 110.168 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 12' ' ' ALA . . . . . 0.546 ' HB1' ' HA ' ' A' ' 13' ' ' SER . . . -67.43 -38.01 83.9 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.269 -0.894 . . . . 0.0 110.2 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.759 HG23 ' O ' ' B' ' 9' ' ' LYS . 46.9 t -63.13 -44.14 99.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.328 -0.858 . . . . 0.0 110.152 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.2 -41.84 89.52 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.195 -0.94 . . . . 0.0 110.226 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 28.3 m -63.77 -37.43 87.32 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.317 -0.864 . . . . 0.0 110.234 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.664 ' O ' HG23 ' B' ' 20' ' ' VAL . 88.0 t -68.89 -46.43 79.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.202 -0.936 . . . . 0.0 110.198 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.517 HG23 ' O ' ' B' ' 13' ' ' VAL . 59.3 t -58.74 -43.52 88.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.225 -0.922 . . . . 0.0 110.195 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.97 -44.72 91.88 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.266 -0.897 . . . . 0.0 110.243 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.27 -43.54 94.49 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.196 -0.94 . . . . 0.0 110.22 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.664 HG23 ' O ' ' B' ' 16' ' ' VAL . 61.2 t -66.96 -42.5 88.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.323 -0.861 . . . . 0.0 110.328 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 21' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' B' ' 17' ' ' VAL . 3.1 t0 -60.82 -31.63 71.03 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.252 -0.905 . . . . 0.0 110.376 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -59.24 -51.24 70.83 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.184 -0.948 . . . . 0.0 110.251 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.4 -38.24 87.06 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.245 -0.909 . . . . 0.0 110.148 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.614 0 O-C-N 121.385 -0.822 . . . . 0.0 110.512 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.417 HG22 ' CE1' ' A' ' 68' ' ' TYR . 6.6 m . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.282 0.563 . . . . 0.0 110.159 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.54 -46.04 84.54 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.249 -0.907 . . . . 0.0 109.71 179.811 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -57.61 -36.65 72.06 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.402 -0.811 . . . . 0.0 109.879 179.57 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 37.3 tt0 -61.61 -45.85 92.33 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.263 -0.898 . . . . 0.0 110.115 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.495 HG21 ' HE2' ' A' ' 68' ' ' TYR . 54.1 t -59.47 -42.11 86.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.109 -0.995 . . . . 0.0 109.745 179.675 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 86.8 mt -65.31 -48.12 84.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 121.321 -0.862 . . . . 0.0 109.36 179.388 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.56 -39.81 77.53 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.282 -0.886 . . . . 0.0 108.792 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.485 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 7.0 m -67.21 -43.92 80.87 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 178.912 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.532 ' CB ' ' CD1' ' A' ' 60' ' ' TYR . 5.8 m-85 -67.32 -40.71 85.98 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.474 -0.766 . . . . 0.0 109.309 179.044 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.517 ' HG2' ' HA ' ' A' ' 20' ' ' ASP . 17.2 ttt180 -52.93 -40.95 64.01 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.407 -0.808 . . . . 0.0 109.223 179.241 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.412 HG21 ' HA ' ' B' ' 9' ' ' LYS . 49.1 mt -64.55 -43.91 96.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.407 -0.808 . . . . 0.0 110.224 179.741 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 13' ' ' SER . 15.5 mt -62.96 -41.73 99.62 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.087 -1.008 . . . . 0.0 110.096 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.693 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -83.59 13.31 4.7 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.311 -0.868 . . . . 0.0 110.299 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.429 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 65.69 57.8 0.83 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.21 -0.931 . . . . 0.0 110.28 179.899 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.517 ' HA ' ' HG2' ' A' ' 15' ' ' ARG . 0.6 OUTLIER 55.42 63.29 2.13 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.303 -0.873 . . . . 0.0 110.48 179.858 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -147.34 143.7 18.47 Favored Pre-proline 0 N--CA 1.49 1.565 0 O-C-N 121.202 -0.936 . . . . 0.0 110.034 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.467 ' O ' ' CD1' ' A' ' 23' ' ' TYR . 14.5 Cg_endo -72.89 -1.23 10.14 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 124.153 1.607 . . . . 0.0 110.114 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.467 ' CD1' ' O ' ' A' ' 22' ' ' PRO . 10.7 m-85 -130.44 150.06 51.84 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.262 -0.899 . . . . 0.0 109.866 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.693 HG12 ' HB2' ' A' ' 18' ' ' ALA . 0.1 OUTLIER -135.28 145.01 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.116 -0.99 . . . . 0.0 110.106 -179.828 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.577 ' N ' HD13 ' A' ' 24' ' ' ILE . 2.1 mp -80.09 153.54 28.67 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.267 -0.896 . . . . 0.0 110.061 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.462 ' O ' ' HB2' ' A' ' 29' ' ' LEU . . . -66.32 -45.37 80.54 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.249 -0.907 . . . . 0.0 110.071 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.84 -36.93 77.84 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.143 -0.973 . . . . 0.0 109.687 179.705 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.548 ' HB3' HD11 ' A' ' 24' ' ' ILE . 0.9 OUTLIER -58.37 -38.7 77.81 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.294 -0.878 . . . . 0.0 109.183 179.273 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.466 ' HG ' HD12 ' A' ' 24' ' ' ILE . 20.3 mt -61.42 -38.04 85.67 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.42 -0.8 . . . . 0.0 109.571 179.377 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 14.4 mtp85 -68.27 -34.03 75.45 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.306 -0.871 . . . . 0.0 110.077 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 15.4 ttt-85 -87.17 -21.56 25.85 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.284 -0.885 . . . . 0.0 110.7 -179.66 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 0.5 OUTLIER -99.02 -23.83 15.14 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.048 -1.033 . . . . 0.0 110.646 -179.552 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.791 HD22 ' HB3' ' A' ' 37' ' ' GLN . 3.5 mt -124.01 162.17 42.85 Favored Pre-proline 0 C--N 1.304 -1.39 0 O-C-N 121.11 -0.994 . . . . 0.0 110.196 -179.715 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.487 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 34.8 Cg_exo -62.72 179.86 0.64 Allowed 'Trans proline' 0 C--N 1.304 -1.768 0 O-C-N 123.918 1.483 . . . . 0.0 109.889 179.418 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.487 ' HD2' ' HB3' ' A' ' 34' ' ' PRO . 19.0 Cg_endo -63.99 -49.26 4.07 Favored 'Trans proline' 0 C--N 1.304 -1.772 0 O-C-N 123.941 1.495 . . . . 0.0 110.35 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -66.01 -40.94 91.55 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.292 -0.88 . . . . 0.0 110.863 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.791 ' HB3' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -69.65 -40.9 76.2 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.07 -1.019 . . . . 0.0 110.564 -179.5 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.45 -40.74 89.61 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.151 -0.968 . . . . 0.0 110.353 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -66.08 -48.87 69.56 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.187 -0.946 . . . . 0.0 110.509 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -62.08 -45.58 92.88 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.237 -0.914 . . . . 0.0 110.593 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 68.7 m -60.74 -44.33 96.8 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.149 -0.969 . . . . 0.0 110.514 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 72.3 mt -61.17 -32.84 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.169 -0.957 . . . . 0.0 110.404 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -76.44 -24.49 53.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.136 -0.978 . . . . 0.0 110.346 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.639 ' CD ' ' CE1' ' A' ' 63' ' ' PHE . 0.1 OUTLIER -84.07 -61.79 1.73 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.207 -0.933 . . . . 0.0 110.142 179.987 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.519 ' HE2' ' HA ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -34.39 103.46 0.23 Allowed Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.672 -0.642 . . . . 0.0 111.241 179.89 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo . . . . . 0 C--N 1.305 -1.725 0 O-C-N 123.889 1.468 . . . . 0.0 109.683 179.361 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 121.253 0.549 . . . . 0.0 110.204 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.479 ' HB3' ' HB3' ' A' ' 45' ' ' MET . 54.5 mt -114.57 159.77 20.04 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.322 -0.861 . . . . 0.0 110.198 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.478 ' C ' ' HG3' ' A' ' 45' ' ' MET . 13.5 p30 -110.34 111.09 22.15 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.253 -0.905 . . . . 0.0 110.468 179.766 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.572 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 24.8 p90 -74.8 -27.35 60.27 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.169 -0.957 . . . . 0.0 109.268 179.435 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.572 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.12 -44.74 79.43 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.446 -0.784 . . . . 0.0 109.591 179.616 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.48 -32.83 72.85 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.254 -0.904 . . . . 0.0 109.472 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.639 ' CE1' ' CD ' ' A' ' 44' ' ' ARG . 1.1 t80 -71.67 -40.34 69.69 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.626 -0.671 . . . . 0.0 109.983 179.641 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 21.0 p -58.92 -45.14 91.07 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.295 -0.878 . . . . 0.0 110.23 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 16.3 t -60.51 -39.69 88.69 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.276 -0.89 . . . . 0.0 110.219 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.26 -40.7 51.22 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.215 -0.928 . . . . 0.0 110.104 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.692 ' O ' HD12 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -66.48 -45.55 79.31 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.274 -0.891 . . . . 0.0 109.68 179.821 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.507 ' N ' ' HG ' ' A' ' 67' ' ' LEU . 3.9 m-85 . . . . . 0 N--CA 1.491 1.62 0 O-C-N 121.632 -0.668 . . . . 0.0 110.223 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 33.3 tttt . . . . . 0 N--CA 1.498 1.952 0 CA-C-O 120.928 0.394 . . . . 0.0 110.767 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.69 ' O ' HG23 ' B' ' 13' ' ' VAL . 7.2 ttmt -57.02 -33.85 67.59 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.038 -1.038 . . . . 0.0 110.037 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.38 -38.65 88.0 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.269 -0.894 . . . . 0.0 109.664 179.587 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -65.39 -42.1 93.0 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.296 -0.877 . . . . 0.0 109.807 179.576 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 12' ' ' ALA . . . . . 0.401 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -63.16 -33.05 74.63 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.35 -0.844 . . . . 0.0 109.888 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.69 HG23 ' O ' ' B' ' 9' ' ' LYS . 87.8 t -65.72 -42.29 92.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.287 -0.883 . . . . 0.0 110.135 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.71 -39.56 81.17 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.23 -0.919 . . . . 0.0 110.245 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.5 m -65.97 -43.74 87.01 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.301 -0.874 . . . . 0.0 110.193 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.658 ' O ' HG23 ' B' ' 20' ' ' VAL . 67.9 t -64.93 -43.22 96.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.246 -0.909 . . . . 0.0 110.06 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.728 HG22 ' HG2' ' A' ' 37' ' ' GLN . 43.6 t -58.58 -50.44 78.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.288 -0.883 . . . . 0.0 110.039 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.8 -46.69 88.44 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.251 -0.905 . . . . 0.0 109.822 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.78 -45.96 87.4 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.342 -0.849 . . . . 0.0 109.901 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.658 HG23 ' O ' ' B' ' 16' ' ' VAL . 75.3 t -63.26 -44.14 99.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.278 -0.889 . . . . 0.0 109.642 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -59.61 -40.25 86.91 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.399 -0.813 . . . . 0.0 109.708 179.67 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -54.21 -40.13 67.34 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.231 -0.918 . . . . 0.0 109.532 179.539 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 23' ' ' ALA . . . . . 0.504 ' HB2' HD13 ' A' ' 67' ' ' LEU . . . -60.04 -39.39 85.77 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.344 -0.847 . . . . 0.0 109.627 179.552 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 6.9 ttm-85 . . . . . 0 N--CA 1.488 1.449 0 O-C-N 121.261 -0.899 . . . . 0.0 109.69 179.506 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.643 HG22 ' CE2' ' A' ' 68' ' ' TYR . 3.6 m . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.338 0.59 . . . . 0.0 110.15 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -69.99 -45.2 67.8 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.253 -0.904 . . . . 0.0 109.864 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -54.78 -37.07 65.58 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.34 -0.85 . . . . 0.0 109.806 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.0 tp60 -61.98 -45.0 95.55 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.306 -0.871 . . . . 0.0 110.0 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.826 HG12 ' CD2' ' A' ' 14' ' ' PHE . 17.3 t -60.36 -45.14 96.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.238 -0.914 . . . . 0.0 109.947 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 69.2 mt -59.4 -49.65 82.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.319 -0.863 . . . . 0.0 109.911 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.97 -47.91 81.54 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.186 -0.947 . . . . 0.0 109.343 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.41 ' HB2' HG23 ' B' ' 16' ' ' VAL . 2.0 p -65.42 -36.06 82.8 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.336 -0.852 . . . . 0.0 109.201 179.161 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.826 ' CD2' HG12 ' A' ' 10' ' ' VAL . 1.0 OUTLIER -68.29 -43.99 76.46 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.431 -0.793 . . . . 0.0 109.323 179.308 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.2 ttt180 -53.53 -48.44 69.04 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.391 -0.818 . . . . 0.0 108.974 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.523 HG21 ' HA ' ' B' ' 9' ' ' LYS . 50.7 mt -58.93 -43.42 88.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.412 -0.805 . . . . 0.0 109.566 179.195 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.1 mp -64.94 -36.05 83.13 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.324 -0.86 . . . . 0.0 110.033 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.641 ' HB1' ' O ' ' A' ' 23' ' ' TYR . . . -81.04 0.78 34.29 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.311 -0.868 . . . . 0.0 110.149 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.459 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 3.3 t 65.28 76.14 0.34 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.259 -0.901 . . . . 0.0 110.172 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.409 ' C ' ' O ' ' A' ' 19' ' ' SER . 10.4 t70 42.85 56.34 4.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.284 -0.885 . . . . 0.0 110.298 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.459 ' HG3' ' O ' ' A' ' 19' ' ' SER . 9.5 mttm -143.94 143.85 24.43 Favored Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.225 -0.922 . . . . 0.0 110.116 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.464 ' O ' ' CD1' ' A' ' 23' ' ' TYR . 19.2 Cg_endo -76.27 3.36 6.32 Favored 'Trans proline' 0 C--N 1.304 -1.795 0 O-C-N 124.049 1.552 . . . . 0.0 110.182 179.905 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.641 ' O ' ' HB1' ' A' ' 18' ' ' ALA . 47.7 m-85 -141.91 165.84 26.37 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.305 -0.872 . . . . 0.0 110.429 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.57 HD13 ' HB3' ' A' ' 28' ' ' GLU . 0.3 OUTLIER -132.48 146.32 33.1 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.376 -0.827 . . . . 0.0 109.841 179.932 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.496 ' N ' HD13 ' A' ' 24' ' ' ILE . 49.2 mt -92.33 155.64 17.79 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.164 -0.96 . . . . 0.0 110.344 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.574 ' HA ' HD21 ' A' ' 29' ' ' LEU . . . -63.07 -38.97 93.32 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.35 -0.844 . . . . 0.0 110.056 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.05 -33.99 70.81 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.226 -0.921 . . . . 0.0 109.705 179.473 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.57 ' HB3' HD13 ' A' ' 24' ' ' ILE . 19.9 tt0 -62.9 -51.27 67.62 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.357 -0.839 . . . . 0.0 110.227 -179.563 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.64 HD13 ' HA ' ' A' ' 38' ' ' ALA . 4.0 pp -67.8 -33.28 74.49 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.01 -1.056 . . . . 0.0 109.221 179.132 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.494 ' N ' HD12 ' A' ' 29' ' ' LEU . 0.0 OUTLIER -65.55 -33.91 77.02 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.233 -0.917 . . . . 0.0 110.539 179.908 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -89.73 -15.1 33.22 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.062 -1.023 . . . . 0.0 111.395 -179.147 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.538 ' HG2' ' HA ' ' A' ' 29' ' ' LEU . 12.1 pt-20 -108.79 -24.32 11.35 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.797 -1.19 . . . . 0.0 111.329 -179.339 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.637 HD22 ' HB3' ' A' ' 37' ' ' GLN . 0.5 OUTLIER -110.1 146.32 33.95 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 120.944 -1.098 . . . . 0.0 110.173 -179.929 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.428 ' O ' ' C ' ' A' ' 35' ' ' PRO . 47.8 Cg_exo -48.17 140.75 19.2 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 O-C-N 123.934 1.491 . . . . 0.0 110.194 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.428 ' C ' ' O ' ' A' ' 34' ' ' PRO . 29.8 Cg_endo -41.12 -38.15 3.07 Favored 'Trans proline' 0 C--N 1.304 -1.804 0 O-C-N 124.062 1.559 . . . . 0.0 110.263 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -65.74 -44.16 86.79 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.308 -0.87 . . . . 0.0 110.441 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.637 ' HB3' HD22 ' A' ' 33' ' ' LEU . 62.6 mm-40 -68.95 -42.19 77.02 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.197 -0.939 . . . . 0.0 110.26 -179.731 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.64 ' HA ' HD13 ' A' ' 29' ' ' LEU . . . -56.25 -43.4 78.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.23 -0.919 . . . . 0.0 110.248 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -65.9 -44.75 84.3 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.24 -0.912 . . . . 0.0 110.148 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.09 -47.81 78.6 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.233 -0.917 . . . . 0.0 110.009 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.489 ' O ' ' HG2' ' A' ' 45' ' ' MET . 60.9 m -65.84 -51.0 62.57 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.453 -0.779 . . . . 0.0 111.082 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.637 HD11 HD11 ' A' ' 29' ' ' LEU . 44.3 mt -50.84 -28.49 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 O-C-N 121.208 -0.932 . . . . 0.0 110.675 -179.282 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 6.1 tttt -85.81 -27.14 25.33 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.218 -0.926 . . . . 0.0 110.693 -179.672 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.583 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 13.8 mmt180 -76.72 -71.63 0.39 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.245 -0.909 . . . . 0.0 110.801 -179.452 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.548 ' HE2' ' CA ' ' A' ' 60' ' ' TYR . 12.0 ptp -57.33 122.48 55.0 Favored Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 121.173 -0.954 . . . . 0.0 110.498 -179.636 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.404 ' O ' HD23 ' A' ' 58' ' ' LEU . 18.7 Cg_endo . . . . . 0 C--N 1.307 -1.657 0 O-C-N 123.95 1.5 . . . . 0.0 110.199 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.19 0.519 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.429 ' HB3' ' HG3' ' A' ' 45' ' ' MET . 70.8 mt -118.99 156.89 28.81 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.278 -0.889 . . . . 0.0 110.33 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.404 ' O ' ' HB2' ' A' ' 45' ' ' MET . 0.7 OUTLIER -107.81 113.29 26.42 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.278 -0.888 . . . . 0.0 110.212 -179.964 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.548 ' CA ' ' HE2' ' A' ' 45' ' ' MET . 26.0 p90 -83.78 -23.29 31.57 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.214 -0.929 . . . . 0.0 110.339 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.482 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.02 -41.46 74.99 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.119 -0.988 . . . . 0.0 109.508 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.51 -32.42 73.77 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.321 -0.862 . . . . 0.0 109.612 179.313 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.583 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 5.3 t80 -69.65 -33.09 72.12 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 121.62 -0.675 . . . . 0.0 110.252 179.725 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.447 ' O ' ' HB2' ' A' ' 68' ' ' TYR . 5.8 p -63.92 -50.05 70.21 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.222 -0.924 . . . . 0.0 110.154 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 25.8 t -68.8 -35.39 76.96 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.203 -0.936 . . . . 0.0 110.108 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.18 -46.17 68.17 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.333 -0.854 . . . . 0.0 110.512 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.678 HD12 ' C ' ' A' ' 67' ' ' LEU . 0.3 OUTLIER -69.33 -38.19 78.06 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.1 -1.0 . . . . 0.0 110.112 -179.84 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.643 ' CE2' HG22 ' A' ' 6' ' ' THR . 2.4 m-85 . . . . . 0 N--CA 1.493 1.685 0 O-C-N 121.484 -0.76 . . . . 0.0 110.248 179.721 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.52 ' HG2' ' N ' ' B' ' 9' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.092 0.472 . . . . 0.0 110.408 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.523 ' HA ' HG21 ' A' ' 16' ' ' ILE . 0.7 OUTLIER -57.61 -51.1 70.87 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.008 -1.058 . . . . 0.0 109.834 179.914 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.11 -33.98 67.89 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.252 -0.905 . . . . 0.0 109.581 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -68.7 -40.75 79.85 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.406 -0.809 . . . . 0.0 109.809 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.04 -35.87 81.69 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.344 -0.847 . . . . 0.0 109.983 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.487 HG23 ' O ' ' B' ' 9' ' ' LYS . 57.8 t -61.62 -43.4 96.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.359 -0.838 . . . . 0.0 110.043 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.87 -35.57 75.08 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.236 -0.915 . . . . 0.0 110.131 179.838 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 17.0 m -68.16 -48.6 64.86 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.271 -0.893 . . . . 0.0 109.956 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.41 HG23 ' HB2' ' A' ' 13' ' ' SER . 74.1 t -61.22 -44.32 98.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.237 -0.914 . . . . 0.0 110.13 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.537 HG22 ' HG3' ' A' ' 37' ' ' GLN . 44.1 t -58.46 -48.07 86.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.227 -0.921 . . . . 0.0 110.05 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.3 -39.81 88.24 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.348 -0.845 . . . . 0.0 110.134 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.54 -44.29 82.82 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.274 -0.891 . . . . 0.0 110.006 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.449 ' HB ' ' OE1' ' A' ' 37' ' ' GLN . 77.5 t -63.79 -47.49 90.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.21 -0.931 . . . . 0.0 110.138 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -55.2 -38.05 67.88 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.18 -0.95 . . . . 0.0 109.636 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -63.38 -36.88 85.19 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.395 -0.816 . . . . 0.0 109.953 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 23' ' ' ALA . . . . . 0.554 ' HB1' HH21 ' A' ' 44' ' ' ARG . . . -64.76 -39.48 93.68 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.305 -0.872 . . . . 0.0 110.3 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.58 0 O-C-N 121.257 -0.902 . . . . 0.0 109.845 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.608 ' CG2' ' CE1' ' A' ' 68' ' ' TYR . 2.9 m . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 121.229 0.538 . . . . 0.0 110.09 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -69.84 -44.31 70.15 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.205 -0.934 . . . . 0.0 109.774 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 19.7 tp10 -54.98 -36.41 65.35 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.371 -0.831 . . . . 0.0 109.697 179.583 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.402 ' O ' ' OG ' ' A' ' 13' ' ' SER . 1.1 tp60 -61.25 -44.83 96.61 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.295 -0.878 . . . . 0.0 109.858 179.89 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 59.2 t -58.38 -41.22 80.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.244 -0.91 . . . . 0.0 109.549 179.405 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.578 HG23 ' HE1' ' A' ' 60' ' ' TYR . 69.2 mt -66.71 -43.91 89.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.419 -0.801 . . . . 0.0 109.492 179.295 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.59 -43.27 84.5 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.276 -0.89 . . . . 0.0 108.861 179.14 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.447 ' O ' HD23 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -66.74 -38.66 87.1 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 178.71 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.565 ' HB3' ' CE2' ' A' ' 60' ' ' TYR . 1.2 m-85 -68.38 -42.28 79.36 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.491 -0.755 . . . . 0.0 109.437 179.124 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.77 -43.37 72.73 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.296 -0.878 . . . . 0.0 109.399 179.303 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.429 ' CD1' ' HB2' ' B' ' 12' ' ' ALA . 80.9 mt -63.79 -44.83 98.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.314 -0.866 . . . . 0.0 109.624 179.402 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.495 HD13 ' HA ' ' A' ' 17' ' ' LEU . 3.2 mm? -63.31 -34.75 78.36 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.32 -0.863 . . . . 0.0 109.735 179.585 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.731 ' HB1' ' O ' ' A' ' 23' ' ' TYR . . . -79.92 2.44 23.43 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.375 -0.828 . . . . 0.0 110.112 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.482 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 4.3 t 60.27 80.3 0.21 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.282 -0.886 . . . . 0.0 110.113 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.482 ' O ' ' HG2' ' A' ' 21' ' ' LYS . 6.3 m-20 45.31 59.33 3.6 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.346 -0.846 . . . . 0.0 110.438 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.482 ' HG2' ' O ' ' A' ' 20' ' ' ASP . 18.4 mttp -153.5 141.72 14.01 Favored Pre-proline 0 N--CA 1.489 1.502 0 O-C-N 121.25 -0.906 . . . . 0.0 110.047 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.512 ' HG2' ' CE2' ' A' ' 23' ' ' TYR . 23.4 Cg_endo -78.36 6.25 4.89 Favored 'Trans proline' 0 C--N 1.303 -1.824 0 O-C-N 124.172 1.617 . . . . 0.0 110.232 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.731 ' O ' ' HB1' ' A' ' 18' ' ' ALA . 22.1 m-85 -135.91 166.16 23.97 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.277 -0.889 . . . . 0.0 110.107 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.64 HD13 ' H ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -138.45 140.58 39.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.137 -0.977 . . . . 0.0 110.062 -179.945 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.64 ' H ' HD13 ' A' ' 24' ' ' ILE . 4.4 mp -83.55 154.45 23.81 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.174 -0.953 . . . . 0.0 110.019 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.83 -45.28 71.57 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.254 -0.904 . . . . 0.0 110.304 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -56.54 -39.69 73.84 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.268 -0.895 . . . . 0.0 109.937 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -59.26 -41.62 89.26 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.327 -0.858 . . . . 0.0 109.199 179.613 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 1.037 HD13 HD12 ' A' ' 33' ' ' LEU . 2.0 mm? -61.52 -33.82 74.47 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.53 -0.731 . . . . 0.0 109.417 179.265 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 14.8 mmm-85 -68.91 -34.38 75.31 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.381 -0.824 . . . . 0.0 110.322 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.2 -25.45 15.29 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.146 -0.971 . . . . 0.0 111.413 -179.139 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.482 ' HB3' HD12 ' A' ' 17' ' ' LEU . 12.3 mm-40 -91.64 -23.59 19.79 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 120.925 -1.109 . . . . 0.0 111.449 -178.918 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 1.037 HD12 HD13 ' A' ' 29' ' ' LEU . 7.8 mt -123.85 163.64 33.93 Favored Pre-proline 0 N--CA 1.487 1.392 0 O-C-N 120.847 -1.158 . . . . 0.0 110.734 -179.297 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.518 ' HD3' HD23 ' A' ' 33' ' ' LEU . 21.7 Cg_exo -61.52 139.33 81.2 Favored 'Trans proline' 0 C--N 1.306 -1.69 0 O-C-N 124.114 1.586 . . . . 0.0 110.003 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.431 ' C ' ' O ' ' A' ' 34' ' ' PRO . 31.7 Cg_endo -39.98 -41.65 3.03 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 O-C-N 124.065 1.561 . . . . 0.0 110.511 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -66.0 -37.58 86.31 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.283 -0.885 . . . . 0.0 111.081 -179.535 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.875 ' OE1' HG22 ' B' ' 17' ' ' VAL . 0.1 OUTLIER -69.64 -42.16 74.62 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.928 -1.107 . . . . 0.0 110.42 -179.562 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.489 ' O ' HG12 ' A' ' 42' ' ' ILE . . . -56.01 -48.3 76.17 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.179 -0.951 . . . . 0.0 110.288 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -56.11 -48.83 75.43 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.086 -1.009 . . . . 0.0 110.469 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -62.56 -48.12 80.88 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.152 -0.968 . . . . 0.0 110.101 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 56.6 m -65.26 -47.29 77.25 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.255 -0.903 . . . . 0.0 110.046 179.71 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.489 HG12 ' O ' ' A' ' 38' ' ' ALA . 16.2 mm -57.41 -22.88 18.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.389 -0.819 . . . . 0.0 110.109 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 26.1 tttt -84.47 -24.14 29.6 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.284 -0.885 . . . . 0.0 110.385 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.603 ' HB3' ' CG ' ' A' ' 63' ' ' PHE . 10.6 mmt180 -93.65 -67.92 0.83 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.246 -0.909 . . . . 0.0 110.275 -179.858 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.505 ' HE1' ' HB3' ' A' ' 60' ' ' TYR . 2.0 ttm -36.62 105.44 0.3 Allowed Pre-proline 0 N--CA 1.493 1.721 0 O-C-N 121.598 -0.689 . . . . 0.0 111.001 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.458 ' HD2' ' OD1' ' A' ' 59' ' ' ASP . 37.6 Cg_exo . . . . . 0 C--N 1.305 -1.729 0 O-C-N 124.03 1.542 . . . . 0.0 109.785 179.453 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 121.317 0.58 . . . . 0.0 110.275 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.409 ' HB3' ' HB3' ' A' ' 45' ' ' MET . 1.1 mt -111.62 157.75 20.05 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.226 -0.921 . . . . 0.0 110.181 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.475 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.7 OUTLIER -110.52 111.44 22.69 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.125 -0.984 . . . . 0.0 110.397 179.738 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.578 ' HE1' HG23 ' A' ' 11' ' ' ILE . 22.7 p90 -73.66 -24.82 60.03 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.217 -0.927 . . . . 0.0 109.182 179.362 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.547 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.65 -42.68 79.36 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.465 -0.772 . . . . 0.0 109.765 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.45 -40.3 86.39 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.298 -0.876 . . . . 0.0 109.874 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.603 ' CG ' ' HB3' ' A' ' 44' ' ' ARG . 1.7 t80 -71.97 -35.17 69.46 Favored 'General case' 0 C--N 1.298 -1.666 0 O-C-N 121.591 -0.693 . . . . 0.0 110.384 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 70.3 m -58.37 -43.48 88.46 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.21 -0.931 . . . . 0.0 110.465 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.28 -40.69 95.05 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.173 -0.954 . . . . 0.0 110.272 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.61 -31.94 67.46 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.281 -0.887 . . . . 0.0 110.452 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.722 HD21 ' HB2' ' B' ' 23' ' ' ALA . 0.5 OUTLIER -64.67 -44.41 90.48 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.109 -0.994 . . . . 0.0 110.386 -179.825 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.608 ' CE1' ' CG2' ' A' ' 6' ' ' THR . 28.4 m-85 . . . . . 0 N--CA 1.49 1.571 0 O-C-N 121.198 -0.939 . . . . 0.0 110.27 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.241 0.543 . . . . 0.0 110.134 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.815 ' O ' HG23 ' B' ' 13' ' ' VAL . 0.3 OUTLIER -58.32 -40.34 81.82 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.291 -0.88 . . . . 0.0 110.159 -179.944 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.11 -46.5 79.1 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.23 -0.919 . . . . 0.0 109.964 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -62.12 -40.95 97.63 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.277 -0.89 . . . . 0.0 110.032 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 12' ' ' ALA . . . . . 0.468 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -64.33 -37.11 86.33 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.342 -0.849 . . . . 0.0 110.184 179.936 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.929 ' O ' HG23 ' B' ' 17' ' ' VAL . 42.7 t -65.31 -45.09 94.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.321 -0.862 . . . . 0.0 110.128 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.33 -35.94 74.75 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.234 -0.916 . . . . 0.0 110.173 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 15.0 m -67.54 -40.95 85.01 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.378 -0.826 . . . . 0.0 110.347 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.85 ' O ' HG23 ' B' ' 20' ' ' VAL . 57.4 t -69.91 -40.18 78.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.248 -0.908 . . . . 0.0 110.168 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.929 HG23 ' O ' ' B' ' 13' ' ' VAL . 16.7 t -61.45 -47.41 93.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.365 -0.834 . . . . 0.0 110.238 -179.845 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.86 -46.01 92.27 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.253 -0.904 . . . . 0.0 110.322 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.04 -41.4 95.23 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.228 -0.92 . . . . 0.0 110.287 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.85 HG23 ' O ' ' B' ' 16' ' ' VAL . 75.1 t -67.1 -39.44 83.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.25 -0.906 . . . . 0.0 110.425 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.44 -33.73 76.55 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.235 -0.916 . . . . 0.0 110.333 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -58.09 -49.38 77.14 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.286 -0.884 . . . . 0.0 110.267 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 23' ' ' ALA . . . . . 0.722 ' HB2' HD21 ' A' ' 67' ' ' LEU . . . -66.15 -37.32 85.39 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.235 -0.915 . . . . 0.0 110.411 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 51.1 ttt-85 . . . . . 0 N--CA 1.493 1.694 0 O-C-N 121.268 -0.895 . . . . 0.0 110.648 -179.609 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.5 m . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.194 0.521 . . . . 0.0 110.141 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.568 ' HA ' ' CZ ' ' A' ' 68' ' ' TYR . . . -69.99 -41.48 74.34 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.335 -0.853 . . . . 0.0 109.873 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -59.66 -36.9 77.35 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.278 -0.889 . . . . 0.0 109.742 179.602 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -64.58 -44.04 91.94 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.439 -0.788 . . . . 0.0 110.284 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.628 HG21 ' OH ' ' A' ' 68' ' ' TYR . 54.3 t -57.87 -43.75 85.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.203 -0.936 . . . . 0.0 109.86 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.494 HD12 ' O ' ' A' ' 7' ' ' ALA . 5.5 mt -63.74 -49.16 83.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.329 -0.857 . . . . 0.0 109.351 179.35 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.06 -43.15 86.78 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.294 -0.879 . . . . 0.0 108.92 179.114 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.499 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 1.0 OUTLIER -63.56 -46.63 85.02 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.608 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.578 ' HB3' ' CE2' ' A' ' 60' ' ' TYR . 3.6 m-85 -59.81 -43.14 94.63 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.465 -0.772 . . . . 0.0 109.129 178.747 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -52.96 -40.59 63.82 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.04 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.405 HG21 ' HA ' ' B' ' 9' ' ' LYS . 61.6 mt -67.1 -44.93 87.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.541 -0.724 . . . . 0.0 110.267 179.41 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.568 HD13 ' OE1' ' A' ' 32' ' ' GLU . 9.3 mt -57.88 -42.11 83.9 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.929 -1.107 . . . . 0.0 109.698 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.446 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -79.5 4.07 16.79 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.378 -0.826 . . . . 0.0 110.298 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.448 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 0.3 OUTLIER 64.91 66.8 0.55 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.268 -0.895 . . . . 0.0 110.234 179.959 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 52.11 59.88 4.22 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.213 -0.929 . . . . 0.0 110.308 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.448 ' HG3' ' O ' ' A' ' 19' ' ' SER . 20.9 mttt -143.51 142.05 20.27 Favored Pre-proline 0 N--CA 1.49 1.525 0 O-C-N 121.182 -0.949 . . . . 0.0 110.014 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -69.81 -3.15 11.47 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 O-C-N 124.089 1.573 . . . . 0.0 110.263 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.523 ' CD1' ' O ' ' A' ' 23' ' ' TYR . 7.0 p90 -143.4 152.37 41.5 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.239 -0.913 . . . . 0.0 110.055 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.404 HD13 HG21 ' A' ' 24' ' ' ILE . 3.9 tt -123.0 147.39 27.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.243 -0.911 . . . . 0.0 110.344 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.503 ' HB2' ' HB2' ' A' ' 28' ' ' GLU . 1.2 mp -80.48 141.43 35.22 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.241 -0.912 . . . . 0.0 109.92 179.867 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.496 ' O ' ' HG ' ' A' ' 29' ' ' LEU . . . -60.27 -40.6 90.94 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.203 -0.936 . . . . 0.0 110.471 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -65.01 -35.17 80.34 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.165 -0.959 . . . . 0.0 110.124 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.503 ' HB2' ' HB2' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -68.8 -49.98 54.04 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.366 -0.834 . . . . 0.0 109.869 179.992 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.725 HD12 ' C ' ' A' ' 29' ' ' LEU . 0.9 OUTLIER -66.82 -34.07 77.01 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.373 -0.829 . . . . 0.0 110.042 179.834 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.76 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 17.2 ttp180 -69.18 -34.48 75.0 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.319 -0.863 . . . . 0.0 111.12 -179.642 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.551 ' NH1' ' HB3' ' A' ' 31' ' ' ARG . 5.0 ttp-105 -86.48 -22.46 26.43 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.007 -1.058 . . . . 0.0 111.32 -178.91 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.568 ' OE1' HD13 ' A' ' 17' ' ' LEU . 12.8 pt-20 -90.7 -24.03 20.55 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.831 -1.168 . . . . 0.0 110.776 -179.542 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.589 HD23 ' HD2' ' A' ' 34' ' ' PRO . 7.6 mt -103.17 155.91 36.06 Favored Pre-proline 0 N--CA 1.488 1.457 0 O-C-N 121.122 -0.986 . . . . 0.0 110.409 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.589 ' HD2' HD23 ' A' ' 33' ' ' LEU . 6.2 Cg_exo -59.18 142.54 99.36 Favored 'Trans proline' 0 C--N 1.302 -1.892 0 O-C-N 124.069 1.563 . . . . 0.0 109.775 179.593 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.429 ' C ' ' O ' ' A' ' 34' ' ' PRO . 33.7 Cg_exo -37.72 -44.08 1.56 Allowed 'Trans proline' 0 C--N 1.305 -1.749 0 O-C-N 124.055 1.555 . . . . 0.0 110.917 -179.481 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.486 ' OD1' ' HB2' ' A' ' 34' ' ' PRO . 2.9 p-10 -65.9 -45.82 80.58 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.091 -1.006 . . . . 0.0 111.04 -179.606 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.626 ' HG2' HG22 ' B' ' 17' ' ' VAL . 0.6 OUTLIER -69.82 -37.85 76.36 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.951 -1.093 . . . . 0.0 110.705 -179.53 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.76 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -60.96 -43.86 98.13 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.369 -0.832 . . . . 0.0 110.952 -179.478 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.3 tm0? -60.09 -44.92 94.46 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.255 -0.903 . . . . 0.0 110.849 -179.367 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -62.21 -41.72 98.63 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.237 -0.914 . . . . 0.0 110.922 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 27.5 m -62.69 -50.88 69.41 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.128 -0.982 . . . . 0.0 110.755 -179.489 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.644 HD12 HD11 ' A' ' 29' ' ' LEU . 1.1 mt -63.84 -18.01 21.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.203 -0.935 . . . . 0.0 110.188 -179.736 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.45 ' C ' ' HD2' ' A' ' 44' ' ' ARG . 9.2 tttt -83.22 -16.01 48.19 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.25 -0.906 . . . . 0.0 110.772 -179.69 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.592 ' HB3' ' CG ' ' A' ' 63' ' ' PHE . 2.0 mpt_? -114.32 -62.26 1.62 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.106 -0.996 . . . . 0.0 110.675 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.492 ' HE1' ' HB3' ' A' ' 60' ' ' TYR . 2.3 ttm -32.88 111.1 0.35 Allowed Pre-proline 0 N--CA 1.497 1.92 0 O-C-N 121.618 -0.676 . . . . 0.0 111.272 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.428 ' O ' ' HA ' ' A' ' 58' ' ' LEU . 12.3 Cg_endo . . . . . 0 C--N 1.306 -1.687 0 O-C-N 124.024 1.539 . . . . 0.0 110.194 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 121.253 0.549 . . . . 0.0 110.107 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.438 ' HB3' ' HB3' ' A' ' 45' ' ' MET . 54.3 mt -93.76 159.04 15.38 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.323 -0.861 . . . . 0.0 110.176 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.479 ' C ' ' HG3' ' A' ' 45' ' ' MET . 1.2 m-20 -115.28 110.42 19.39 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.105 -0.997 . . . . 0.0 110.41 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.579 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 15.9 p90 -72.77 -25.77 61.29 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.379 -0.826 . . . . 0.0 110.271 179.767 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.579 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.7 -36.73 67.5 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.279 -0.888 . . . . 0.0 109.958 -179.7 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.56 -43.36 80.84 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.322 -0.861 . . . . 0.0 109.557 179.416 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.592 ' CG ' ' HB3' ' A' ' 44' ' ' ARG . 1.5 t80 -72.12 -35.29 69.11 Favored 'General case' 0 C--N 1.297 -1.689 0 O-C-N 121.75 -0.593 . . . . 0.0 110.311 179.65 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.566 ' O ' ' CE2' ' A' ' 68' ' ' TYR . 44.3 m -59.67 -49.87 76.07 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.298 -0.876 . . . . 0.0 110.569 -179.606 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.97 -41.24 82.49 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.184 -0.947 . . . . 0.0 110.344 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.64 -39.6 73.96 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.231 -0.918 . . . . 0.0 110.386 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.546 ' CD2' ' HB2' ' B' ' 23' ' ' ALA . 15.3 mt -57.75 -41.12 81.3 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.144 -0.972 . . . . 0.0 110.241 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.628 ' OH ' HG21 ' A' ' 10' ' ' VAL . 2.7 m-85 . . . . . 0 N--CA 1.49 1.568 0 O-C-N 121.271 -0.893 . . . . 0.0 110.077 -179.736 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.466 ' HB2' ' OE1' ' B' ' 11' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.204 0.526 . . . . 0.0 110.133 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.405 ' HA ' HG21 ' A' ' 16' ' ' ILE . 0.0 OUTLIER -65.65 -45.63 82.24 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.24 -0.913 . . . . 0.0 110.025 179.849 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.99 -40.84 77.34 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.314 -0.866 . . . . 0.0 109.997 179.805 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 0.466 ' OE1' ' HB2' ' B' ' 8' ' ' LYS . 5.2 mt-10 -62.05 -40.92 97.39 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.333 -0.854 . . . . 0.0 110.024 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 12' ' ' ALA . . . . . 0.458 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -65.43 -43.08 91.61 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.415 -0.803 . . . . 0.0 110.0 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.558 ' O ' HG23 ' B' ' 17' ' ' VAL . 90.1 t -58.64 -44.25 89.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.215 -0.928 . . . . 0.0 110.013 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.29 -39.56 90.89 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.307 -0.87 . . . . 0.0 110.179 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 19.7 m -64.66 -44.43 90.42 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.226 -0.921 . . . . 0.0 110.136 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.458 HG23 ' O ' ' B' ' 12' ' ' ALA . 59.8 t -65.18 -42.28 93.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.246 -0.909 . . . . 0.0 110.08 179.898 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.626 HG22 ' HG2' ' A' ' 37' ' ' GLN . 74.4 t -60.66 -44.79 97.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.271 -0.893 . . . . 0.0 110.256 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.71 -46.32 90.16 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.197 -0.94 . . . . 0.0 110.199 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.51 -42.02 92.53 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.27 -0.894 . . . . 0.0 110.232 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.449 HG23 ' O ' ' B' ' 16' ' ' VAL . 57.6 t -66.04 -46.04 89.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.304 -0.873 . . . . 0.0 110.244 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -63.08 -32.58 73.98 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.235 -0.915 . . . . 0.0 110.221 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 4.5 tp60 -56.9 -41.45 78.12 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.268 -0.895 . . . . 0.0 110.11 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 23' ' ' ALA . . . . . 0.546 ' HB2' ' CD2' ' A' ' 67' ' ' LEU . . . -60.63 -39.06 86.85 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.207 -0.933 . . . . 0.0 109.981 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 O-C-N 121.367 -0.833 . . . . 0.0 110.264 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.778 HG22 ' CZ ' ' A' ' 68' ' ' TYR . 1.9 m . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 121.195 0.521 . . . . 0.0 110.258 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -67.8 -37.97 82.69 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.289 -0.882 . . . . 0.0 109.43 179.592 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.6 tp10 -59.85 -36.02 75.98 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.418 -0.801 . . . . 0.0 109.681 179.209 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.15 -45.66 93.74 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.327 -0.858 . . . . 0.0 110.046 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.684 HG12 ' CD2' ' A' ' 14' ' ' PHE . 21.7 t -61.88 -43.64 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.097 -1.002 . . . . 0.0 109.649 179.621 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 34.8 mt -57.3 -49.47 79.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.385 -0.822 . . . . 0.0 109.413 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.05 -41.85 93.19 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.293 -0.879 . . . . 0.0 109.063 179.09 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.444 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 5.1 m -65.46 -41.24 93.6 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.48 -0.762 . . . . 0.0 109.153 179.022 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.684 ' CD2' HG12 ' A' ' 10' ' ' VAL . 2.2 m-85 -68.43 -41.26 80.58 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.385 -0.822 . . . . 0.0 109.395 179.257 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.471 ' HD3' ' HA ' ' A' ' 20' ' ' ASP . 1.5 tmm_? -53.58 -43.63 68.7 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.353 -0.842 . . . . 0.0 109.612 179.509 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.633 HD12 ' HB2' ' B' ' 12' ' ' ALA . 54.8 mt -60.14 -44.94 96.28 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.283 -0.886 . . . . 0.0 109.691 179.627 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 13' ' ' SER . 38.5 mt -65.36 -40.15 93.21 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.295 -0.878 . . . . 0.0 109.803 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.561 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -72.35 -4.88 32.58 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.298 -0.876 . . . . 0.0 110.103 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.468 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.3 OUTLIER 68.48 54.17 0.54 Allowed 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.24 -0.912 . . . . 0.0 110.2 -179.922 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.471 ' HA ' ' HD3' ' A' ' 15' ' ' ARG . 2.2 t70 63.02 36.74 12.2 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.204 -0.935 . . . . 0.0 110.313 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.561 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 7.5 mmtt -118.47 144.75 35.86 Favored Pre-proline 0 N--CA 1.49 1.543 0 O-C-N 121.237 -0.914 . . . . 0.0 110.037 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 21' ' ' LYS . 38.4 Cg_exo -68.77 -5.33 15.2 Favored 'Trans proline' 0 C--N 1.304 -1.79 0 O-C-N 124.123 1.591 . . . . 0.0 109.999 179.734 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.544 ' CD1' ' N ' ' A' ' 23' ' ' TYR . 18.0 p90 -141.01 165.11 28.45 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.419 -0.8 . . . . 0.0 110.106 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.859 HD12 ' CD2' ' A' ' 29' ' ' LEU . 0.4 OUTLIER -125.76 149.88 30.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.217 -0.927 . . . . 0.0 109.96 -179.886 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.823 HD22 ' N ' ' A' ' 25' ' ' LEU . 2.9 mm? -90.99 154.64 19.3 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.26 -0.9 . . . . 0.0 110.238 -179.872 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.0 -37.64 78.83 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.3 -0.875 . . . . 0.0 110.112 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -65.89 -35.2 79.98 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.277 -0.889 . . . . 0.0 110.071 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.44 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 1.1 mt-10 -62.59 -43.99 97.43 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.322 -0.862 . . . . 0.0 109.93 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.859 ' CD2' HD12 ' A' ' 24' ' ' ILE . 3.8 mm? -62.55 -34.31 76.69 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.173 -0.955 . . . . 0.0 109.883 179.738 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.77 -39.05 80.43 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.312 -0.868 . . . . 0.0 110.175 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.74 -15.9 27.68 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.267 -0.895 . . . . 0.0 110.298 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.44 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 3.1 mm-40 -100.41 -23.58 14.71 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.109 -0.994 . . . . 0.0 110.383 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.9 HD23 ' HD2' ' A' ' 34' ' ' PRO . 0.3 OUTLIER -134.8 151.4 75.63 Favored Pre-proline 0 N--CA 1.487 1.395 0 O-C-N 121.103 -0.998 . . . . 0.0 110.306 -179.694 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.9 ' HD2' HD23 ' A' ' 33' ' ' LEU . 8.8 Cg_endo -50.5 140.41 35.73 Favored 'Trans proline' 0 C--N 1.304 -1.763 0 O-C-N 124.009 1.531 . . . . 0.0 110.218 179.727 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -43.72 -35.03 6.19 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 124.029 1.542 . . . . 0.0 110.328 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -62.68 -45.63 91.89 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.179 -0.951 . . . . 0.0 110.239 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.743 ' HG2' HG22 ' B' ' 17' ' ' VAL . 1.9 mp0 -69.33 -42.23 75.6 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.179 -0.951 . . . . 0.0 110.297 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.45 -48.42 79.21 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.243 -0.911 . . . . 0.0 110.225 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -57.48 -43.06 83.79 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.31 -0.869 . . . . 0.0 109.867 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -66.13 -44.22 84.85 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.284 -0.885 . . . . 0.0 110.127 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.475 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 5.5 m -59.52 -50.7 72.9 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.3 -0.875 . . . . 0.0 110.494 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 81.2 mt -60.0 -25.21 32.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.269 -0.895 . . . . 0.0 110.339 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.85 -40.37 72.41 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.27 -0.894 . . . . 0.0 109.721 179.495 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.615 ' HB2' ' CD2' ' A' ' 63' ' ' PHE . 11.1 mpt_? -84.46 -69.07 0.67 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.373 -0.829 . . . . 0.0 109.815 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.699 ' HE1' ' HB3' ' A' ' 60' ' ' TYR . 21.5 mtt -32.04 116.78 0.39 Allowed Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.775 -0.578 . . . . 0.0 111.197 179.42 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.692 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 38.8 Cg_exo . . . . . 0 C--N 1.305 -1.753 0 O-C-N 124.013 1.533 . . . . 0.0 110.048 179.721 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.507 ' C ' HD13 ' A' ' 58' ' ' LEU . . . . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 121.274 0.559 . . . . 0.0 110.016 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.854 HD22 ' N ' ' A' ' 58' ' ' LEU . 0.9 OUTLIER -105.6 160.73 14.96 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.28 -0.887 . . . . 0.0 110.217 -179.615 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.514 ' OD1' ' N ' ' A' ' 59' ' ' ASP . 1.5 p-10 -107.46 110.53 22.5 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.097 -1.002 . . . . 0.0 111.081 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.699 ' HB3' ' HE1' ' A' ' 45' ' ' MET . 16.0 p90 -72.77 -23.21 60.79 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.328 -0.858 . . . . 0.0 109.231 178.878 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.576 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.19 -41.92 72.59 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.273 -0.892 . . . . 0.0 108.719 179.436 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.692 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -58.89 -32.19 69.28 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 119.494 -0.882 . . . . 0.0 108.79 178.493 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.634 ' CZ ' HG22 ' B' ' 20' ' ' VAL . 26.2 t80 -59.7 -49.33 78.16 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 121.257 0.551 . . . . 0.0 110.708 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.474 ' OG ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -70.5 -37.25 74.16 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.123 -0.985 . . . . 0.0 110.78 -179.432 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 51.3 p -64.52 -41.78 96.18 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.149 -0.969 . . . . 0.0 110.467 -179.691 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -75.57 -40.69 56.31 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.148 -0.97 . . . . 0.0 110.507 -179.76 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.577 HD13 ' CD1' ' A' ' 63' ' ' PHE . 0.2 OUTLIER -64.02 -43.98 93.95 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.204 -0.935 . . . . 0.0 110.424 -179.713 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.778 ' CZ ' HG22 ' A' ' 6' ' ' THR . 24.5 m-85 . . . . . 0 N--CA 1.489 1.501 0 O-C-N 121.23 -0.919 . . . . 0.0 110.287 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.649 0 CA-C-O 121.248 0.547 . . . . 0.0 110.282 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.444 ' HA ' HG21 ' A' ' 16' ' ' ILE . 10.4 ttpt -62.3 -39.45 93.05 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.251 -0.906 . . . . 0.0 110.239 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.66 -40.04 86.42 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.211 -0.931 . . . . 0.0 110.15 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.31 -39.81 91.87 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.316 -0.865 . . . . 0.0 110.273 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 12' ' ' ALA . . . . . 0.808 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -61.98 -41.87 98.51 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.18 -0.95 . . . . 0.0 109.984 -179.913 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.669 HG13 ' HG ' ' A' ' 33' ' ' LEU . 59.0 t -63.65 -43.11 98.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.264 -0.898 . . . . 0.0 109.721 179.518 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.51 -42.21 95.91 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.317 -0.864 . . . . 0.0 110.005 179.723 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 22.8 m -64.57 -43.21 94.63 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.314 -0.866 . . . . 0.0 110.018 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.808 HG23 ' O ' ' B' ' 12' ' ' ALA . 30.9 t -63.61 -46.51 94.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.255 -0.903 . . . . 0.0 110.024 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.743 HG22 ' HG2' ' A' ' 37' ' ' GLN . 83.2 t -58.16 -42.32 82.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.245 -0.91 . . . . 0.0 109.944 179.838 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.67 -45.57 93.66 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.231 -0.918 . . . . 0.0 109.917 179.634 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.97 -42.06 90.35 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.301 -0.874 . . . . 0.0 109.957 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.634 HG22 ' CZ ' ' A' ' 63' ' ' PHE . 52.2 t -67.77 -43.2 86.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.278 -0.889 . . . . 0.0 110.045 179.837 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 21' ' ' ASP . . . . . 0.461 ' O ' ' HG2' ' B' ' 24' ' ' ARG . 2.0 t70 -64.2 -34.04 77.17 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.283 -0.885 . . . . 0.0 110.123 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.9 -36.58 82.6 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.232 -0.917 . . . . 0.0 110.243 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 23' ' ' ALA . . . . . 0.539 ' HB2' ' CD2' ' A' ' 67' ' ' LEU . . . -65.38 -42.77 92.32 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.238 -0.913 . . . . 0.0 110.618 -179.701 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 24' ' ' ARG . . . . . 0.461 ' HG2' ' O ' ' B' ' 21' ' ' ASP . 2.1 ptm180 . . . . . 0 N--CA 1.493 1.679 0 O-C-N 121.041 -1.037 . . . . 0.0 110.274 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.418 HG22 ' CZ ' ' A' ' 68' ' ' TYR . 4.2 m . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 121.265 0.555 . . . . 0.0 110.092 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -70.04 -46.25 65.42 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.162 -0.961 . . . . 0.0 109.909 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -54.64 -36.68 64.79 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.383 -0.823 . . . . 0.0 110.051 179.654 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.416 ' HG2' HG21 ' B' ' 15' ' ' THR . 40.6 tt0 -61.63 -43.09 99.51 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.255 -0.903 . . . . 0.0 110.236 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 98.2 t -61.79 -42.13 93.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.194 -0.941 . . . . 0.0 109.996 179.829 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.622 HG23 ' HE1' ' A' ' 60' ' ' TYR . 82.7 mt -57.41 -49.88 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.31 -0.869 . . . . 0.0 109.683 179.68 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.54 -37.61 76.04 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 119.504 -0.878 . . . . 0.0 108.796 178.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.475 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 41.7 m -67.66 -39.7 84.54 Favored 'General case' 0 N--CA 1.485 1.324 0 O-C-N 121.456 -0.778 . . . . 0.0 109.206 178.98 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.517 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 0.7 OUTLIER -68.41 -42.62 78.73 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.346 -0.847 . . . . 0.0 109.534 179.185 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -53.95 -41.57 67.92 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.245 -0.91 . . . . 0.0 108.939 179.077 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.8 mt -62.0 -41.11 89.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.459 -0.775 . . . . 0.0 109.611 179.21 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 13' ' ' SER . 26.7 mt -64.89 -41.94 95.19 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.256 -0.902 . . . . 0.0 109.456 179.455 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.666 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -77.14 -7.31 55.58 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.438 -0.789 . . . . 0.0 110.092 179.761 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.477 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 68.07 67.44 0.34 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.231 -0.918 . . . . 0.0 110.235 -179.908 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.413 ' O ' ' HG2' ' A' ' 21' ' ' LYS . 0.3 OUTLIER 59.85 61.84 1.82 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.246 -0.908 . . . . 0.0 110.3 179.885 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.666 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 6.3 mttt -147.92 142.78 16.93 Favored Pre-proline 0 N--CA 1.489 1.487 0 O-C-N 121.234 -0.916 . . . . 0.0 110.01 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 21' ' ' LYS . 35.2 Cg_exo -74.29 0.92 7.9 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 O-C-N 123.955 1.503 . . . . 0.0 110.081 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.477 ' CD1' ' HB1' ' A' ' 57' ' ' ALA . 45.5 p90 -145.83 164.82 30.73 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.259 -0.901 . . . . 0.0 110.159 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.815 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -131.62 141.91 44.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.162 -0.961 . . . . 0.0 110.2 -179.873 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.815 ' N ' HD13 ' A' ' 24' ' ' ILE . 4.2 mt -81.52 157.7 24.73 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.13 -0.981 . . . . 0.0 110.205 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.73 -41.06 75.8 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.302 -0.874 . . . . 0.0 110.32 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -60.7 -35.41 76.23 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.176 -0.953 . . . . 0.0 110.17 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.455 ' OE1' ' OE2' ' A' ' 32' ' ' GLU . 9.0 mt-10 -64.25 -44.11 92.82 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.348 -0.845 . . . . 0.0 109.925 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.637 HD12 HG13 ' A' ' 42' ' ' ILE . 18.0 mt -60.66 -33.72 73.24 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.203 -0.936 . . . . 0.0 109.609 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.594 HH12 HD13 ' A' ' 42' ' ' ILE . 18.9 mtt85 -67.89 -35.08 77.88 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.388 -0.82 . . . . 0.0 110.309 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.4 ttt180 -95.62 -20.62 18.81 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.164 -0.96 . . . . 0.0 110.82 -179.649 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.456 ' OE1' ' HB3' ' A' ' 17' ' ' LEU . 86.5 mt-10 -96.14 -23.78 16.59 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.05 -1.031 . . . . 0.0 110.466 -179.764 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.521 HD22 ' CB ' ' A' ' 37' ' ' GLN . 6.0 mt -129.44 153.59 80.62 Favored Pre-proline 0 C--N 1.305 -1.348 0 O-C-N 121.233 -0.917 . . . . 0.0 110.078 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.415 ' CD ' HD23 ' A' ' 33' ' ' LEU . 33.1 Cg_exo -56.19 154.46 28.45 Favored 'Trans proline' 0 C--N 1.306 -1.69 0 O-C-N 123.94 1.495 . . . . 0.0 110.264 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -47.68 -38.74 29.66 Favored 'Trans proline' 0 C--N 1.307 -1.652 0 O-C-N 124.048 1.551 . . . . 0.0 110.305 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.73 -46.33 85.87 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.248 -0.908 . . . . 0.0 110.291 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.621 ' HG2' HG22 ' B' ' 17' ' ' VAL . 9.6 mp0 -69.27 -44.42 71.92 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.282 -0.886 . . . . 0.0 110.383 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.904 ' O ' HD12 ' A' ' 42' ' ' ILE . . . -56.26 -48.07 77.29 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.175 -0.953 . . . . 0.0 110.367 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.8 tm0? -64.74 -43.02 94.7 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.226 -0.921 . . . . 0.0 110.191 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -64.93 -46.79 80.17 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.281 -0.887 . . . . 0.0 110.305 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.443 ' SG ' ' O ' ' A' ' 37' ' ' GLN . 62.2 m -65.46 -49.71 68.09 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.157 -0.965 . . . . 0.0 110.452 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.904 HD12 ' O ' ' A' ' 38' ' ' ALA . 6.3 mt -58.22 -24.03 23.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.221 -0.924 . . . . 0.0 110.38 -179.769 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.41 -30.3 33.62 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.156 -0.965 . . . . 0.0 110.367 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.576 ' HG3' ' CE1' ' A' ' 63' ' ' PHE . 2.2 mmt180 -86.27 -58.93 2.44 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.218 -0.927 . . . . 0.0 110.195 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.687 ' SD ' HG22 ' A' ' 24' ' ' ILE . 1.4 ttm -38.29 119.27 1.02 Allowed Pre-proline 0 N--CA 1.492 1.641 0 O-C-N 121.511 -0.743 . . . . 0.0 110.722 179.855 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.446 ' CD ' ' HB3' ' A' ' 62' ' ' ALA . 12.4 Cg_endo . . . . . 0 C--N 1.305 -1.736 0 O-C-N 123.937 1.493 . . . . 0.0 110.22 179.792 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.477 ' HB1' ' CD1' ' A' ' 23' ' ' TYR . . . . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 121.268 0.556 . . . . 0.0 110.207 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.487 ' CB ' ' HG2' ' A' ' 45' ' ' MET . 13.2 mt -92.71 155.76 17.49 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.186 -0.946 . . . . 0.0 110.17 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.472 ' C ' ' HG3' ' A' ' 45' ' ' MET . 4.4 m-20 -103.32 111.7 24.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.2 -0.938 . . . . 0.0 110.13 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.622 ' HE1' HG23 ' A' ' 11' ' ' ILE . 23.7 p90 -72.63 -22.35 60.96 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.389 -0.82 . . . . 0.0 110.157 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.488 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.01 -34.18 65.58 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.182 -0.949 . . . . 0.0 110.021 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.446 ' HB3' ' CD ' ' A' ' 46' ' ' PRO . . . -68.23 -36.49 79.58 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.234 -0.916 . . . . 0.0 109.827 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.606 ' CE1' ' HB3' ' A' ' 67' ' ' LEU . 3.5 t80 -72.1 -35.42 69.2 Favored 'General case' 0 C--N 1.297 -1.683 0 O-C-N 121.676 -0.64 . . . . 0.0 110.455 179.806 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.5 m -56.51 -49.76 73.78 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.258 -0.901 . . . . 0.0 110.567 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.5 m -66.15 -35.6 80.92 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.247 -0.908 . . . . 0.0 110.471 -179.655 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.13 -39.36 63.36 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.299 -0.875 . . . . 0.0 110.841 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.732 HD12 ' C ' ' A' ' 67' ' ' LEU . 0.3 OUTLIER -72.55 -41.22 66.02 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.099 -1.001 . . . . 0.0 110.413 -179.499 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.627 ' CD2' HD11 ' A' ' 67' ' ' LEU . 1.8 m-85 . . . . . 0 N--CA 1.491 1.625 0 O-C-N 121.38 -0.825 . . . . 0.0 110.206 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 5.6 ptpp? . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.217 0.532 . . . . 0.0 110.093 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.544 ' O ' HG23 ' B' ' 13' ' ' VAL . 6.2 ttmt -62.63 -45.67 91.77 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.277 -0.89 . . . . 0.0 109.983 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.52 -37.87 79.47 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.219 -0.926 . . . . 0.0 109.906 179.721 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -63.34 -43.08 98.77 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.238 -0.914 . . . . 0.0 110.014 179.731 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 12' ' ' ALA . . . . . 0.465 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -63.65 -37.56 87.81 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.299 -0.875 . . . . 0.0 110.088 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.591 ' O ' HG23 ' B' ' 17' ' ' VAL . 87.9 t -60.63 -43.27 94.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.269 -0.894 . . . . 0.0 110.018 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.07 -39.07 84.77 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.298 -0.876 . . . . 0.0 110.158 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 15' ' ' THR . . . . . 0.416 HG21 ' HG2' ' A' ' 9' ' ' GLN . 53.0 m -65.52 -49.01 70.53 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.182 -0.949 . . . . 0.0 110.118 179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.607 ' O ' HG23 ' B' ' 20' ' ' VAL . 36.9 t -63.53 -40.73 90.15 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.319 -0.863 . . . . 0.0 110.21 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.621 HG22 ' HG2' ' A' ' 37' ' ' GLN . 71.6 t -61.94 -47.26 94.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.224 -0.922 . . . . 0.0 110.271 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.44 -41.1 96.75 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.161 -0.962 . . . . 0.0 110.425 -179.754 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.78 -45.6 81.82 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.18 -0.95 . . . . 0.0 110.371 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.607 HG23 ' O ' ' B' ' 16' ' ' VAL . 58.4 t -67.83 -45.91 83.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.178 -0.951 . . . . 0.0 110.39 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -56.88 -31.78 65.19 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.253 -0.904 . . . . 0.0 110.271 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -56.79 -49.88 74.0 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.268 -0.895 . . . . 0.0 110.572 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.94 -34.87 73.84 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.226 -0.921 . . . . 0.0 110.545 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 2.5 tpt180 . . . . . 0 N--CA 1.493 1.689 0 O-C-N 121.164 -0.96 . . . . 0.0 110.489 -179.654 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.824 HG21 ' OH ' ' A' ' 68' ' ' TYR . 2.0 m . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 121.261 0.553 . . . . 0.0 110.107 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.88 -44.99 83.71 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.237 -0.914 . . . . 0.0 109.628 179.626 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.14 -36.01 67.78 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.467 -0.771 . . . . 0.0 109.959 179.532 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -61.11 -44.17 97.76 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.296 -0.878 . . . . 0.0 110.273 -179.642 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.473 ' HB ' ' HB3' ' A' ' 64' ' ' SER . 22.8 t -58.62 -46.36 90.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.151 -0.968 . . . . 0.0 109.964 179.842 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 21.5 mt -65.18 -49.73 77.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.303 -0.873 . . . . 0.0 109.699 179.789 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.14 -40.84 91.2 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.268 -0.895 . . . . 0.0 109.177 179.274 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.471 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 68.1 m -67.02 -41.15 87.11 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.394 -0.816 . . . . 0.0 109.277 179.134 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.537 ' HB3' ' CD2' ' A' ' 60' ' ' TYR . 1.7 m-85 -68.2 -43.01 79.03 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.386 -0.821 . . . . 0.0 109.57 179.426 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.1 ttp180 -53.24 -41.19 65.2 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.217 -0.927 . . . . 0.0 109.124 179.222 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.5 mt -59.8 -44.86 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.446 -0.784 . . . . 0.0 109.504 179.151 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 13' ' ' SER . 18.4 mt -65.05 -41.68 94.94 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.287 -0.883 . . . . 0.0 109.701 179.508 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.629 ' HB1' ' O ' ' A' ' 23' ' ' TYR . . . -73.29 -1.41 17.82 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.307 -0.871 . . . . 0.0 110.074 179.778 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.489 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 1.4 t 68.28 64.92 0.34 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.198 -0.939 . . . . 0.0 110.267 -179.998 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 50.26 58.2 5.75 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.397 -0.814 . . . . 0.0 110.293 179.953 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.577 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 29.8 mttt -140.7 143.01 30.64 Favored Pre-proline 0 N--CA 1.49 1.56 0 O-C-N 121.303 -0.873 . . . . 0.0 110.085 179.852 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_endo -65.62 -7.6 16.81 Favored 'Trans proline' 0 C--N 1.305 -1.722 0 O-C-N 123.931 1.49 . . . . 0.0 110.122 179.83 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.629 ' O ' ' HB1' ' A' ' 18' ' ' ALA . 23.3 p90 -138.99 166.4 24.59 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.214 -0.929 . . . . 0.0 110.495 -179.927 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.727 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -136.32 144.48 32.85 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.374 -0.829 . . . . 0.0 109.87 -179.967 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.727 ' N ' HD13 ' A' ' 24' ' ' ILE . 4.0 mt -79.87 150.4 30.64 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.188 -0.945 . . . . 0.0 110.075 -179.825 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.581 ' HB2' HD11 ' A' ' 58' ' ' LEU . . . -67.17 -45.61 76.46 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.297 -0.877 . . . . 0.0 110.327 -179.875 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.456 ' CG ' ' N ' ' A' ' 28' ' ' GLU . 22.9 pt-20 -59.27 -37.54 77.88 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.138 -0.976 . . . . 0.0 109.747 179.883 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.456 ' N ' ' CG ' ' A' ' 27' ' ' GLU . 6.2 tt0 -66.75 -34.66 78.32 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.237 -0.914 . . . . 0.0 108.876 179.076 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.556 HD11 ' HA ' ' A' ' 38' ' ' ALA . 2.6 tp -66.67 -39.92 88.37 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 108.706 -0.849 . . . . 0.0 108.706 178.803 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.23 -34.43 78.09 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.561 -0.712 . . . . 0.0 109.544 179.065 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.7 tpt180 -84.46 -39.3 19.1 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.484 -0.76 . . . . 0.0 110.876 -179.792 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -76.15 -23.5 54.79 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.217 -0.927 . . . . 0.0 110.973 -179.084 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.684 HD11 HG11 ' B' ' 16' ' ' VAL . 4.2 mt -127.87 156.59 75.69 Favored Pre-proline 0 N--CA 1.488 1.458 0 O-C-N 121.07 -1.019 . . . . 0.0 110.228 -179.837 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.606 ' CD ' HD23 ' A' ' 33' ' ' LEU . 22.9 Cg_exo -60.01 142.49 98.55 Favored 'Trans proline' 0 C--N 1.304 -1.774 0 O-C-N 124.011 1.532 . . . . 0.0 110.184 179.979 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -41.68 -38.87 4.59 Favored 'Trans proline' 0 C--N 1.304 -1.773 0 O-C-N 124.065 1.561 . . . . 0.0 110.225 179.996 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -63.12 -43.28 98.87 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.337 -0.852 . . . . 0.0 110.242 179.956 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.794 ' HG3' HG22 ' B' ' 17' ' ' VAL . 82.3 mm-40 -69.21 -41.99 76.34 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.188 -0.945 . . . . 0.0 109.981 179.966 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.556 ' HA ' HD11 ' A' ' 29' ' ' LEU . . . -63.67 -48.22 78.08 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.294 -0.879 . . . . 0.0 110.089 179.969 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -54.95 -48.6 72.96 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.251 -0.906 . . . . 0.0 109.926 179.932 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -64.01 -47.86 78.61 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.311 -0.868 . . . . 0.0 109.854 179.771 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.509 ' O ' ' HG2' ' A' ' 45' ' ' MET . 75.9 m -65.43 -49.57 68.69 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.341 -0.849 . . . . 0.0 110.381 179.929 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.474 HG12 ' O ' ' A' ' 38' ' ' ALA . 9.0 mm -41.54 -33.43 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.317 -0.865 . . . . 0.0 110.241 -179.893 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.44 -37.67 19.52 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.29 -0.881 . . . . 0.0 110.263 179.948 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.521 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 0.9 OUTLIER -65.79 -75.66 0.09 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.284 -0.885 . . . . 0.0 110.243 -179.878 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.549 ' CE ' ' HB3' ' A' ' 60' ' ' TYR . 6.3 ptp -53.02 108.58 1.14 Allowed Pre-proline 0 N--CA 1.488 1.462 0 O-C-N 121.22 -0.925 . . . . 0.0 110.175 179.952 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.506 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 17.3 Cg_exo . . . . . 0 C--N 1.305 -1.756 0 O-C-N 123.995 1.524 . . . . 0.0 110.326 -179.865 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.413 ' HB1' ' HB2' ' A' ' 23' ' ' TYR . . . . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.269 0.557 . . . . 0.0 110.334 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.581 HD11 ' HB2' ' A' ' 26' ' ' ALA . 91.7 mt -127.71 160.29 32.12 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.294 -0.879 . . . . 0.0 110.024 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -111.75 111.93 23.26 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.149 -0.969 . . . . 0.0 110.517 -179.775 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.549 ' HB3' ' CE ' ' A' ' 45' ' ' MET . 14.5 p90 -81.66 -19.82 40.87 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.318 -0.864 . . . . 0.0 109.647 179.415 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.422 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.03 -36.65 68.24 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.249 -0.907 . . . . 0.0 109.793 179.883 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.506 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -63.94 -34.95 79.14 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.224 -0.923 . . . . 0.0 109.763 179.593 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.953 ' CZ ' HD11 ' A' ' 67' ' ' LEU . 4.6 t80 -71.78 -32.74 67.96 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.567 -0.708 . . . . 0.0 110.114 179.628 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.473 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.9 OUTLIER -71.79 -49.29 40.02 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.348 -0.845 . . . . 0.0 110.297 -179.876 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 66.2 m -63.75 -42.34 97.86 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.251 -0.905 . . . . 0.0 110.301 -179.887 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.52 -28.75 65.18 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.188 -0.945 . . . . 0.0 110.27 -179.87 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.953 HD11 ' CZ ' ' A' ' 63' ' ' PHE . 8.4 mt -61.44 -42.41 98.71 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.205 -0.935 . . . . 0.0 110.365 -179.935 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.824 ' OH ' HG21 ' A' ' 6' ' ' THR . 20.1 m-85 . . . . . 0 N--CA 1.492 1.644 0 O-C-N 121.208 -0.932 . . . . 0.0 110.223 179.987 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 3.1 tmtm? . . . . . 0 N--CA 1.492 1.641 0 CA-C-O 121.268 0.556 . . . . 0.0 110.132 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.402 ' O ' HG23 ' B' ' 13' ' ' VAL . 0.7 OUTLIER -61.79 -44.69 96.37 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.18 -0.95 . . . . 0.0 110.147 179.974 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.01 -38.8 68.35 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.219 -0.926 . . . . 0.0 109.949 179.871 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -65.48 -39.93 92.51 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.286 -0.884 . . . . 0.0 110.017 179.806 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.28 -37.5 85.75 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.208 -0.933 . . . . 0.0 109.991 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.402 HG23 ' O ' ' B' ' 9' ' ' LYS . 51.9 t -65.0 -40.44 89.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.208 -0.933 . . . . 0.0 109.8 179.658 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.63 -35.59 76.57 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.326 -0.858 . . . . 0.0 110.058 179.843 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 41.2 m -68.1 -43.6 78.12 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.291 -0.88 . . . . 0.0 110.238 -179.981 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.684 HG11 HD11 ' A' ' 33' ' ' LEU . 92.1 t -66.6 -42.48 89.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.273 -0.892 . . . . 0.0 110.134 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.794 HG22 ' HG3' ' A' ' 37' ' ' GLN . 70.1 t -63.38 -47.54 91.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.406 -0.809 . . . . 0.0 110.313 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.31 -40.76 95.36 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.307 -0.871 . . . . 0.0 110.198 -179.976 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.67 -37.97 88.0 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.286 -0.884 . . . . 0.0 110.236 179.977 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.526 HG23 ' O ' ' B' ' 16' ' ' VAL . 54.5 t -67.92 -43.86 85.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.199 -0.938 . . . . 0.0 110.273 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 38.4 t0 -62.1 -35.57 79.1 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.308 -0.87 . . . . 0.0 110.366 -179.965 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -60.05 -50.08 75.12 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.222 -0.924 . . . . 0.0 110.297 -179.978 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 23' ' ' ALA . . . . . 0.43 ' HB2' ' CD2' ' A' ' 67' ' ' LEU . . . -63.76 -35.07 79.39 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.278 -0.889 . . . . 0.0 110.107 179.994 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.689 0 O-C-N 121.247 -0.908 . . . . 0.0 110.182 179.833 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 121.237 0.541 . . . . 0.0 110.191 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.68 -47.78 77.17 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.186 -0.946 . . . . 0.0 109.867 179.909 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.65 -36.15 64.26 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.425 -0.797 . . . . 0.0 109.981 179.586 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.45 -44.68 96.68 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.364 -0.835 . . . . 0.0 110.37 -179.711 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.48 HG21 HD21 ' A' ' 67' ' ' LEU . 88.6 t -57.99 -41.38 80.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.261 -0.9 . . . . 0.0 110.012 179.996 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 59.5 mt -63.65 -49.83 80.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.359 -0.838 . . . . 0.0 109.651 179.653 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.25 -42.45 91.15 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.284 -0.885 . . . . 0.0 109.033 179.22 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.471 ' HA ' HD12 ' A' ' 16' ' ' ILE . 0.1 OUTLIER -64.09 -39.43 94.05 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.379 -0.826 . . . . 0.0 109.302 179.033 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.623 ' CB ' ' CD1' ' A' ' 60' ' ' TYR . 3.1 m-85 -68.15 -42.17 80.51 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.308 -0.87 . . . . 0.0 109.51 179.282 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -55.85 -41.18 73.94 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.166 -0.959 . . . . 0.0 109.429 179.209 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.637 ' CD1' ' HB2' ' B' ' 12' ' ' ALA . 96.8 mt -60.27 -44.84 96.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.388 -0.82 . . . . 0.0 109.728 179.408 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 13' ' ' SER . 61.1 mt -64.98 -41.89 95.04 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.315 -0.866 . . . . 0.0 109.548 179.561 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.566 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -71.06 -15.27 62.53 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.357 -0.839 . . . . 0.0 110.089 179.625 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.478 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 68.05 72.25 0.31 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.291 -0.881 . . . . 0.0 110.339 -179.985 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.463 ' HB2' ' O ' ' A' ' 19' ' ' SER . 2.7 m-20 56.62 61.9 2.49 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.347 -0.845 . . . . 0.0 110.367 179.857 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.566 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 35.1 mttp -153.5 142.1 14.3 Favored Pre-proline 0 N--CA 1.489 1.49 0 O-C-N 121.274 -0.891 . . . . 0.0 110.093 179.878 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -76.59 3.9 6.02 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 O-C-N 124.092 1.575 . . . . 0.0 110.188 179.912 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.416 ' CD1' ' C ' ' A' ' 23' ' ' TYR . 20.6 p90 -145.9 156.52 43.59 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.185 -0.947 . . . . 0.0 110.026 179.999 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.827 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -125.67 142.74 41.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.169 -0.957 . . . . 0.0 109.735 179.997 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.827 ' N ' HD13 ' A' ' 24' ' ' ILE . 6.0 mp -80.14 145.81 32.15 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.132 -0.98 . . . . 0.0 109.919 -179.729 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.469 ' O ' ' HG ' ' A' ' 29' ' ' LEU . . . -58.68 -44.91 90.36 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.324 -0.86 . . . . 0.0 110.366 -179.628 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.77 -34.18 77.74 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.216 -0.928 . . . . 0.0 110.369 180.0 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.619 ' HB3' HD11 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -64.08 -51.08 65.74 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.12 -0.988 . . . . 0.0 110.288 -179.698 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.861 HD21 ' CG1' ' A' ' 42' ' ' ILE . 1.0 OUTLIER -67.27 -33.54 75.51 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.141 -0.974 . . . . 0.0 109.579 179.402 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.802 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -61.23 -35.0 76.04 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.524 -0.735 . . . . 0.0 110.347 -179.965 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.2 ttt180 -94.03 -17.83 22.48 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.221 -0.925 . . . . 0.0 110.262 -179.949 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -90.09 -21.62 22.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.273 -0.892 . . . . 0.0 110.246 179.972 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.702 HD11 HG11 ' B' ' 16' ' ' VAL . 11.2 mt -117.59 154.27 50.69 Favored Pre-proline 0 N--CA 1.487 1.395 0 O-C-N 121.261 -0.899 . . . . 0.0 110.249 -179.698 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.468 ' HD2' ' HB2' ' A' ' 37' ' ' GLN . 39.7 Cg_exo -59.24 153.87 50.17 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 O-C-N 123.875 1.461 . . . . 0.0 110.134 179.788 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -43.89 -44.1 11.95 Favored 'Trans proline' 0 C--N 1.305 -1.72 0 O-C-N 124.088 1.573 . . . . 0.0 110.542 -179.857 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.424 ' O ' ' HB2' ' A' ' 40' ' ' TYR . 0.3 OUTLIER -65.53 -46.91 77.76 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.273 -0.892 . . . . 0.0 110.393 -179.835 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.612 ' HG2' HG22 ' B' ' 17' ' ' VAL . 3.8 mp0 -69.69 -41.82 74.94 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.202 -0.936 . . . . 0.0 110.377 -179.935 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.802 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -59.21 -48.38 81.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.183 -0.948 . . . . 0.0 110.374 -179.811 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 -66.23 -43.48 86.49 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.25 -0.906 . . . . 0.0 110.37 -179.894 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.424 ' HB2' ' O ' ' A' ' 36' ' ' ASP . 1.2 t80 -62.31 -47.08 85.88 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.31 -0.869 . . . . 0.0 110.548 -179.76 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.455 ' O ' ' SD ' ' A' ' 45' ' ' MET . 71.9 m -62.43 -51.17 68.59 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.284 -0.885 . . . . 0.0 110.508 -179.668 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.861 ' CG1' HD21 ' A' ' 29' ' ' LEU . 53.3 mt -58.84 -19.08 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.244 -0.91 . . . . 0.0 110.332 -179.96 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 4.9 tttm -85.22 -19.98 30.84 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.323 -0.861 . . . . 0.0 110.529 -179.717 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.601 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 12.6 mmt85 -100.35 -72.82 0.66 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.176 -0.953 . . . . 0.0 110.759 -179.56 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.531 ' N ' ' HB2' ' A' ' 63' ' ' PHE . 1.4 ptm -45.25 127.47 5.85 Favored Pre-proline 0 N--CA 1.487 1.412 0 O-C-N 121.14 -0.975 . . . . 0.0 110.265 -179.698 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.706 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 9.4 Cg_endo . . . . . 0 C--N 1.305 -1.738 0 O-C-N 124.084 1.571 . . . . 0.0 110.3 -179.94 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.591 0 CA-C-O 121.069 0.461 . . . . 0.0 110.213 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.5 HD12 ' N ' ' A' ' 58' ' ' LEU . 2.5 mp -129.03 143.66 50.94 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.223 -0.923 . . . . 0.0 110.089 179.592 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.543 ' OD1' ' HB3' ' A' ' 61' ' ' ALA . 7.7 t0 -94.69 111.29 23.06 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.18 -0.95 . . . . 0.0 110.244 179.755 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.623 ' CD1' ' CB ' ' A' ' 14' ' ' PHE . 21.7 p90 -76.87 -25.29 52.92 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.189 -0.944 . . . . 0.0 108.882 179.118 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.543 ' HB3' ' OD1' ' A' ' 59' ' ' ASP . . . -56.42 -45.35 80.76 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.519 -0.738 . . . . 0.0 109.449 179.33 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.706 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -57.16 -36.15 70.4 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.346 -0.846 . . . . 0.0 109.643 179.549 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.601 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 1.6 t80 -71.8 -37.86 70.32 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.647 -0.658 . . . . 0.0 110.004 179.581 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.4 p -56.03 -49.73 72.89 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.313 -0.867 . . . . 0.0 110.234 -179.897 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.1 m -62.27 -37.3 84.95 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.165 -0.96 . . . . 0.0 110.064 179.892 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.89 -39.05 64.17 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.234 -0.916 . . . . 0.0 110.115 179.753 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.701 HD12 ' C ' ' A' ' 67' ' ' LEU . 0.1 OUTLIER -60.32 -44.86 95.08 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.247 -0.908 . . . . 0.0 109.593 179.893 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.557 ' N ' ' HG ' ' A' ' 67' ' ' LEU . 4.5 m-85 . . . . . 0 N--CA 1.492 1.65 0 O-C-N 121.569 -0.707 . . . . 0.0 110.239 179.985 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 24.6 ttmt . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 121.157 0.503 . . . . 0.0 110.153 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.413 ' HA ' HG21 ' A' ' 16' ' ' ILE . 8.7 ttpt -62.37 -48.44 79.78 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.274 -0.891 . . . . 0.0 110.174 -179.935 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.74 -40.22 72.21 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.196 -0.94 . . . . 0.0 109.986 179.915 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.35 -41.43 98.85 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.215 -0.928 . . . . 0.0 109.974 179.855 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 12' ' ' ALA . . . . . 0.637 ' HB2' ' CD1' ' A' ' 16' ' ' ILE . . . -62.86 -42.83 99.9 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.276 -0.89 . . . . 0.0 110.057 179.909 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.665 ' O ' HG23 ' B' ' 17' ' ' VAL . 79.0 t -57.53 -43.06 82.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.261 -0.899 . . . . 0.0 110.057 179.829 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.94 -37.55 85.13 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.338 -0.851 . . . . 0.0 109.97 179.849 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 15' ' ' THR . . . . . 0.402 ' HB ' ' OG ' ' A' ' 13' ' ' SER . 11.8 m -64.61 -44.26 91.13 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.296 -0.878 . . . . 0.0 109.879 179.91 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.702 HG11 HD11 ' A' ' 33' ' ' LEU . 73.5 t -65.71 -45.54 91.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.294 -0.879 . . . . 0.0 110.043 179.935 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.665 HG23 ' O ' ' B' ' 13' ' ' VAL . 59.5 t -58.42 -45.84 89.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.255 -0.903 . . . . 0.0 110.116 179.914 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.36 -43.79 93.45 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.297 -0.877 . . . . 0.0 110.256 179.993 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.44 -45.86 82.18 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.279 -0.888 . . . . 0.0 110.2 -179.95 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.427 HG23 ' O ' ' B' ' 16' ' ' VAL . 54.8 t -60.22 -41.17 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.259 -0.9 . . . . 0.0 110.056 179.826 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -64.79 -33.01 74.98 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.364 -0.835 . . . . 0.0 110.143 179.994 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.36 -49.98 75.71 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.206 -0.934 . . . . 0.0 110.027 179.881 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.42 -40.42 97.13 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.253 -0.905 . . . . 0.0 109.993 179.805 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 2.4 ttp85 . . . . . 0 N--CA 1.492 1.627 0 O-C-N 121.37 -0.831 . . . . 0.0 110.316 -179.966 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.601 HG22 ' CZ ' ' A' ' 68' ' ' TYR . 7.4 m . . . . . 0 N--CA 1.492 1.641 0 CA-C-O 121.096 0.474 . . . . 0.0 110.248 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -68.41 -36.2 78.75 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.158 -0.964 . . . . 0.0 109.561 179.702 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.593 ' HA ' HD12 ' A' ' 11' ' ' ILE . 0.5 OUTLIER -70.69 -36.49 73.32 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.401 -0.812 . . . . 0.0 109.812 179.474 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.57 -42.62 99.11 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.33 -0.856 . . . . 0.0 110.081 179.9 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.527 HG12 ' CD2' ' A' ' 14' ' ' PHE . 96.0 t -60.61 -46.44 95.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.224 -0.922 . . . . 0.0 109.829 179.643 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.593 HD12 ' HA ' ' A' ' 8' ' ' GLU . 56.8 mt -54.73 -45.78 73.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.328 -0.858 . . . . 0.0 109.393 179.471 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.72 -41.07 81.03 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.22 -0.925 . . . . 0.0 108.635 178.859 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.4 m -68.21 -37.95 81.42 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 178.718 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.577 ' HB3' ' CD1' ' A' ' 60' ' ' TYR . 1.9 m-85 -68.39 -41.95 79.77 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.452 -0.78 . . . . 0.0 109.387 179.033 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -54.15 -46.42 72.27 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.407 -0.808 . . . . 0.0 109.393 179.355 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 53.2 mt -58.13 -43.69 85.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.389 -0.819 . . . . 0.0 109.501 179.336 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.481 HD11 HG22 ' B' ' 13' ' ' VAL . 2.5 mp -65.0 -40.13 94.49 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.397 -0.814 . . . . 0.0 109.748 179.485 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.669 ' HB2' ' HB ' ' A' ' 24' ' ' ILE . . . -77.19 -1.35 29.02 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.374 -0.829 . . . . 0.0 110.246 179.739 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.483 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 0.3 OUTLIER 68.71 63.87 0.32 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.226 -0.922 . . . . 0.0 110.308 179.965 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 51.68 59.02 4.87 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.19 -0.944 . . . . 0.0 110.141 179.937 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 19' ' ' SER . 9.0 mttt -145.46 142.92 18.75 Favored Pre-proline 0 N--CA 1.49 1.525 0 O-C-N 121.248 -0.908 . . . . 0.0 110.071 179.985 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -69.63 -4.84 14.76 Favored 'Trans proline' 0 C--N 1.305 -1.723 0 O-C-N 123.973 1.512 . . . . 0.0 109.907 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.434 ' CD1' ' C ' ' A' ' 23' ' ' TYR . 19.6 p90 -144.77 161.9 38.09 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.349 -0.844 . . . . 0.0 109.884 179.866 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.669 ' HB ' ' HB2' ' A' ' 18' ' ' ALA . 11.3 tt -139.32 153.14 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.137 -0.977 . . . . 0.0 110.311 -179.823 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.2 mp -89.24 156.24 18.89 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.309 -0.87 . . . . 0.0 109.964 179.798 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.38 -42.23 92.92 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.172 -0.955 . . . . 0.0 110.256 -179.825 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -56.45 -40.48 74.87 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.28 -0.887 . . . . 0.0 110.152 179.931 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 1.9 mt-10 -68.32 -41.12 81.31 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.212 -0.93 . . . . 0.0 108.771 179.215 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.702 HD23 HG13 ' A' ' 42' ' ' ILE . 3.3 tp -66.83 -38.84 87.19 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 179.012 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.5 ttm180 -66.96 -34.58 78.08 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.559 -0.713 . . . . 0.0 110.587 -179.923 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.08 -20.26 22.24 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.21 -0.931 . . . . 0.0 111.04 -179.391 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.461 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 86.2 mt-10 -94.87 -19.26 20.44 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.012 -1.055 . . . . 0.0 110.814 -179.447 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.617 HD12 ' CD1' ' A' ' 29' ' ' LEU . 5.7 mt -120.92 162.06 37.03 Favored Pre-proline 0 N--CA 1.489 1.498 0 O-C-N 121.079 -1.013 . . . . 0.0 110.303 -179.857 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.492 ' CD ' HD23 ' A' ' 33' ' ' LEU . 32.5 Cg_exo -67.76 148.43 77.27 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 124.032 1.543 . . . . 0.0 110.246 179.914 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.402 ' C ' ' O ' ' A' ' 34' ' ' PRO . 16.6 Cg_exo -41.78 -40.59 5.73 Favored 'Trans proline' 0 C--N 1.303 -1.864 0 O-C-N 124.116 1.588 . . . . 0.0 110.496 -179.823 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -63.58 -47.25 82.27 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.223 -0.923 . . . . 0.0 110.37 -179.705 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.636 ' HG2' HG22 ' B' ' 17' ' ' VAL . 14.5 mp0 -69.58 -40.85 76.47 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.192 -0.943 . . . . 0.0 110.267 179.957 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.865 ' O ' HD12 ' A' ' 42' ' ' ILE . . . -58.88 -47.84 83.51 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.303 -0.873 . . . . 0.0 110.299 -179.921 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 48.7 tp60 -61.63 -48.83 79.12 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.309 -0.869 . . . . 0.0 110.378 -179.906 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.19 -42.22 89.15 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.235 -0.916 . . . . 0.0 110.228 179.991 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 13.7 m -63.65 -48.24 78.03 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.305 -0.872 . . . . 0.0 110.15 179.885 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.865 HD12 ' O ' ' A' ' 38' ' ' ALA . 1.2 mt -61.23 -21.24 24.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.274 -0.891 . . . . 0.0 110.071 -179.993 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -81.56 -39.79 24.08 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.15 -0.969 . . . . 0.0 110.144 179.794 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.599 ' HB2' ' CD2' ' A' ' 63' ' ' PHE . 40.4 mmt-85 -77.11 -66.09 0.87 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.273 -0.892 . . . . 0.0 109.97 179.805 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.634 ' HE3' ' CB ' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -29.91 114.92 0.31 Allowed Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.9 -0.5 . . . . 0.0 111.471 179.648 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.801 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 18.5 Cg_endo . . . . . 0 C--N 1.305 -1.743 0 O-C-N 124.003 1.528 . . . . 0.0 109.932 179.649 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.756 ' C ' HD22 ' A' ' 58' ' ' LEU . . . . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.33 0.586 . . . . 0.0 110.143 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.789 HD22 ' N ' ' A' ' 58' ' ' LEU . 3.1 mm? -113.66 160.49 18.55 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.361 -0.837 . . . . 0.0 110.021 179.962 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.886 ' OD1' ' HB3' ' A' ' 61' ' ' ALA . 6.9 t70 -109.38 110.23 21.31 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.993 -1.067 . . . . 0.0 111.008 -179.915 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.634 ' CB ' ' HE3' ' A' ' 45' ' ' MET . 26.4 p90 -73.1 -23.61 60.53 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 178.192 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.886 ' HB3' ' OD1' ' A' ' 59' ' ' ASP . . . -56.29 -40.68 74.67 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.702 -0.624 . . . . 0.0 109.71 179.667 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.801 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -56.4 -32.17 64.57 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.241 -0.912 . . . . 0.0 109.619 179.532 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.599 ' CD2' ' HB2' ' A' ' 44' ' ' ARG . 1.7 t80 -65.78 -47.6 74.63 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.6 -0.688 . . . . 0.0 110.559 179.976 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.0 t -55.81 -47.53 77.0 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.168 -0.958 . . . . 0.0 110.759 -179.288 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.32 -39.19 92.13 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.14 -0.975 . . . . 0.0 110.521 -179.721 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.26 -30.53 57.89 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.149 -0.969 . . . . 0.0 110.556 -179.656 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.815 HD13 ' HB2' ' B' ' 23' ' ' ALA . 0.6 OUTLIER -78.59 -45.2 22.24 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.119 -0.988 . . . . 0.0 109.603 -179.955 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.601 ' CZ ' HG22 ' A' ' 6' ' ' THR . 17.1 m-85 . . . . . 0 N--CA 1.491 1.607 0 O-C-N 121.535 -0.728 . . . . 0.0 110.316 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.155 0.503 . . . . 0.0 110.161 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.728 ' O ' HG23 ' B' ' 13' ' ' VAL . 2.4 ttmt -57.84 -50.04 74.62 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.2 -0.938 . . . . 0.0 109.926 179.863 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.0 -38.36 67.79 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.184 -0.948 . . . . 0.0 109.706 179.66 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -67.79 -41.03 83.82 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.407 -0.808 . . . . 0.0 109.874 179.684 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.53 -37.67 88.36 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.315 -0.865 . . . . 0.0 109.902 179.718 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.728 HG23 ' O ' ' B' ' 9' ' ' LYS . 46.5 t -61.1 -41.51 89.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.266 -0.896 . . . . 0.0 109.998 179.732 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.95 -42.94 99.97 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.264 -0.897 . . . . 0.0 110.022 179.778 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 90.6 m -61.29 -43.2 99.26 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.22 -0.925 . . . . 0.0 110.159 179.88 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.663 ' O ' HG23 ' B' ' 20' ' ' VAL . 98.2 t -64.81 -41.27 91.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.177 -0.952 . . . . 0.0 110.053 179.86 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.664 HG23 ' O ' ' B' ' 13' ' ' VAL . 86.5 t -59.87 -46.31 93.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.295 -0.878 . . . . 0.0 110.271 -179.964 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.17 -39.63 94.41 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.247 -0.908 . . . . 0.0 110.27 -179.948 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.42 -41.49 96.58 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.257 -0.902 . . . . 0.0 110.399 -179.855 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.663 HG23 ' O ' ' B' ' 16' ' ' VAL . 61.4 t -67.01 -41.67 87.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.225 -0.922 . . . . 0.0 110.367 -179.807 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.86 -40.14 91.8 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.269 -0.894 . . . . 0.0 110.303 -179.964 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.21 -49.03 72.99 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.251 -0.905 . . . . 0.0 110.287 -179.977 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 23' ' ' ALA . . . . . 0.815 ' HB2' HD13 ' A' ' 67' ' ' LEU . . . -63.02 -37.44 87.18 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.277 -0.889 . . . . 0.0 110.233 179.997 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 9.9 ttp180 . . . . . 0 N--CA 1.492 1.639 0 O-C-N 121.271 -0.893 . . . . 0.0 110.05 179.925 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.351 0.596 . . . . 0.0 110.134 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -66.16 -46.82 76.09 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.262 -0.899 . . . . 0.0 109.725 179.826 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.571 ' HA ' HD12 ' A' ' 11' ' ' ILE . 23.4 tt0 -54.52 -36.78 64.6 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.358 -0.839 . . . . 0.0 109.82 179.633 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -62.02 -48.39 80.49 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.29 -0.881 . . . . 0.0 109.91 179.92 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.531 HG12 ' HD2' ' A' ' 14' ' ' PHE . 77.7 t -58.92 -43.25 88.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.251 -0.906 . . . . 0.0 109.773 179.657 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.571 HD12 ' HA ' ' A' ' 8' ' ' GLU . 45.0 mt -62.0 -47.07 94.92 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.305 -0.872 . . . . 0.0 109.545 179.433 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.56 -42.13 82.41 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.324 -0.86 . . . . 0.0 108.944 179.175 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.473 ' O ' HD13 ' A' ' 17' ' ' LEU . 0.8 OUTLIER -68.43 -40.39 81.19 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.416 -0.802 . . . . 0.0 109.277 179.004 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.558 ' HB3' ' CD1' ' A' ' 60' ' ' TYR . 1.7 m-85 -65.26 -42.94 92.73 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.242 -0.911 . . . . 0.0 109.587 179.396 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 35.8 ttm-85 -55.96 -47.08 78.27 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.302 -0.873 . . . . 0.0 109.579 179.388 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.1 mt -60.73 -41.14 87.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.398 -0.814 . . . . 0.0 109.649 179.403 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.531 HD23 ' OE2' ' A' ' 32' ' ' GLU . 5.5 mp -64.86 -40.5 95.24 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.419 -0.8 . . . . 0.0 109.781 179.602 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.585 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -73.65 -4.89 37.04 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.405 -0.809 . . . . 0.0 110.103 179.842 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.458 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.1 OUTLIER 67.46 59.42 0.5 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.298 -0.876 . . . . 0.0 110.158 -179.948 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.423 ' CB ' ' O ' ' A' ' 19' ' ' SER . 0.2 OUTLIER 63.96 64.66 0.74 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.276 -0.89 . . . . 0.0 110.295 179.939 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.585 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 73.4 mttt -153.02 143.6 15.67 Favored Pre-proline 0 N--CA 1.489 1.491 0 O-C-N 121.212 -0.93 . . . . 0.0 110.093 -179.979 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -75.69 2.0 7.44 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 O-C-N 123.957 1.504 . . . . 0.0 110.011 179.539 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.549 ' CD1' ' N ' ' A' ' 23' ' ' TYR . 14.7 p90 -142.48 169.7 17.09 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.326 -0.858 . . . . 0.0 109.952 179.949 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.823 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -137.27 141.63 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.104 -0.998 . . . . 0.0 110.165 -179.897 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.823 ' N ' HD13 ' A' ' 24' ' ' ILE . 1.4 mp -81.54 153.6 26.69 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.21 -0.931 . . . . 0.0 110.127 -179.925 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.478 ' O ' ' HG ' ' A' ' 29' ' ' LEU . . . -68.27 -38.53 81.82 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.366 -0.834 . . . . 0.0 110.403 -179.775 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -69.25 -34.2 74.43 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.252 -0.905 . . . . 0.0 109.937 179.852 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.498 ' OE2' ' HA ' ' A' ' 18' ' ' ALA . 14.5 tt0 -65.5 -50.97 63.29 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.23 -0.919 . . . . 0.0 109.951 -179.98 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.733 HD12 ' C ' ' A' ' 29' ' ' LEU . 1.2 pp -67.3 -33.74 75.91 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.187 -0.945 . . . . 0.0 109.716 179.378 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.636 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 10.3 mtt-85 -63.73 -34.1 77.13 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.427 -0.796 . . . . 0.0 110.381 179.974 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.14 -16.33 29.78 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.205 -0.934 . . . . 0.0 111.255 -179.174 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.562 ' CG ' ' HA ' ' A' ' 29' ' ' LEU . 0.8 OUTLIER -99.51 -23.77 14.99 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.807 -1.183 . . . . 0.0 110.726 -179.667 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.652 HD22 ' HB3' ' A' ' 37' ' ' GLN . 4.3 mt -108.89 139.86 21.31 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.229 -0.919 . . . . 0.0 110.44 -179.994 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.492 ' HD2' HD23 ' A' ' 33' ' ' LEU . 37.5 Cg_exo -44.36 139.47 6.61 Favored 'Trans proline' 0 C--N 1.306 -1.693 0 O-C-N 123.962 1.506 . . . . 0.0 109.87 179.676 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.438 ' C ' ' O ' ' A' ' 34' ' ' PRO . 24.9 Cg_exo -39.92 -39.01 2.13 Favored 'Trans proline' 0 C--N 1.306 -1.693 0 O-C-N 124.027 1.541 . . . . 0.0 110.574 -179.563 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.16 -45.98 79.03 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.244 -0.91 . . . . 0.0 110.805 -179.891 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.652 ' HB3' HD22 ' A' ' 33' ' ' LEU . 98.3 mm-40 -69.64 -44.34 70.8 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.032 -1.043 . . . . 0.0 110.413 -179.664 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.636 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -58.16 -49.24 77.71 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.315 -0.866 . . . . 0.0 110.56 -179.553 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -58.97 -40.85 86.0 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.152 -0.967 . . . . 0.0 110.412 -179.887 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.29 -47.97 71.91 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.254 -0.904 . . . . 0.0 110.356 -179.88 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.573 ' HA ' ' CE1' ' A' ' 63' ' ' PHE . 48.1 m -63.02 -48.33 79.23 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.236 -0.915 . . . . 0.0 110.371 -179.863 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.644 ' CD1' HD21 ' A' ' 29' ' ' LEU . 12.4 mm -47.1 -19.3 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.303 -0.873 . . . . 0.0 111.225 -179.854 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.28 -24.12 30.04 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.969 -1.082 . . . . 0.0 111.527 -179.072 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.664 ' NH1' HD21 ' A' ' 67' ' ' LEU . 36.7 mtt180 -95.79 -69.91 0.73 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 120.862 -1.149 . . . . 0.0 110.862 -179.419 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.567 ' C ' ' O ' ' A' ' 44' ' ' ARG . 2.1 mtp -14.99 84.13 0.03 OUTLIER Pre-proline 0 N--CA 1.507 2.399 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -179.477 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.743 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 35.4 Cg_exo . . . . . 0 C--N 1.307 -1.64 0 O-C-N 124.053 1.554 . . . . 0.0 110.28 -179.923 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.332 0.587 . . . . 0.0 110.274 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 79.1 mt -121.06 157.44 30.04 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.195 -0.941 . . . . 0.0 109.962 179.813 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -104.54 112.07 25.0 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.209 -0.932 . . . . 0.0 110.527 -179.911 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.558 ' CD1' ' HB3' ' A' ' 14' ' ' PHE . 23.2 p90 -81.19 -19.43 43.33 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.298 -0.876 . . . . 0.0 109.353 179.483 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.427 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.86 -40.83 73.46 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.326 -0.859 . . . . 0.0 109.264 179.575 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.743 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -58.36 -32.31 68.45 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.328 -0.858 . . . . 0.0 108.981 179.083 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.887 ' O ' HD12 ' A' ' 67' ' ' LEU . 6.1 t80 -58.65 -45.45 89.3 Favored 'General case' 0 C--N 1.3 -1.558 0 CA-C-O 121.278 0.561 . . . . 0.0 110.219 179.607 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 81.2 p -72.44 -45.02 61.5 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.191 -0.943 . . . . 0.0 110.554 -179.78 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 47.2 t -68.42 -41.04 80.97 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.255 -0.903 . . . . 0.0 110.576 -179.642 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.25 -35.44 71.42 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.209 -0.932 . . . . 0.0 110.594 -179.683 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.887 HD12 ' O ' ' A' ' 63' ' ' PHE . 11.2 mt -74.94 -41.14 60.21 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.172 -0.955 . . . . 0.0 110.556 -179.705 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 . . . . . 0 N--CA 1.491 1.59 0 O-C-N 121.154 -0.966 . . . . 0.0 110.307 -179.783 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 121.284 0.564 . . . . 0.0 110.279 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.401 ' O ' HG23 ' B' ' 13' ' ' VAL . 0.0 OUTLIER -60.36 -44.05 95.95 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.302 -0.873 . . . . 0.0 110.241 -179.997 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.16 -35.95 74.42 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.195 -0.94 . . . . 0.0 110.067 179.993 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -65.42 -40.62 93.56 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.268 -0.895 . . . . 0.0 109.91 179.855 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 12' ' ' ALA . . . . . 0.418 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -64.17 -44.32 92.42 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.292 -0.88 . . . . 0.0 110.234 179.96 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.609 ' O ' HG23 ' B' ' 17' ' ' VAL . 47.5 t -62.25 -46.25 96.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.229 -0.919 . . . . 0.0 110.042 -179.914 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.49 -35.42 72.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.281 -0.887 . . . . 0.0 110.038 179.905 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 8.8 m -66.2 -42.87 88.22 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.267 -0.895 . . . . 0.0 109.97 179.737 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.761 ' O ' HG23 ' B' ' 20' ' ' VAL . 53.3 t -67.16 -43.3 88.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.21 -0.931 . . . . 0.0 110.103 179.907 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.609 HG23 ' O ' ' B' ' 13' ' ' VAL . 59.2 t -61.4 -44.92 99.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.354 -0.841 . . . . 0.0 110.315 -179.905 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.14 -43.54 94.92 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.222 -0.924 . . . . 0.0 110.213 179.865 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.37 -40.59 96.14 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.28 -0.887 . . . . 0.0 110.213 -179.898 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.761 HG23 ' O ' ' B' ' 16' ' ' VAL . 65.6 t -67.49 -42.52 87.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.153 -0.967 . . . . 0.0 110.101 179.993 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -63.17 -40.13 96.65 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.274 -0.891 . . . . 0.0 110.132 179.919 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -54.21 -49.96 68.2 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.288 -0.883 . . . . 0.0 109.846 179.908 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 23' ' ' ALA . . . . . 0.479 ' HB2' HD22 ' A' ' 67' ' ' LEU . . . -58.27 -42.41 86.47 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.192 -0.942 . . . . 0.0 109.795 179.632 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 5.0 ttp180 . . . . . 0 N--CA 1.49 1.535 0 O-C-N 121.303 -0.873 . . . . 0.0 109.99 179.837 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.1 m . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.262 0.553 . . . . 0.0 110.271 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.582 ' HA ' ' CZ ' ' A' ' 68' ' ' TYR . . . -65.22 -46.55 80.17 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.193 -0.942 . . . . 0.0 109.948 179.925 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.78 -36.54 69.98 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.28 -0.888 . . . . 0.0 109.831 179.485 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.57 -43.36 99.01 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.341 -0.849 . . . . 0.0 110.181 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.868 HG21 ' OH ' ' A' ' 68' ' ' TYR . 65.6 t -59.07 -44.87 92.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.09 -1.006 . . . . 0.0 109.777 179.732 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 44.4 mt -57.1 -49.72 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.404 -0.81 . . . . 0.0 109.465 179.574 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.78 -39.24 84.23 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.309 -0.869 . . . . 0.0 108.829 178.901 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.504 ' HB3' HG23 ' B' ' 16' ' ' VAL . 70.8 m -65.41 -40.54 93.52 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.465 -0.772 . . . . 0.0 109.099 178.898 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -66.82 -43.88 82.65 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.343 -0.848 . . . . 0.0 109.366 179.102 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -53.35 -41.21 65.58 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.353 -0.842 . . . . 0.0 109.153 179.049 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.526 HD12 ' HB2' ' B' ' 12' ' ' ALA . 49.3 mt -59.18 -45.09 93.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.426 -0.796 . . . . 0.0 109.687 179.326 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 13' ' ' SER . 15.4 mt -65.09 -41.83 94.63 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.185 -0.947 . . . . 0.0 109.41 179.386 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.5 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -71.12 -7.27 45.44 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.527 -0.733 . . . . 0.0 110.123 179.826 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.486 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 1.5 t 68.38 64.3 0.34 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.24 -0.912 . . . . 0.0 110.199 -179.971 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 58.2 66.35 1.12 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.257 -0.902 . . . . 0.0 110.312 179.969 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.5 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 64.5 mttt -153.15 143.22 15.31 Favored Pre-proline 0 N--CA 1.49 1.537 0 O-C-N 121.248 -0.908 . . . . 0.0 110.023 179.992 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -75.28 2.17 7.06 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 O-C-N 123.983 1.517 . . . . 0.0 110.156 179.703 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.431 ' CZ ' ' HD3' ' A' ' 21' ' ' LYS . 23.7 p90 -141.66 160.65 39.72 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.202 -0.936 . . . . 0.0 110.075 179.951 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.855 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -130.31 140.79 47.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.228 -0.92 . . . . 0.0 109.937 179.916 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.855 ' N ' HD13 ' A' ' 24' ' ' ILE . 1.1 mt -81.85 148.32 28.89 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.223 -0.923 . . . . 0.0 110.45 -179.733 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.77 -44.84 95.14 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.373 -0.829 . . . . 0.0 109.953 179.818 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -56.52 -36.28 69.02 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.276 -0.89 . . . . 0.0 109.869 179.744 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.517 ' O ' ' N ' ' A' ' 32' ' ' GLU . 0.6 OUTLIER -62.73 -42.22 99.56 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.416 -0.803 . . . . 0.0 109.681 179.742 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.743 HD13 ' HB3' ' A' ' 41' ' ' CYS . 17.5 mt -58.32 -34.2 70.33 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.272 -0.892 . . . . 0.0 109.532 179.634 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 9.6 mtm-85 -66.92 -38.68 86.65 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.343 -0.848 . . . . 0.0 109.828 179.597 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.76 -12.16 24.06 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.297 -0.877 . . . . 0.0 110.665 -179.754 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.517 ' N ' ' O ' ' A' ' 28' ' ' GLU . 11.3 mm-40 -96.76 -23.55 16.36 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.095 -1.003 . . . . 0.0 110.451 -179.819 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.598 ' CD2' HG22 ' B' ' 17' ' ' VAL . 1.4 mt -136.75 157.03 75.72 Favored Pre-proline 0 C--N 1.306 -1.317 0 O-C-N 121.166 -0.959 . . . . 0.0 110.102 -179.769 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.548 ' HD2' HD23 ' A' ' 33' ' ' LEU . 32.7 Cg_exo -46.25 171.21 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.735 0 O-C-N 123.861 1.453 . . . . 0.0 110.075 179.777 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_endo -64.77 -41.92 16.96 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 O-C-N 123.921 1.485 . . . . 0.0 110.305 -179.89 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.95 -40.89 91.73 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.34 -0.85 . . . . 0.0 110.548 -179.795 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.51 ' HG2' HG22 ' B' ' 17' ' ' VAL . 12.9 mp0 -69.33 -37.94 77.95 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.142 -0.974 . . . . 0.0 110.394 -179.739 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.79 -45.96 90.69 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.264 -0.898 . . . . 0.0 110.33 -179.94 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.463 ' O ' ' HB2' ' A' ' 43' ' ' LYS . 14.1 tt0 -66.1 -43.76 86.32 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.142 -0.974 . . . . 0.0 110.51 -179.873 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.8 -42.2 95.2 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.26 -0.9 . . . . 0.0 110.401 -179.766 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.743 ' HB3' HD13 ' A' ' 29' ' ' LEU . 31.1 m -63.09 -46.89 85.28 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.298 -0.876 . . . . 0.0 110.578 -179.666 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.644 ' CG1' HD12 ' A' ' 29' ' ' LEU . 74.5 mt -72.98 -13.72 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.126 -0.984 . . . . 0.0 110.519 -179.644 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 39' ' ' GLN . 0.1 OUTLIER -76.29 -21.19 56.56 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.163 -0.961 . . . . 0.0 110.461 -179.707 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.606 ' HB3' ' CG ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -113.0 -48.99 2.95 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.123 -0.986 . . . . 0.0 110.344 -180.0 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.523 ' HE1' ' CB ' ' A' ' 60' ' ' TYR . 2.0 ttm -34.62 96.77 0.11 Allowed Pre-proline 0 N--CA 1.494 1.764 0 O-C-N 121.695 -0.628 . . . . 0.0 111.071 -179.975 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.471 ' HD2' ' O ' ' A' ' 59' ' ' ASP . 27.1 Cg_exo . . . . . 0 C--N 1.305 -1.716 0 O-C-N 123.995 1.524 . . . . 0.0 110.026 179.765 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.649 ' C ' HD22 ' A' ' 58' ' ' LEU . . . . . . . . 0 N--CA 1.491 1.621 0 CA-C-O 121.34 0.59 . . . . 0.0 110.217 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.813 HD22 ' N ' ' A' ' 58' ' ' LEU . 2.3 mm? -116.2 160.19 20.75 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.305 -0.872 . . . . 0.0 109.936 179.996 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.486 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.6 OUTLIER -106.8 110.41 22.58 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.041 -1.037 . . . . 0.0 110.445 -179.98 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.624 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 17.2 p90 -75.91 -26.31 56.86 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.259 -0.9 . . . . 0.0 109.966 179.601 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.624 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.15 -39.59 72.54 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.327 -0.858 . . . . 0.0 110.023 -179.806 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.463 ' CB ' ' HG2' ' A' ' 46' ' ' PRO . . . -65.56 -39.55 91.81 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.177 -0.952 . . . . 0.0 109.831 179.667 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.606 ' CG ' ' HB3' ' A' ' 44' ' ' ARG . 2.0 t80 -71.9 -35.05 69.59 Favored 'General case' 0 C--N 1.298 -1.647 0 O-C-N 121.572 -0.705 . . . . 0.0 110.137 179.68 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.579 ' O ' ' CD2' ' A' ' 68' ' ' TYR . 17.4 m -56.19 -49.9 72.73 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.343 -0.848 . . . . 0.0 110.554 -179.692 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.5 p -55.65 -44.42 77.16 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.211 -0.931 . . . . 0.0 110.461 -179.754 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.16 -39.08 74.54 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.149 -0.97 . . . . 0.0 110.481 -179.802 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.513 ' CD2' ' HB2' ' B' ' 23' ' ' ALA . 18.3 mt -60.25 -38.52 83.72 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.188 -0.945 . . . . 0.0 110.292 -179.894 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.868 ' OH ' HG21 ' A' ' 10' ' ' VAL . 10.3 m-85 . . . . . 0 N--CA 1.489 1.52 0 O-C-N 121.315 -0.866 . . . . 0.0 110.215 -179.641 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 11.4 ptpt . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 121.321 0.581 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 15.8 ttmt -58.55 -41.87 86.6 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.221 -0.925 . . . . 0.0 110.161 -179.969 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.16 -35.74 77.94 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.235 -0.916 . . . . 0.0 110.011 179.927 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.86 -42.62 94.72 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.343 -0.848 . . . . 0.0 110.128 179.998 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 12' ' ' ALA . . . . . 0.526 ' HB2' HD12 ' A' ' 16' ' ' ILE . . . -63.17 -35.78 81.44 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.141 -0.974 . . . . 0.0 110.018 179.83 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.633 ' O ' HG23 ' B' ' 17' ' ' VAL . 72.8 t -61.61 -42.34 93.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.28 -0.887 . . . . 0.0 110.075 179.892 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.51 -44.26 93.16 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.309 -0.87 . . . . 0.0 110.234 179.955 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 37.0 m -64.57 -49.12 72.43 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.301 -0.875 . . . . 0.0 110.33 -180.0 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.571 HG11 HD11 ' A' ' 33' ' ' LEU . 86.2 t -60.99 -43.98 97.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.183 -0.948 . . . . 0.0 110.298 -179.966 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.633 HG23 ' O ' ' B' ' 13' ' ' VAL . 90.2 t -63.18 -47.17 93.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.327 -0.858 . . . . 0.0 110.2 -179.886 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.54 -43.25 75.65 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.25 -0.906 . . . . 0.0 110.165 -179.975 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.5 -44.09 83.53 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.309 -0.869 . . . . 0.0 110.161 179.989 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.41 HG23 ' O ' ' B' ' 16' ' ' VAL . 75.1 t -66.07 -44.96 91.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.226 -0.921 . . . . 0.0 110.192 179.956 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -57.16 -34.81 68.81 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.276 -0.89 . . . . 0.0 110.24 -179.96 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.9 tm0? -61.18 -49.83 75.62 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.2 -0.938 . . . . 0.0 110.162 -179.914 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 23' ' ' ALA . . . . . 0.513 ' HB2' ' CD2' ' A' ' 67' ' ' LEU . . . -60.81 -35.4 76.4 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.291 -0.881 . . . . 0.0 110.353 -179.922 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 21.5 ttp85 . . . . . 0 N--CA 1.493 1.684 0 O-C-N 121.15 -0.968 . . . . 0.0 110.487 179.979 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.928 HG22 ' CE2' ' A' ' 68' ' ' TYR . 3.3 m . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 121.191 0.52 . . . . 0.0 110.196 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -66.94 -45.53 77.53 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.22 -0.925 . . . . 0.0 109.823 179.774 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.524 ' HA ' HD12 ' A' ' 11' ' ' ILE . 1.9 tt0 -57.02 -36.65 70.69 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.32 -0.863 . . . . 0.0 109.883 179.694 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -61.38 -47.37 86.15 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.333 -0.854 . . . . 0.0 110.185 -179.853 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 41.6 t -58.26 -41.3 80.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.164 -0.96 . . . . 0.0 109.871 179.755 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.676 HG23 ' HE1' ' A' ' 60' ' ' TYR . 29.8 mt -63.33 -47.92 89.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.354 -0.841 . . . . 0.0 109.487 179.547 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.43 -39.01 75.32 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.334 -0.853 . . . . 0.0 108.722 179.018 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.57 ' HB3' HG23 ' B' ' 16' ' ' VAL . 10.6 m -66.91 -40.34 87.65 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 178.71 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.571 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 6.6 m-85 -68.28 -41.23 81.33 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.464 -0.772 . . . . 0.0 109.525 179.219 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -53.1 -44.26 67.49 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.348 -0.845 . . . . 0.0 109.456 179.363 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.608 HD13 ' HB2' ' B' ' 12' ' ' ALA . 48.3 mt -59.74 -43.6 91.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.479 -0.763 . . . . 0.0 109.882 179.467 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 13' ' ' SER . 48.3 mt -65.12 -41.75 94.57 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.289 -0.882 . . . . 0.0 109.949 179.792 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.601 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -83.75 13.97 4.32 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.456 -0.778 . . . . 0.0 110.337 -179.879 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 57.73 70.58 0.64 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.245 -0.91 . . . . 0.0 110.465 179.932 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.8 t70 44.99 54.96 6.51 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.332 -0.855 . . . . 0.0 110.514 179.777 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.552 ' HD2' ' CZ ' ' A' ' 23' ' ' TYR . 7.1 mttm -133.55 141.83 41.71 Favored Pre-proline 0 N--CA 1.491 1.575 0 O-C-N 121.143 -0.973 . . . . 0.0 109.901 179.89 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -68.13 -4.4 12.55 Favored 'Trans proline' 0 C--N 1.305 -1.729 0 O-C-N 124.02 1.537 . . . . 0.0 110.388 179.973 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.552 ' CZ ' ' HD2' ' A' ' 21' ' ' LYS . 51.8 p90 -139.18 157.41 45.98 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.213 -0.93 . . . . 0.0 110.306 -179.913 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.794 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -132.91 138.25 52.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.286 -0.884 . . . . 0.0 109.467 179.581 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.794 ' N ' HD13 ' A' ' 24' ' ' ILE . 1.0 OUTLIER -82.15 139.48 34.32 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.13 -0.981 . . . . 0.0 110.369 -179.48 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.451 ' O ' HD11 ' A' ' 42' ' ' ILE . . . -54.99 -35.22 64.11 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.39 -0.819 . . . . 0.0 110.175 179.945 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 87.6 mt-10 -61.12 -38.56 86.77 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.224 -0.922 . . . . 0.0 109.991 179.9 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.554 ' HB3' HD11 ' A' ' 24' ' ' ILE . 8.4 mt-10 -65.87 -40.48 91.69 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.329 -0.857 . . . . 0.0 109.565 179.627 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.517 HD12 HG12 ' A' ' 42' ' ' ILE . 63.6 mt -59.24 -34.03 71.72 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.433 -0.792 . . . . 0.0 109.476 179.446 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 27.8 mtp180 -68.48 -34.56 76.14 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.388 -0.82 . . . . 0.0 110.047 179.754 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.22 -31.48 13.47 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.3 -0.875 . . . . 0.0 110.499 -179.665 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -83.48 -23.36 32.23 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.074 -1.017 . . . . 0.0 110.431 -179.773 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.914 HD23 ' HD2' ' A' ' 34' ' ' PRO . 1.5 mt -129.85 147.84 67.1 Favored Pre-proline 0 N--CA 1.488 1.461 0 O-C-N 121.082 -1.011 . . . . 0.0 110.329 -179.749 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.914 ' HD2' HD23 ' A' ' 33' ' ' LEU . 1.0 OUTLIER -46.45 167.11 0.07 OUTLIER 'Trans proline' 0 C--N 1.305 -1.76 0 O-C-N 124.021 1.537 . . . . 0.0 110.095 179.665 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -62.44 -36.02 68.57 Favored 'Trans proline' 0 C--N 1.304 -1.794 0 O-C-N 124.03 1.542 . . . . 0.0 110.484 -179.768 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.521 ' OD1' ' N ' ' A' ' 37' ' ' GLN . 1.7 p30 -65.61 -46.4 79.46 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.25 -0.906 . . . . 0.0 110.462 -179.78 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.908 ' NE2' HG13 ' B' ' 17' ' ' VAL . 0.3 OUTLIER -69.45 -40.17 77.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.121 -0.987 . . . . 0.0 110.153 -179.962 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.418 ' O ' HG13 ' A' ' 42' ' ' ILE . . . -58.64 -48.14 82.02 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.289 -0.882 . . . . 0.0 110.185 179.917 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 66.7 tp60 -62.91 -47.52 82.9 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.266 -0.896 . . . . 0.0 110.14 179.888 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -66.21 -46.56 76.84 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.339 -0.851 . . . . 0.0 110.045 179.962 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 89.6 m -64.92 -45.97 83.61 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.356 -0.84 . . . . 0.0 110.332 -179.998 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.517 HG12 HD12 ' A' ' 29' ' ' LEU . 66.2 mt -68.73 -12.46 15.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.245 -0.909 . . . . 0.0 110.424 -179.853 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 19.7 tttm -83.12 -40.23 20.05 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.209 -0.932 . . . . 0.0 110.487 -179.783 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.511 ' O ' ' C ' ' A' ' 45' ' ' MET . 3.2 mtp85 -85.27 -61.61 1.73 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.204 -0.935 . . . . 0.0 110.55 -179.656 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.689 ' HE1' ' HB3' ' A' ' 60' ' ' TYR . 5.8 ttm -28.0 103.32 0.16 Allowed Pre-proline 0 N--CA 1.497 1.919 0 O-C-N 121.84 -0.537 . . . . 0.0 111.598 -179.886 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.545 ' O ' HD12 ' A' ' 58' ' ' LEU . 11.4 Cg_endo . . . . . 0 C--N 1.305 -1.713 0 O-C-N 124.058 1.557 . . . . 0.0 110.028 179.691 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.473 ' C ' HD22 ' A' ' 58' ' ' LEU . . . . . . . . 0 N--CA 1.494 1.749 0 CA-C-O 121.284 0.564 . . . . 0.0 110.032 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.851 HD22 ' N ' ' A' ' 58' ' ' LEU . 1.6 mm? -110.41 154.51 23.47 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.25 -0.906 . . . . 0.0 110.129 -179.846 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.491 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.4 OUTLIER -106.27 110.64 22.94 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.166 -0.959 . . . . 0.0 110.354 179.837 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.689 ' HB3' ' HE1' ' A' ' 45' ' ' MET . 17.4 p90 -72.56 -18.02 61.66 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.242 -0.911 . . . . 0.0 109.164 179.223 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.434 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.79 -35.47 66.33 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.451 -0.781 . . . . 0.0 109.104 179.571 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.493 ' HB3' ' CD ' ' A' ' 46' ' ' PRO . . . -60.15 -32.68 71.26 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.368 -0.832 . . . . 0.0 109.174 179.185 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.671 ' HE2' HG22 ' B' ' 20' ' ' VAL . 2.6 t80 -63.14 -48.79 76.96 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.785 -0.572 . . . . 0.0 110.203 179.756 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.453 ' O ' ' HB2' ' A' ' 68' ' ' TYR . 41.3 p -63.92 -45.74 87.91 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.216 -0.928 . . . . 0.0 110.401 -179.862 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 54.0 m -67.06 -39.25 86.86 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.236 -0.915 . . . . 0.0 110.285 -179.897 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.19 -43.86 69.89 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.231 -0.918 . . . . 0.0 110.35 -179.851 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.896 ' CD2' ' HB2' ' B' ' 23' ' ' ALA . 22.5 mt -73.6 -44.6 56.73 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.175 -0.953 . . . . 0.0 110.357 -179.868 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.928 ' CE2' HG22 ' A' ' 6' ' ' THR . 11.7 m-85 . . . . . 0 N--CA 1.491 1.583 0 O-C-N 121.222 -0.924 . . . . 0.0 110.286 -179.935 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 14.3 ptmt . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.164 0.507 . . . . 0.0 110.226 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.486 ' HA ' HG21 ' A' ' 16' ' ' ILE . 7.3 ttpt -65.2 -45.74 83.55 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.174 -0.954 . . . . 0.0 110.228 -179.879 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.45 -41.94 73.57 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.284 -0.885 . . . . 0.0 110.099 179.859 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -61.07 -41.28 96.34 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.231 -0.918 . . . . 0.0 110.115 179.872 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 12' ' ' ALA . . . . . 0.608 ' HB2' HD13 ' A' ' 16' ' ' ILE . . . -62.97 -36.43 83.45 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.309 -0.869 . . . . 0.0 110.142 179.94 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.646 ' O ' HG23 ' B' ' 17' ' ' VAL . 55.0 t -65.96 -45.12 91.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.255 -0.903 . . . . 0.0 110.163 179.758 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.04 -39.69 79.06 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.262 -0.899 . . . . 0.0 110.207 179.973 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 15.9 m -70.04 -40.79 74.95 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.317 -0.864 . . . . 0.0 110.21 179.916 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.57 HG23 ' HB3' ' A' ' 13' ' ' SER . 92.4 t -67.08 -45.47 86.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.265 -0.897 . . . . 0.0 110.247 179.986 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.908 HG13 ' NE2' ' A' ' 37' ' ' GLN . 55.0 t -62.77 -44.33 99.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.199 -0.938 . . . . 0.0 110.098 179.935 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.06 -39.19 77.85 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.311 -0.868 . . . . 0.0 110.236 -179.988 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.25 -40.77 86.29 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.194 -0.941 . . . . 0.0 110.221 -179.905 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.671 HG22 ' HE2' ' A' ' 63' ' ' PHE . 91.0 t -66.05 -41.04 88.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.293 -0.879 . . . . 0.0 110.355 -179.982 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 48.6 t0 -61.6 -31.86 71.95 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.245 -0.909 . . . . 0.0 110.247 -179.883 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -39.43 94.19 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.249 -0.907 . . . . 0.0 110.175 -179.9 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 23' ' ' ALA . . . . . 0.896 ' HB2' ' CD2' ' A' ' 67' ' ' LEU . . . -65.91 -38.35 88.48 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.188 -0.945 . . . . 0.0 110.334 -179.851 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.675 0 O-C-N 121.174 -0.954 . . . . 0.0 110.398 -179.867 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.213 0.53 . . . . 0.0 110.27 . . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.437 ' O ' HG13 ' A' ' 11' ' ' ILE . . . -62.01 -45.26 94.36 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.224 -0.923 . . . . 0.0 109.453 179.754 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -56.06 -36.59 68.23 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.437 -0.789 . . . . 0.0 109.682 179.333 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -61.96 -48.41 80.53 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.354 -0.841 . . . . 0.0 110.04 179.866 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 44.0 t -59.44 -46.42 92.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.339 -0.851 . . . . 0.0 109.673 179.695 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.773 HG23 ' HE1' ' A' ' 60' ' ' TYR . 44.7 mt -57.49 -48.49 82.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.293 -0.879 . . . . 0.0 109.431 179.536 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.76 -43.36 85.4 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.223 -0.923 . . . . 0.0 108.811 178.979 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.586 ' O ' ' HB1' ' B' ' 12' ' ' ALA . 6.7 p -63.07 -39.19 93.98 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 178.6 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -68.57 -41.21 80.02 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.512 -0.742 . . . . 0.0 109.576 179.112 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.638 ' NH2' ' CE2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -54.47 -42.61 70.88 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.276 -0.89 . . . . 0.0 109.62 179.486 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.86 HD12 ' HB2' ' B' ' 12' ' ' ALA . 38.0 mt -57.64 -45.05 86.5 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 O-C-N 121.155 -0.965 . . . . 0.0 108.72 179.032 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.464 HD13 ' HA ' ' A' ' 17' ' ' LEU . 4.1 mm? -65.97 -41.7 90.82 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.449 -0.782 . . . . 0.0 109.717 178.905 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.461 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -72.15 -11.96 60.97 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.475 -0.766 . . . . 0.0 110.091 -179.958 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.461 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 1.7 t 66.32 64.59 0.51 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.339 -0.851 . . . . 0.0 110.249 -179.987 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 51.45 62.36 2.75 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.213 -0.93 . . . . 0.0 110.377 179.902 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.525 ' O ' ' NE ' ' A' ' 15' ' ' ARG . 14.9 mttt -141.76 140.77 20.58 Favored Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.316 -0.865 . . . . 0.0 109.881 179.847 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.584 ' O ' ' CD1' ' A' ' 23' ' ' TYR . 18.5 Cg_endo -62.24 -10.65 19.09 Favored 'Trans proline' 0 C--N 1.303 -1.835 0 O-C-N 123.926 1.488 . . . . 0.0 110.178 179.938 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.584 ' CD1' ' O ' ' A' ' 22' ' ' PRO . 32.0 m-85 -143.06 -173.5 3.93 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.265 -0.897 . . . . 0.0 110.255 -179.974 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.7 tt -143.66 139.37 25.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.376 -0.828 . . . . 0.0 109.993 179.863 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.8 mt -80.17 143.35 33.91 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.276 -0.89 . . . . 0.0 109.95 -179.932 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.657 ' HB2' HD11 ' A' ' 58' ' ' LEU . . . -62.52 -36.49 82.75 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.38 -0.825 . . . . 0.0 110.606 -179.534 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -65.48 -36.44 83.88 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.134 -0.979 . . . . 0.0 110.128 -179.892 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.471 ' O ' ' CG ' ' A' ' 32' ' ' GLU . 28.8 mt-10 -69.1 -51.11 41.97 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.12 -0.988 . . . . 0.0 110.131 -179.876 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.738 HD12 ' C ' ' A' ' 29' ' ' LEU . 2.4 pp -67.62 -33.21 74.53 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.254 -0.904 . . . . 0.0 109.779 179.387 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 1.083 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 10.8 tpt180 -64.71 -34.84 79.26 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.261 -0.9 . . . . 0.0 110.526 -179.846 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.4 ttp85 -93.98 -9.05 38.21 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.218 -0.926 . . . . 0.0 110.63 -179.576 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.471 ' CG ' ' O ' ' A' ' 28' ' ' GLU . 8.0 mm-40 -100.13 -23.44 14.85 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.11 -0.994 . . . . 0.0 111.171 -179.313 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.638 HD22 ' HB3' ' A' ' 37' ' ' GLN . 0.3 OUTLIER -110.87 150.43 41.82 Favored Pre-proline 0 N--CA 1.489 1.486 0 O-C-N 120.907 -1.121 . . . . 0.0 110.3 -179.753 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.433 ' HG2' ' HB2' ' A' ' 37' ' ' GLN . 6.3 Cg_exo -47.36 144.44 9.73 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 O-C-N 124.031 1.542 . . . . 0.0 109.879 179.783 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.432 ' C ' ' O ' ' A' ' 34' ' ' PRO . 35.3 Cg_endo -38.1 -47.79 2.25 Favored 'Trans proline' 0 C--N 1.304 -1.78 0 O-C-N 124.192 1.628 . . . . 0.0 110.569 -179.72 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.409 ' OD1' ' HG2' ' A' ' 35' ' ' PRO . 2.4 m-20 -66.31 -47.02 74.9 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.24 -0.912 . . . . 0.0 111.185 -179.563 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.638 ' HB3' HD22 ' A' ' 33' ' ' LEU . 0.9 OUTLIER -69.82 -44.43 70.0 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.062 -1.024 . . . . 0.0 110.575 -179.42 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 1.083 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -59.16 -44.46 92.11 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.28 -0.888 . . . . 0.0 110.624 -179.534 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -66.09 -43.43 87.31 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.099 -1.001 . . . . 0.0 110.712 -179.643 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -61.31 -43.74 98.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.161 -0.962 . . . . 0.0 110.5 -179.805 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.457 ' O ' ' SD ' ' A' ' 45' ' ' MET . 79.1 m -58.09 -42.41 85.54 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.165 -0.959 . . . . 0.0 110.477 -179.771 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.644 HG13 HD11 ' A' ' 29' ' ' LEU . 36.4 mt -65.49 -21.82 29.88 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.14 -0.975 . . . . 0.0 110.362 -179.854 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.66 -34.5 23.02 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.18 -0.95 . . . . 0.0 110.817 -179.569 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.52 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 2.0 mmp_? -74.72 -69.45 0.46 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.107 -0.996 . . . . 0.0 110.589 -179.521 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.763 ' HE2' ' HB3' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -36.28 118.14 0.69 Allowed Pre-proline 0 N--CA 1.488 1.467 0 O-C-N 121.53 -0.731 . . . . 0.0 111.412 -179.756 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.689 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 9.3 Cg_endo . . . . . 0 C--N 1.304 -1.771 0 O-C-N 124.197 1.63 . . . . 0.0 109.342 179.117 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.358 0.599 . . . . 0.0 110.479 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.657 HD11 ' HB2' ' A' ' 26' ' ' ALA . 62.3 mt -124.88 159.75 30.41 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.298 -0.876 . . . . 0.0 109.613 179.499 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.454 ' C ' ' HG2' ' A' ' 45' ' ' MET . 3.7 m-20 -106.18 110.76 23.11 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.005 -1.06 . . . . 0.0 111.234 -179.52 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.773 ' HE1' HG23 ' A' ' 11' ' ' ILE . 39.7 p90 -81.49 -29.77 33.55 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.425 -0.797 . . . . 0.0 110.08 179.307 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.528 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.5 -36.65 66.92 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.283 -0.886 . . . . 0.0 109.522 -179.943 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.689 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -68.16 -35.81 78.65 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.344 -0.848 . . . . 0.0 109.862 179.539 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.52 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 2.6 t80 -72.05 -31.44 66.14 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.576 -0.703 . . . . 0.0 110.303 179.66 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 20.1 m -71.43 -48.5 49.2 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.285 -0.884 . . . . 0.0 110.409 -179.704 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.43 -43.28 97.89 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.199 -0.938 . . . . 0.0 110.37 -179.779 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -61.83 -40.78 96.48 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.196 -0.94 . . . . 0.0 110.404 -179.789 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.86 -40.03 75.39 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.152 -0.968 . . . . 0.0 110.346 -179.804 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 . . . . . 0 N--CA 1.491 1.616 0 O-C-N 121.127 -0.983 . . . . 0.0 110.263 -179.995 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 2.1 tptp . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.199 0.523 . . . . 0.0 110.264 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.448 ' CE ' ' OE1' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -59.96 -51.14 70.96 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.217 -0.927 . . . . 0.0 110.153 179.942 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.8 -35.54 68.85 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.216 -0.927 . . . . 0.0 110.059 179.935 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -62.84 -42.55 99.78 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.216 -0.928 . . . . 0.0 110.207 179.932 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 12' ' ' ALA . . . . . 0.86 ' HB2' HD12 ' A' ' 16' ' ' ILE . . . -67.04 -40.96 87.28 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.294 -0.879 . . . . 0.0 110.073 179.916 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.518 ' O ' HG23 ' B' ' 17' ' ' VAL . 75.1 t -61.24 -44.62 98.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.204 -0.935 . . . . 0.0 109.952 179.895 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.52 -44.33 89.5 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.19 -0.943 . . . . 0.0 110.053 179.809 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 54.3 m -63.55 -43.25 97.63 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.241 -0.912 . . . . 0.0 110.085 179.858 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.424 HG23 ' O ' ' B' ' 12' ' ' ALA . 76.7 t -64.22 -41.99 94.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.298 -0.876 . . . . 0.0 110.054 179.864 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.518 HG23 ' O ' ' B' ' 13' ' ' VAL . 77.6 t -61.04 -44.33 98.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.272 -0.892 . . . . 0.0 110.071 179.84 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.8 -45.97 92.33 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.162 -0.961 . . . . 0.0 110.034 179.939 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.32 -45.44 87.91 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.201 -0.937 . . . . 0.0 110.087 179.826 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 66.5 t -68.04 -40.52 83.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.231 -0.918 . . . . 0.0 110.191 179.937 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -61.87 -31.5 71.78 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.345 -0.847 . . . . 0.0 110.133 179.934 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -55.82 -50.93 69.19 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.26 -0.9 . . . . 0.0 110.078 -179.995 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.87 -39.66 90.01 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.199 -0.938 . . . . 0.0 110.091 179.785 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 10.6 ttp180 . . . . . 0 N--CA 1.492 1.646 0 O-C-N 121.406 -0.809 . . . . 0.0 110.128 179.857 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 27.8 m . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.347 0.594 . . . . 0.0 109.989 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.8 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -66.52 -45.78 78.39 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.282 -0.886 . . . . 0.0 109.793 179.644 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -54.69 -36.48 64.7 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.358 -0.838 . . . . 0.0 109.758 179.552 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -61.56 -40.08 93.44 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.34 -0.85 . . . . 0.0 110.047 179.995 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 88.3 t -58.2 -52.35 59.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.178 -0.951 . . . . 0.0 109.935 179.698 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 59.0 mt -55.47 -49.49 72.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.254 -0.904 . . . . 0.0 109.49 179.612 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.83 -40.38 79.91 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.315 -0.866 . . . . 0.0 108.876 179.119 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.401 ' O ' HD23 ' A' ' 17' ' ' LEU . 2.0 p -66.8 -37.78 85.2 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.418 -0.801 . . . . 0.0 109.122 178.941 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.495 ' CE1' ' HE1' ' A' ' 45' ' ' MET . 3.3 m-85 -68.27 -43.66 77.28 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.317 -0.864 . . . . 0.0 109.706 179.363 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.401 ' HD3' ' OH ' ' A' ' 60' ' ' TYR . 0.7 OUTLIER -53.35 -47.99 68.92 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.327 -0.858 . . . . 0.0 109.389 179.515 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.613 HG21 ' HA ' ' B' ' 9' ' ' LYS . 71.3 mt -59.09 -42.36 86.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.403 -0.811 . . . . 0.0 109.607 179.281 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.631 HD12 ' HB3' ' A' ' 32' ' ' GLU . 2.6 mm? -64.79 -39.13 93.09 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.414 -0.804 . . . . 0.0 109.982 179.727 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.746 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -82.95 10.58 7.59 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.319 -0.863 . . . . 0.0 110.249 -179.974 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 61.46 56.35 2.61 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.311 -0.868 . . . . 0.0 110.239 -179.948 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.6 t0 56.85 59.31 3.56 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.225 -0.922 . . . . 0.0 110.225 179.925 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' A' ' 18' ' ' ALA . 18.8 mttm -140.62 144.34 35.96 Favored Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.25 -0.906 . . . . 0.0 110.173 -179.975 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 21' ' ' LYS . 26.6 Cg_exo -75.03 1.06 8.17 Favored 'Trans proline' 0 C--N 1.304 -1.792 0 O-C-N 124.091 1.574 . . . . 0.0 109.998 179.562 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.455 ' CD1' ' O ' ' A' ' 23' ' ' TYR . 8.4 p90 -141.69 150.42 41.85 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.219 -0.925 . . . . 0.0 110.179 179.963 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.746 HG12 ' HB2' ' A' ' 18' ' ' ALA . 0.4 OUTLIER -121.38 144.09 31.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.188 -0.945 . . . . 0.0 110.002 -179.973 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.581 ' H ' HD13 ' A' ' 24' ' ' ILE . 4.4 mm? -85.73 145.24 27.35 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.22 -0.925 . . . . 0.0 110.302 -179.894 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.63 -45.43 94.11 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.279 -0.888 . . . . 0.0 110.181 179.894 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -61.42 -35.72 78.35 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.22 -0.925 . . . . 0.0 109.85 179.889 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -62.4 -47.2 85.17 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.264 -0.897 . . . . 0.0 109.075 179.329 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.584 HD11 HG21 ' A' ' 24' ' ' ILE . 41.8 mt -58.75 -33.46 70.29 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.424 -0.798 . . . . 0.0 109.229 178.971 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.495 ' HA ' ' CB ' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -65.73 -34.68 78.76 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.359 -0.838 . . . . 0.0 110.236 179.999 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -96.68 -31.93 12.44 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.086 -1.009 . . . . 0.0 110.832 -179.745 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.631 ' HB3' HD12 ' A' ' 17' ' ' LEU . 0.4 OUTLIER -76.02 -23.33 55.18 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.058 -1.026 . . . . 0.0 110.587 -179.726 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.683 HD23 ' HD2' ' A' ' 34' ' ' PRO . 0.2 OUTLIER -133.05 158.44 75.81 Favored Pre-proline 0 C--N 1.305 -1.334 0 O-C-N 121.096 -1.003 . . . . 0.0 110.403 -179.627 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.683 ' HD2' HD23 ' A' ' 33' ' ' LEU . 6.3 Cg_exo -50.58 134.02 39.12 Favored 'Trans proline' 0 C--N 1.305 -1.739 0 O-C-N 124.053 1.554 . . . . 0.0 110.056 179.769 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.42 ' C ' ' O ' ' A' ' 34' ' ' PRO . 33.9 Cg_endo -39.24 -35.23 0.66 Allowed 'Trans proline' 0 C--N 1.306 -1.701 0 O-C-N 124.133 1.596 . . . . 0.0 110.723 -179.636 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -65.31 -44.67 87.12 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.164 -0.96 . . . . 0.0 110.585 -179.73 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.517 ' CG ' ' HG2' ' A' ' 34' ' ' PRO . 28.6 mm100 -69.33 -38.11 78.03 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.157 -0.965 . . . . 0.0 110.549 -179.66 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.495 ' CB ' ' HA ' ' A' ' 30' ' ' ARG . . . -56.38 -42.55 78.06 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.212 -0.93 . . . . 0.0 110.549 -179.902 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 40.0 tt0 -64.27 -45.01 89.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.116 -0.99 . . . . 0.0 110.383 -179.759 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.09 -48.33 71.32 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.141 -0.974 . . . . 0.0 110.401 -179.86 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.456 ' O ' ' HG3' ' A' ' 45' ' ' MET . 54.8 m -65.75 -43.59 88.5 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.328 -0.857 . . . . 0.0 110.518 -179.846 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.454 ' CG1' ' O ' ' A' ' 38' ' ' ALA . 61.1 mt -60.26 -22.9 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.236 -0.915 . . . . 0.0 110.782 -179.56 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.96 -31.21 23.7 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.119 -0.988 . . . . 0.0 110.834 -179.509 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.561 ' HG3' ' CE1' ' A' ' 63' ' ' PHE . 0.2 OUTLIER -76.3 -65.15 0.96 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.224 -0.922 . . . . 0.0 110.589 -179.704 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.601 ' CE ' ' CB ' ' A' ' 60' ' ' TYR . 12.0 mtt -39.44 111.12 0.66 Allowed Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.379 -0.825 . . . . 0.0 110.863 -179.737 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.485 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 6.7 Cg_endo . . . . . 0 C--N 1.304 -1.775 0 O-C-N 124.018 1.536 . . . . 0.0 109.865 179.497 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.296 0.57 . . . . 0.0 110.151 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.535 ' HB3' ' CB ' ' A' ' 45' ' ' MET . 80.3 mt -104.11 155.72 18.47 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.211 -0.931 . . . . 0.0 110.266 179.974 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -98.97 111.14 23.62 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.249 -0.907 . . . . 0.0 110.546 -179.852 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.601 ' CB ' ' CE ' ' A' ' 45' ' ' MET . 31.7 p90 -76.22 -28.79 57.33 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.276 -0.89 . . . . 0.0 110.268 179.708 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.571 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.06 -41.41 75.02 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.233 -0.917 . . . . 0.0 110.135 -179.67 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.485 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -65.61 -35.56 81.17 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.238 -0.913 . . . . 0.0 109.791 179.823 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.566 ' O ' ' CD1' ' A' ' 63' ' ' PHE . 1.5 t80 -72.28 -36.34 68.95 Favored 'General case' 0 C--N 1.298 -1.659 0 O-C-N 121.607 -0.683 . . . . 0.0 110.242 179.807 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.567 ' O ' ' CE2' ' A' ' 68' ' ' TYR . 2.7 p -63.67 -49.85 71.59 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.211 -0.93 . . . . 0.0 110.455 -179.683 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.613 ' HA ' ' CD2' ' A' ' 68' ' ' TYR . 43.3 m -60.11 -47.56 85.39 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.168 -0.957 . . . . 0.0 110.264 -179.869 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -55.98 -36.68 68.15 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.189 -0.944 . . . . 0.0 110.204 -179.971 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.882 HD21 ' O ' ' B' ' 19' ' ' ALA . 0.2 OUTLIER -54.73 -32.54 59.84 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.288 -0.882 . . . . 0.0 110.232 -179.952 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.8 ' CE2' ' HB1' ' A' ' 7' ' ' ALA . 1.5 m-85 . . . . . 0 N--CA 1.491 1.605 0 O-C-N 121.238 -0.914 . . . . 0.0 110.205 -179.692 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 1.8 pttt . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.234 0.54 . . . . 0.0 110.185 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.613 ' HA ' HG21 ' A' ' 16' ' ' ILE . 0.4 OUTLIER -63.26 -48.88 76.3 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.249 -0.907 . . . . 0.0 110.172 -179.99 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.34 -39.42 69.99 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.198 -0.939 . . . . 0.0 110.009 179.91 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -63.45 -39.78 95.39 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.314 -0.867 . . . . 0.0 110.14 179.836 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.28 -42.39 99.3 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.181 -0.949 . . . . 0.0 109.95 -179.985 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.456 HG13 ' HG ' ' A' ' 33' ' ' LEU . 98.4 t -59.6 -40.4 82.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.164 -0.96 . . . . 0.0 109.712 179.5 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.41 -36.84 76.61 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.279 -0.888 . . . . 0.0 109.898 179.746 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 25.0 m -67.62 -42.77 81.85 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.275 -0.89 . . . . 0.0 110.14 179.914 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.807 ' O ' HG23 ' B' ' 20' ' ' VAL . 94.0 t -64.52 -40.42 88.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.299 -0.876 . . . . 0.0 110.28 179.968 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 67.8 t -63.07 -50.19 80.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.295 -0.878 . . . . 0.0 110.51 -179.684 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.33 -39.89 94.81 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.2 -0.938 . . . . 0.0 110.716 -179.598 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.882 ' O ' HD21 ' A' ' 67' ' ' LEU . . . -67.28 -41.57 85.26 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.187 -0.946 . . . . 0.0 110.613 -179.509 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.807 HG23 ' O ' ' B' ' 16' ' ' VAL . 63.7 t -67.45 -39.0 81.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.23 -0.919 . . . . 0.0 110.681 -179.526 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.02 -33.01 75.03 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.234 -0.916 . . . . 0.0 110.495 -179.744 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -56.3 -45.52 80.2 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.261 -0.899 . . . . 0.0 110.459 -179.702 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.87 -38.4 88.7 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.196 -0.94 . . . . 0.0 110.422 -179.768 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 8.4 ttt-85 . . . . . 0 N--CA 1.492 1.669 0 O-C-N 121.193 -0.942 . . . . 0.0 110.21 -179.867 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.29 0.567 . . . . 0.0 110.128 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -66.59 -44.51 81.98 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.279 -0.888 . . . . 0.0 109.703 179.627 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -55.74 -36.92 67.8 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.314 -0.866 . . . . 0.0 109.702 179.618 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.406 ' O ' ' OG ' ' A' ' 13' ' ' SER . 2.9 tt0 -62.12 -48.33 80.64 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.261 -0.899 . . . . 0.0 110.08 179.957 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.51 HG12 ' HD2' ' A' ' 14' ' ' PHE . 73.1 t -59.86 -46.83 93.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.159 -0.963 . . . . 0.0 109.89 179.864 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.75 HG23 ' HE1' ' A' ' 60' ' ' TYR . 79.0 mt -56.92 -48.34 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.366 -0.834 . . . . 0.0 109.607 179.586 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.425 ' O ' HG13 ' A' ' 16' ' ' ILE . . . -57.49 -39.55 76.7 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.316 -0.865 . . . . 0.0 109.095 179.172 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.501 ' HA ' ' HB1' ' B' ' 12' ' ' ALA . 1.1 m -68.79 -39.06 80.33 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.481 -0.762 . . . . 0.0 109.124 178.955 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.536 ' CG ' ' HB2' ' A' ' 60' ' ' TYR . 4.9 m-85 -68.55 -45.24 72.68 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.43 -0.794 . . . . 0.0 109.793 179.425 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.3 ttt-85 -53.02 -41.09 64.36 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.299 -0.876 . . . . 0.0 109.495 179.496 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.621 HD12 ' HB2' ' B' ' 12' ' ' ALA . 42.0 mt -63.47 -43.79 98.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.272 -0.892 . . . . 0.0 109.985 179.723 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.471 HD22 ' HB3' ' A' ' 32' ' ' GLU . 75.8 mt -62.98 -41.71 99.63 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.109 -0.995 . . . . 0.0 109.691 179.561 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.709 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -75.77 1.14 15.6 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.342 -0.849 . . . . 0.0 110.132 179.757 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.463 ' O ' ' CB ' ' A' ' 20' ' ' ASP . 0.1 OUTLIER 66.69 55.16 0.79 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.177 -0.952 . . . . 0.0 110.099 -179.897 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.463 ' CB ' ' O ' ' A' ' 19' ' ' SER . 13.6 t0 65.82 65.02 0.54 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.241 -0.912 . . . . 0.0 110.14 -179.97 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.625 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 26.8 mttt -148.79 143.76 17.52 Favored Pre-proline 0 N--CA 1.49 1.537 0 O-C-N 121.255 -0.903 . . . . 0.0 110.145 -179.968 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.546 ' O ' ' CD1' ' A' ' 23' ' ' TYR . 11.3 Cg_endo -73.32 -0.73 9.6 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 O-C-N 124.083 1.57 . . . . 0.0 110.068 179.495 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.546 ' CD1' ' O ' ' A' ' 22' ' ' PRO . 25.9 m-85 -139.98 158.85 43.41 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.247 -0.908 . . . . 0.0 109.842 179.863 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.77 HD13 ' H ' ' A' ' 25' ' ' LEU . 0.4 OUTLIER -124.39 150.77 29.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.115 -0.991 . . . . 0.0 109.942 179.984 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.77 ' H ' HD13 ' A' ' 24' ' ' ILE . 15.6 mt -92.74 145.61 24.28 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.067 -1.021 . . . . 0.0 110.26 -179.842 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.45 -45.39 80.84 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.221 -0.924 . . . . 0.0 110.278 -179.862 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -61.14 -35.7 77.79 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.208 -0.932 . . . . 0.0 109.917 179.871 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.557 ' HB3' HD11 ' A' ' 24' ' ' ILE . 21.9 mm-40 -60.15 -45.2 93.86 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.344 -0.847 . . . . 0.0 109.796 179.795 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.406 HD13 ' CB ' ' A' ' 41' ' ' CYS . 26.2 mt -63.15 -34.27 77.26 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.359 -0.838 . . . . 0.0 109.827 179.68 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.537 ' HA ' ' HB2' ' A' ' 38' ' ' ALA . 24.3 mtt-85 -68.88 -38.26 79.58 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.356 -0.84 . . . . 0.0 110.219 -179.927 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.5 -26.24 18.04 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.291 -0.881 . . . . 0.0 110.831 -179.568 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.471 ' HB3' HD22 ' A' ' 17' ' ' LEU . 75.4 mm-40 -89.88 -23.74 21.56 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.098 -1.001 . . . . 0.0 110.658 -179.69 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.773 HD21 HG23 ' B' ' 17' ' ' VAL . 1.3 mt -128.73 155.85 78.53 Favored Pre-proline 0 N--CA 1.488 1.451 0 O-C-N 121.19 -0.944 . . . . 0.0 110.056 -179.797 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.769 ' HD2' HD23 ' A' ' 33' ' ' LEU . 47.9 Cg_exo -52.56 144.4 41.86 Favored 'Trans proline' 0 C--N 1.304 -1.793 0 O-C-N 124.009 1.531 . . . . 0.0 110.302 179.972 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -41.87 -45.13 6.92 Favored 'Trans proline' 0 C--N 1.305 -1.744 0 O-C-N 124.003 1.528 . . . . 0.0 110.589 -179.842 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -58.36 -43.66 88.49 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.196 -0.94 . . . . 0.0 110.434 -179.771 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.688 ' HG3' HG22 ' B' ' 17' ' ' VAL . 75.3 mm-40 -68.97 -40.75 78.65 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.213 -0.929 . . . . 0.0 110.16 -179.959 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.537 ' HB2' ' HA ' ' A' ' 30' ' ' ARG . . . -56.54 -47.13 80.08 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.299 -0.876 . . . . 0.0 110.39 -179.956 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.2 tp60 -65.85 -46.72 77.43 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.159 -0.963 . . . . 0.0 110.252 -179.858 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -64.04 -48.01 77.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.28 -0.887 . . . . 0.0 110.209 -179.96 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.413 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 77.5 m -65.13 -47.7 76.19 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.219 -0.926 . . . . 0.0 110.159 -179.946 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 54.5 mt -58.34 -23.49 22.34 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.255 -0.903 . . . . 0.0 110.234 179.935 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.48 -41.31 16.7 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.242 -0.912 . . . . 0.0 110.33 -179.809 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.63 ' CB ' ' CD2' ' A' ' 63' ' ' PHE . 1.0 OUTLIER -64.11 -73.93 0.11 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.109 -0.994 . . . . 0.0 109.975 -179.916 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.594 ' CG ' ' HA ' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -38.47 117.21 0.96 Allowed Pre-proline 0 N--CA 1.488 1.427 0 O-C-N 121.382 -0.824 . . . . 0.0 111.473 179.847 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.424 ' HD2' ' HA ' ' A' ' 45' ' ' MET . 7.7 Cg_endo . . . . . 0 C--N 1.302 -1.871 0 O-C-N 123.829 1.436 . . . . 0.0 108.51 178.33 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.348 0.594 . . . . 0.0 110.207 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.59 HD11 HG22 ' A' ' 24' ' ' ILE . 0.6 OUTLIER -114.89 160.87 19.0 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.318 -0.864 . . . . 0.0 110.131 179.874 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -99.47 115.86 30.27 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.306 -0.871 . . . . 0.0 111.45 -179.17 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.75 ' HE1' HG23 ' A' ' 11' ' ' ILE . 9.1 p90 -78.43 -21.66 48.87 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.429 -0.794 . . . . 0.0 110.145 179.114 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.564 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.85 -33.11 64.23 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.212 -0.93 . . . . 0.0 109.753 179.973 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.434 ' O ' ' CB ' ' A' ' 66' ' ' ALA . . . -65.2 -32.36 74.0 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.284 -0.885 . . . . 0.0 109.486 179.451 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.63 ' CD2' ' CB ' ' A' ' 44' ' ' ARG . 5.9 t80 -65.89 -41.94 90.92 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.742 -0.599 . . . . 0.0 110.223 179.884 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 70.1 p -68.52 -49.58 58.54 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.269 -0.895 . . . . 0.0 110.37 -179.854 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.9 m -68.51 -35.5 77.58 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.273 -0.892 . . . . 0.0 110.381 -179.881 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.434 ' CB ' ' O ' ' A' ' 62' ' ' ALA . . . -67.08 -44.01 81.14 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.241 -0.912 . . . . 0.0 110.386 -179.838 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.549 ' CD1' ' HB2' ' B' ' 23' ' ' ALA . 3.6 mm? -68.39 -41.93 79.81 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.179 -0.951 . . . . 0.0 110.633 -179.745 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 . . . . . 0 N--CA 1.491 1.588 0 O-C-N 121.068 -1.02 . . . . 0.0 110.56 -179.759 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 4.0 tptp . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.266 0.555 . . . . 0.0 110.16 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.704 ' O ' HG23 ' B' ' 13' ' ' VAL . 7.7 ttmt -66.87 -37.51 84.56 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.251 -0.906 . . . . 0.0 110.184 179.993 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.65 -37.24 80.85 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.249 -0.907 . . . . 0.0 110.09 179.855 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -66.02 -41.77 90.52 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.295 -0.878 . . . . 0.0 109.97 179.895 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 12' ' ' ALA . . . . . 0.621 ' HB2' HD12 ' A' ' 16' ' ' ILE . . . -65.59 -40.03 92.24 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.402 -0.811 . . . . 0.0 109.958 179.752 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.704 HG23 ' O ' ' B' ' 9' ' ' LYS . 57.5 t -59.72 -44.83 94.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.352 -0.843 . . . . 0.0 110.077 179.751 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.62 -39.23 93.14 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.147 -0.971 . . . . 0.0 109.946 179.875 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.71 -47.61 80.41 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.357 -0.839 . . . . 0.0 110.07 179.864 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.681 ' O ' HG23 ' B' ' 20' ' ' VAL . 58.8 t -63.65 -45.51 97.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.285 -0.884 . . . . 0.0 110.028 179.884 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.773 HG23 HD21 ' A' ' 33' ' ' LEU . 24.2 t -60.74 -50.87 78.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.3 -0.875 . . . . 0.0 110.003 179.891 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.96 -40.91 67.24 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.271 -0.893 . . . . 0.0 110.091 179.815 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.79 -45.54 78.09 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.266 -0.896 . . . . 0.0 110.023 179.853 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.681 HG23 ' O ' ' B' ' 16' ' ' VAL . 42.5 t -67.21 -43.1 88.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.287 -0.883 . . . . 0.0 110.049 179.855 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -57.3 -37.38 72.35 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.278 -0.888 . . . . 0.0 110.053 179.966 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -49.03 76.89 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.29 -0.881 . . . . 0.0 110.143 -179.987 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 23' ' ' ALA . . . . . 0.549 ' HB2' ' CD1' ' A' ' 67' ' ' LEU . . . -59.04 -36.06 74.38 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.221 -0.924 . . . . 0.0 110.11 -179.927 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.534 0 O-C-N 121.319 -0.863 . . . . 0.0 110.08 179.849 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.512 ' CG2' ' CZ ' ' A' ' 68' ' ' TYR . 2.5 m . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.231 0.538 . . . . 0.0 110.304 . . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.38 -47.4 76.5 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.239 -0.913 . . . . 0.0 109.867 179.896 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -56.02 -35.54 66.95 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.402 -0.811 . . . . 0.0 109.993 179.626 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 16.7 tp60 -60.62 -38.94 86.4 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.191 -0.943 . . . . 0.0 109.841 -179.931 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.891 HG12 ' CD2' ' A' ' 14' ' ' PHE . 53.9 t -61.16 -41.03 87.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.162 -0.961 . . . . 0.0 109.192 179.242 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.469 HG23 ' HE1' ' A' ' 60' ' ' TYR . 11.9 mm -55.26 -49.78 69.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.351 -0.843 . . . . 0.0 109.615 179.452 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.83 -43.61 94.48 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.362 -0.836 . . . . 0.0 109.324 179.331 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.41 ' CB ' HG23 ' B' ' 16' ' ' VAL . 2.7 m -66.69 -40.56 88.57 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.383 -0.823 . . . . 0.0 109.314 179.215 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.891 ' CD2' HG12 ' A' ' 10' ' ' VAL . 1.2 m-85 -68.38 -40.92 81.24 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.333 -0.855 . . . . 0.0 109.587 179.323 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.08 -50.19 64.9 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.362 -0.836 . . . . 0.0 109.561 179.538 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 68.1 mt -60.06 -40.88 84.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.295 -0.878 . . . . 0.0 109.711 179.424 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.743 HD11 HG22 ' B' ' 13' ' ' VAL . 0.6 OUTLIER -65.06 -36.2 83.6 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.396 -0.815 . . . . 0.0 109.894 179.684 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.659 ' HB2' ' HB ' ' A' ' 24' ' ' ILE . . . -89.67 8.22 32.66 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.344 -0.847 . . . . 0.0 110.172 -179.912 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.474 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.4 OUTLIER 67.75 55.66 0.59 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.196 -0.94 . . . . 0.0 110.254 179.991 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.425 ' N ' ' OD1' ' A' ' 20' ' ' ASP . 5.8 m-20 52.28 56.67 7.39 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.285 -0.884 . . . . 0.0 110.397 179.733 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' A' ' 19' ' ' SER . 68.2 mttt -138.52 140.39 27.76 Favored Pre-proline 0 N--CA 1.49 1.551 0 O-C-N 121.19 -0.944 . . . . 0.0 109.951 179.777 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.61 -11.76 18.48 Favored 'Trans proline' 0 C--N 1.305 -1.749 0 O-C-N 124.051 1.553 . . . . 0.0 110.11 179.901 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.57 ' O ' ' HB1' ' A' ' 18' ' ' ALA . 47.8 p90 -135.46 171.25 14.71 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.264 -0.897 . . . . 0.0 110.05 179.805 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.659 ' HB ' ' HB2' ' A' ' 18' ' ' ALA . 8.9 tt -146.72 158.01 10.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.231 -0.918 . . . . 0.0 110.241 -179.917 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.5 mp -91.25 145.14 24.91 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.226 -0.921 . . . . 0.0 110.197 -179.939 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.538 ' HA ' ' CD2' ' A' ' 29' ' ' LEU . . . -59.7 -39.52 84.86 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.303 -0.873 . . . . 0.0 110.328 -179.955 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.73 -35.88 81.14 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.183 -0.948 . . . . 0.0 109.921 179.742 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -69.61 -51.17 37.52 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.338 -0.851 . . . . 0.0 109.554 179.65 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.745 HD12 ' C ' ' A' ' 29' ' ' LEU . 1.7 pp -67.75 -33.53 75.04 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.31 -0.869 . . . . 0.0 109.595 179.192 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.629 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -62.89 -34.47 77.48 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.352 -0.842 . . . . 0.0 110.132 179.79 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -83.68 -31.38 26.16 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.252 -0.905 . . . . 0.0 110.173 179.93 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -76.4 -23.6 54.03 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.266 -0.896 . . . . 0.0 110.287 -179.944 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.784 HD22 ' HB3' ' A' ' 37' ' ' GLN . 1.4 mt -112.92 151.3 43.96 Favored Pre-proline 0 C--N 1.305 -1.357 0 O-C-N 121.197 -0.939 . . . . 0.0 110.061 -179.929 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.462 ' CB ' ' HD2' ' A' ' 35' ' ' PRO . 35.2 Cg_exo -55.0 172.28 0.39 Allowed 'Trans proline' 0 C--N 1.304 -1.815 0 O-C-N 124.033 1.544 . . . . 0.0 110.232 179.946 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.462 ' HD2' ' CB ' ' A' ' 34' ' ' PRO . 30.8 Cg_endo -59.02 -45.8 26.14 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 123.952 1.501 . . . . 0.0 110.311 -179.83 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -66.3 -43.02 87.45 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.323 -0.861 . . . . 0.0 110.77 -179.807 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.784 ' HB3' HD22 ' A' ' 33' ' ' LEU . 4.1 mp0 -69.63 -42.64 74.05 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.156 -0.965 . . . . 0.0 110.381 -179.616 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.629 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -57.26 -48.66 78.29 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.297 -0.877 . . . . 0.0 110.36 -179.726 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 14.2 tm0? -66.82 -43.32 84.06 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.261 -0.899 . . . . 0.0 110.777 -179.78 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -64.91 -42.32 94.82 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.104 -0.997 . . . . 0.0 110.503 -179.521 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.492 ' O ' ' HG2' ' A' ' 45' ' ' MET . 73.6 m -65.22 -51.32 61.68 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.111 -0.993 . . . . 0.0 110.709 -179.687 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.533 HG13 HD11 ' A' ' 29' ' ' LEU . 50.6 mt -53.72 -23.6 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.181 -0.95 . . . . 0.0 110.757 -179.588 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.36 -19.14 31.89 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.117 -0.989 . . . . 0.0 110.649 -179.65 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.608 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 18.4 mmt180 -89.56 -69.99 0.69 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.228 -0.92 . . . . 0.0 110.834 -179.495 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.517 ' CB ' ' O ' ' A' ' 59' ' ' ASP . 9.4 ptp -46.89 110.02 1.18 Allowed Pre-proline 0 N--CA 1.488 1.464 0 O-C-N 121.136 -0.978 . . . . 0.0 110.639 -179.408 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.833 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 9.6 Cg_endo . . . . . 0 C--N 1.307 -1.622 0 O-C-N 124.132 1.596 . . . . 0.0 110.184 179.882 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.714 0 CA-C-O 121.388 0.614 . . . . 0.0 110.575 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.501 HD11 ' HB2' ' A' ' 26' ' ' ALA . 2.3 mt -129.88 160.39 33.67 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.374 -0.829 . . . . 0.0 109.81 179.582 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.517 ' O ' ' CB ' ' A' ' 45' ' ' MET . 1.3 t70 -110.39 110.76 21.66 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.063 -1.023 . . . . 0.0 110.673 -179.789 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.574 ' HB2' ' CD2' ' A' ' 14' ' ' PHE . 40.6 p90 -75.86 -24.24 55.73 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.211 -0.931 . . . . 0.0 109.33 179.231 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.429 ' HB3' ' OD2' ' A' ' 59' ' ' ASP . . . -62.54 -44.4 96.45 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.469 -0.769 . . . . 0.0 109.617 179.67 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.833 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -61.56 -32.81 72.91 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.254 -0.904 . . . . 0.0 109.917 179.682 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.642 ' HZ ' HG22 ' B' ' 20' ' ' VAL . 1.2 t80 -71.4 -39.78 70.94 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.52 -0.737 . . . . 0.0 110.241 179.881 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.476 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 3.6 t -61.05 -50.1 74.7 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.264 -0.898 . . . . 0.0 110.609 -179.69 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.43 -35.3 77.41 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.216 -0.928 . . . . 0.0 110.447 -179.783 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.0 -46.3 68.35 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.208 -0.933 . . . . 0.0 110.786 -179.542 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.761 HD11 ' CD2' ' A' ' 68' ' ' TYR . 2.5 pp -70.84 -33.01 70.21 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.097 -1.002 . . . . 0.0 110.752 -179.477 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.761 ' CD2' HD11 ' A' ' 67' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.26 -0.9 . . . . 0.0 110.391 179.975 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 121.24 0.543 . . . . 0.0 110.139 . . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.749 ' O ' HG23 ' B' ' 13' ' ' VAL . 1.5 tttp -62.26 -48.84 78.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.244 -0.91 . . . . 0.0 110.089 179.892 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.67 -45.55 77.71 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.329 -0.857 . . . . 0.0 110.213 179.881 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -63.45 -41.13 98.65 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.317 -0.864 . . . . 0.0 110.068 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.25 -33.7 76.07 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.309 -0.869 . . . . 0.0 110.167 -179.965 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.749 HG23 ' O ' ' B' ' 9' ' ' LYS . 58.6 t -64.36 -41.96 93.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.278 -0.889 . . . . 0.0 110.093 -179.973 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.04 -35.65 79.23 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.228 -0.92 . . . . 0.0 110.415 -179.974 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 28.7 m -62.31 -44.01 97.5 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.175 -0.953 . . . . 0.0 110.522 -179.862 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.41 HG23 ' CB ' ' A' ' 13' ' ' SER . 84.2 t -68.74 -42.54 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.201 -0.937 . . . . 0.0 110.578 -179.728 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.546 HG23 ' O ' ' B' ' 13' ' ' VAL . 89.9 t -58.28 -44.83 88.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.098 -1.001 . . . . 0.0 110.503 -179.86 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.91 -38.49 91.27 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.316 -0.865 . . . . 0.0 110.285 -179.823 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.99 -46.06 82.99 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.169 -0.957 . . . . 0.0 110.39 -179.935 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.642 HG22 ' HZ ' ' A' ' 63' ' ' PHE . 76.1 t -65.45 -42.33 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.239 -0.913 . . . . 0.0 110.309 -179.86 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -58.48 -41.62 85.68 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.25 -0.906 . . . . 0.0 110.202 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 3.5 tm0? -60.49 -47.84 84.38 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.219 -0.925 . . . . 0.0 110.005 -179.944 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.88 -35.09 80.01 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.296 -0.877 . . . . 0.0 110.195 179.875 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 24' ' ' ARG . . . . . 0.448 ' HG2' ' NH1' ' B' ' 24' ' ' ARG . 17.8 ttp85 . . . . . 0 N--CA 1.492 1.669 0 O-C-N 121.233 -0.917 . . . . 0.0 110.456 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.239 0.542 . . . . 0.0 110.207 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -76.91 0.42 21.03 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.238 -0.914 . . . . 0.0 110.214 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -152.0 149.93 29.42 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.262 -0.899 . . . . 0.0 110.172 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.407 ' O ' ' CB ' ' A' ' 5' ' ' ASP . 1.0 OUTLIER -164.84 124.9 1.94 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.171 -0.956 . . . . 0.0 110.264 -179.959 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.511 ' O ' ' N ' ' A' ' 7' ' ' ALA . 0.1 OUTLIER 175.46 33.81 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.236 -0.915 . . . . 0.0 110.176 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.517 HG22 ' CE2' ' A' ' 68' ' ' TYR . 1.6 m 63.16 -71.58 0.05 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.251 -0.906 . . . . 0.0 110.107 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.511 ' N ' ' O ' ' A' ' 5' ' ' ASP . . . -70.28 -44.23 68.81 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.074 -1.017 . . . . 0.0 109.476 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -62.02 -36.09 80.51 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.471 -0.768 . . . . 0.0 109.906 179.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -60.79 -43.08 98.58 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.33 -0.856 . . . . 0.0 110.097 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.518 HG12 ' HD2' ' A' ' 14' ' ' PHE . 62.0 t -66.06 -42.81 92.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.116 -0.99 . . . . 0.0 109.631 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.615 HG23 ' HE1' ' A' ' 60' ' ' TYR . 61.9 mt -61.45 -49.67 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.298 -0.876 . . . . 0.0 109.318 179.314 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.65 -39.09 92.79 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.377 -0.827 . . . . 0.0 109.228 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.2 m -68.18 -44.18 76.47 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.41 -0.806 . . . . 0.0 109.479 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.57 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 0.6 OUTLIER -65.7 -42.59 91.01 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.307 -0.87 . . . . 0.0 109.497 179.386 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.19 -42.91 70.22 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.343 -0.848 . . . . 0.0 109.416 179.308 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 17.0 mt -60.55 -44.85 97.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.35 -0.843 . . . . 0.0 109.583 179.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.859 HD12 ' HB3' ' A' ' 32' ' ' GLU . 2.5 mm? -65.09 -40.67 94.94 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.359 -0.838 . . . . 0.0 109.966 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.826 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -75.51 1.3 14.53 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.298 -0.876 . . . . 0.0 110.311 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.478 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.1 OUTLIER 67.0 69.18 0.4 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.209 -0.932 . . . . 0.0 110.303 179.866 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 47.04 56.21 7.07 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.243 -0.911 . . . . 0.0 110.28 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.538 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 18.5 mttp -134.34 143.49 47.12 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.16 -0.963 . . . . 0.0 110.023 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -73.83 -0.05 8.91 Favored 'Trans proline' 0 C--N 1.304 -1.815 0 O-C-N 124.04 1.547 . . . . 0.0 110.122 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.538 ' CZ ' ' HD3' ' A' ' 21' ' ' LYS . 23.1 p90 -145.94 163.18 35.96 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.237 -0.914 . . . . 0.0 110.22 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.826 HG12 ' HB2' ' A' ' 18' ' ' ALA . 0.3 OUTLIER -127.07 142.14 44.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.301 -0.874 . . . . 0.0 109.735 179.89 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.485 ' H ' HD13 ' A' ' 24' ' ' ILE . 44.1 mt -88.59 152.26 21.95 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.242 -0.911 . . . . 0.0 110.352 -179.653 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.26 -44.32 95.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.36 -0.837 . . . . 0.0 110.069 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -60.19 -34.97 74.35 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.365 -0.834 . . . . 0.0 110.242 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.466 ' HB3' HD11 ' A' ' 24' ' ' ILE . 9.0 mm-40 -61.87 -49.59 75.65 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.23 -0.919 . . . . 0.0 109.931 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.468 HD21 HG13 ' A' ' 24' ' ' ILE . 9.1 mt -59.53 -34.17 72.3 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.264 -0.898 . . . . 0.0 109.814 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.17 -42.26 93.86 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.329 -0.857 . . . . 0.0 110.174 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -91.33 -20.36 21.94 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.198 -0.938 . . . . 0.0 110.456 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.859 ' HB3' HD12 ' A' ' 17' ' ' LEU . 17.0 mm-40 -98.68 -23.76 15.32 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.08 -1.012 . . . . 0.0 110.409 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.432 HD22 ' HB3' ' A' ' 37' ' ' GLN . 0.3 OUTLIER -128.16 147.72 64.65 Favored Pre-proline 0 N--CA 1.487 1.393 0 O-C-N 121.165 -0.959 . . . . 0.0 110.066 179.962 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.497 ' O ' ' N ' ' A' ' 37' ' ' GLN . 5.9 Cg_exo -43.59 131.03 7.32 Favored 'Trans proline' 0 C--N 1.304 -1.782 0 O-C-N 123.89 1.469 . . . . 0.0 109.679 179.402 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.429 ' C ' ' O ' ' A' ' 34' ' ' PRO . 12.0 Cg_exo -36.8 -42.38 0.77 Allowed 'Trans proline' 0 C--N 1.306 -1.67 0 O-C-N 124.254 1.66 . . . . 0.0 110.619 -179.392 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -65.94 -36.64 83.89 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.352 -0.843 . . . . 0.0 110.857 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.665 ' HG3' HG11 ' B' ' 20' ' ' VAL . 1.8 mp0 -69.09 -44.5 72.35 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.064 -1.023 . . . . 0.0 110.784 -179.262 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.734 ' O ' HD12 ' A' ' 42' ' ' ILE . . . -58.66 -47.24 85.14 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.195 -0.94 . . . . 0.0 110.707 -179.564 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.4 tp60 -60.3 -49.43 77.63 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.227 -0.92 . . . . 0.0 110.995 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 51.6 t80 -61.84 -48.0 82.55 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.009 -1.057 . . . . 0.0 110.436 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.447 ' O ' ' SD ' ' A' ' 45' ' ' MET . 69.8 m -65.35 -49.51 69.08 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.256 -0.902 . . . . 0.0 110.64 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.734 HD12 ' O ' ' A' ' 38' ' ' ALA . 18.6 mt -44.45 -24.66 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.12 -0.988 . . . . 0.0 110.535 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -84.15 -41.28 17.22 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.173 -0.955 . . . . 0.0 110.743 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.532 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 1.5 mmt-85 -64.11 -72.62 0.14 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.12 -0.987 . . . . 0.0 110.59 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.468 ' CB ' ' O ' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -48.01 116.9 5.1 Favored Pre-proline 0 N--CA 1.489 1.475 0 O-C-N 121.14 -0.975 . . . . 0.0 110.394 -179.841 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.581 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 10.5 Cg_endo -59.55 -157.58 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.728 0 O-C-N 124.14 1.6 . . . . 0.0 110.45 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.601 ' O ' ' CD1' ' A' ' 48' ' ' TYR . . . -88.8 71.13 8.71 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.311 -0.868 . . . . 0.0 110.404 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.626 ' CE2' ' CB ' ' A' ' 53' ' ' SER . 27.0 p90 32.73 -156.46 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.017 0 CA-C-O 121.375 0.607 . . . . 0.0 111.337 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.536 ' N ' ' CD2' ' A' ' 48' ' ' TYR . 0.4 OUTLIER 169.35 72.34 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.142 -0.974 . . . . 0.0 110.249 -179.751 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.463 ' H ' ' HG ' ' A' ' 53' ' ' SER . . . -134.14 177.01 19.47 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.544 -1.423 . . . . 0.0 109.544 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -81.74 -53.73 0.04 OUTLIER 'Trans proline' 0 C--N 1.304 -1.767 0 O-C-N 124.005 1.529 . . . . 0.0 110.214 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.486 ' O ' ' O ' ' A' ' 53' ' ' SER . . . -96.24 35.77 4.2 Favored Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.437 -1.465 . . . . 0.0 109.437 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.626 ' CB ' ' CE2' ' A' ' 48' ' ' TYR . 69.1 m -53.71 -162.74 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.304 0 O-C-N 121.402 -1.058 . . . . 0.0 110.717 -179.6 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.82 ' CG2' ' HB2' ' A' ' 57' ' ' ALA . 10.5 m -136.0 172.16 7.57 Favored Pre-proline 0 N--CA 1.492 1.65 0 O-C-N 121.264 -0.897 . . . . 0.0 110.137 179.847 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -79.51 72.79 6.34 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 124.042 1.549 . . . . 0.0 110.17 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 130.68 50.96 0.1 Allowed Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.82 ' HB2' ' CG2' ' A' ' 54' ' ' VAL . . . -108.15 158.85 17.07 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.291 -1.123 . . . . 0.0 110.194 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.794 HD23 ' O ' ' A' ' 57' ' ' ALA . 25.1 mt -135.88 147.54 48.23 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.197 -0.94 . . . . 0.0 110.147 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.477 ' CG ' ' HA ' ' A' ' 48' ' ' TYR . 0.7 OUTLIER -103.37 111.83 24.43 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.19 -0.944 . . . . 0.0 110.291 179.916 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.615 ' HE1' HG23 ' A' ' 11' ' ' ILE . 8.0 p90 -81.66 -19.81 40.9 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.275 -0.89 . . . . 0.0 109.63 179.534 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.53 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -61.48 -40.76 95.73 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.415 -0.803 . . . . 0.0 109.853 179.787 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.581 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -66.53 -36.21 82.13 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.211 -0.931 . . . . 0.0 109.662 179.645 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.532 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 2.4 t80 -72.07 -34.75 68.95 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.722 -0.611 . . . . 0.0 110.18 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.3 p -60.91 -42.4 97.98 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.331 -0.856 . . . . 0.0 110.38 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 8.5 t -64.14 -36.86 85.43 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.218 -0.926 . . . . 0.0 110.486 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.489 ' HA ' ' O ' ' A' ' 69' ' ' GLY . . . -67.7 -41.0 84.28 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.211 -0.931 . . . . 0.0 110.473 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.5 -44.07 89.32 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.208 -0.933 . . . . 0.0 110.187 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.517 ' CE2' HG22 ' A' ' 6' ' ' THR . 39.4 m-85 -99.38 13.68 32.35 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.237 -0.914 . . . . 0.0 110.473 -179.772 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.489 ' O ' ' HA ' ' A' ' 66' ' ' ALA . . . -174.77 102.11 0.17 Allowed Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.766 -1.334 . . . . 0.0 109.766 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.445 ' O ' ' CB ' ' A' ' 71' ' ' SER . 0.1 OUTLIER -131.61 107.9 9.15 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.257 -1.143 . . . . 0.0 110.117 179.798 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.567 ' O ' HD23 ' A' ' 73' ' ' LEU . 0.3 OUTLIER 65.47 146.69 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.261 -0.9 . . . . 0.0 110.207 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -78.33 138.01 38.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.285 -0.884 . . . . 0.0 110.222 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.567 HD23 ' O ' ' A' ' 71' ' ' SER . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.626 0 O-C-N 121.276 -0.89 . . . . 0.0 110.226 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.281 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 5.6 tttt -75.12 -43.69 51.29 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.264 -1.139 . . . . 0.0 110.072 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 14.5 tttt -67.86 -46.71 70.96 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.297 -0.877 . . . . 0.0 110.148 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.1 -41.08 71.18 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.259 -0.901 . . . . 0.0 109.816 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -60.55 -40.3 91.09 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.299 -0.876 . . . . 0.0 109.71 179.548 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' ALA . . . . . 0.538 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -63.19 -42.12 99.28 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.425 -0.797 . . . . 0.0 110.028 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.777 ' O ' HG23 ' B' ' 17' ' ' VAL . 46.6 t -61.28 -40.59 86.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.212 -0.93 . . . . 0.0 109.703 179.654 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.0 -39.24 77.78 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.259 -0.901 . . . . 0.0 109.499 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.7 m -68.82 -47.21 66.63 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.384 -0.822 . . . . 0.0 109.576 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.622 ' O ' HG23 ' B' ' 20' ' ' VAL . 26.4 t -63.46 -45.54 97.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.316 -0.865 . . . . 0.0 109.595 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.777 HG23 ' O ' ' B' ' 13' ' ' VAL . 49.4 t -62.45 -49.68 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.263 -0.898 . . . . 0.0 109.437 179.283 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.1 -43.07 77.74 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.363 -0.836 . . . . 0.0 109.924 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.18 -36.75 82.45 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.278 -0.888 . . . . 0.0 109.906 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.665 HG11 ' HG3' ' A' ' 37' ' ' GLN . 55.4 t -65.29 -41.43 91.39 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 121.187 -0.946 . . . . 0.0 109.713 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.3 -31.66 72.29 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.349 -0.844 . . . . 0.0 110.129 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.25 -51.23 70.84 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.232 -0.917 . . . . 0.0 110.087 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.26 -34.36 77.83 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.223 -0.923 . . . . 0.0 109.858 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.3 ttt180 -63.78 -36.46 83.96 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.405 -0.809 . . . . 0.0 110.474 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -53.61 -22.23 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 O-C-N 121.134 -0.979 . . . . 0.0 109.911 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -87.07 18.49 3.58 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.55 -0.719 . . . . 0.0 110.385 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 27' ' ' GLU . . . . . 0.461 ' O ' ' O ' ' B' ' 28' ' ' PRO . 0.0 OUTLIER -108.73 114.63 58.51 Favored Pre-proline 0 N--CA 1.492 1.629 0 O-C-N 121.281 -0.887 . . . . 0.0 110.049 179.88 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 28' ' ' PRO . . . . . 0.461 ' O ' ' O ' ' B' ' 27' ' ' GLU . 18.7 Cg_endo -54.51 -163.74 0.01 OUTLIER 'Trans proline' 0 C--N 1.303 -1.819 0 O-C-N 124.12 1.59 . . . . 0.0 110.431 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.588 0 O-C-N 121.28 -0.888 . . . . 0.0 110.325 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 38.0 tpp . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.187 0.518 . . . . 0.0 110.17 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -173.15 127.22 0.45 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.212 -0.93 . . . . 0.0 110.205 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -140.38 176.85 8.43 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.253 -0.904 . . . . 0.0 110.232 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.424 ' O ' ' OD1' ' A' ' 5' ' ' ASP . 12.7 t -81.97 -179.51 7.42 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.321 -0.862 . . . . 0.0 110.21 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.424 ' OD1' ' O ' ' A' ' 4' ' ' THR . 0.1 OUTLIER 176.6 170.36 0.47 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.251 -0.906 . . . . 0.0 110.388 179.972 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.676 HG21 ' CE1' ' A' ' 68' ' ' TYR . 0.6 OUTLIER -52.97 -50.3 64.4 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.379 -0.825 . . . . 0.0 110.245 -179.971 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.33 -47.45 76.48 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.287 -0.883 . . . . 0.0 109.866 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -54.59 -36.34 64.31 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.382 -0.824 . . . . 0.0 109.828 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.415 ' O ' ' OG ' ' A' ' 13' ' ' SER . 4.2 tp60 -61.63 -48.05 82.63 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.322 -0.861 . . . . 0.0 110.151 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.477 HG12 ' CD2' ' A' ' 14' ' ' PHE . 12.6 t -64.3 -43.08 97.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.139 -0.975 . . . . 0.0 109.9 179.804 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 30.6 mt -62.0 -48.31 89.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 121.273 -0.892 . . . . 0.0 109.621 179.547 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.51 -41.01 79.95 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.223 -0.923 . . . . 0.0 109.006 179.257 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.449 ' HB3' HG23 ' B' ' 16' ' ' VAL . 3.7 m -68.16 -39.09 82.68 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.431 -0.793 . . . . 0.0 109.371 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.499 ' CG ' ' HB2' ' A' ' 60' ' ' TYR . 2.6 m-85 -68.58 -45.35 72.29 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.386 -0.822 . . . . 0.0 109.73 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 11.3 tpp85 -53.72 -41.18 66.74 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.345 -0.847 . . . . 0.0 109.55 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 42.5 mt -62.37 -44.54 99.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.401 -0.812 . . . . 0.0 109.922 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.661 HD22 ' HB3' ' A' ' 32' ' ' GLU . 56.8 mt -64.84 -41.75 95.48 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.344 -0.848 . . . . 0.0 109.861 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.677 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -67.86 -7.88 31.74 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.304 -0.872 . . . . 0.0 110.106 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.8 t 62.43 68.79 0.64 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.268 -0.895 . . . . 0.0 110.302 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 58.36 53.79 6.12 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.245 -0.909 . . . . 0.0 110.189 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.677 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 18.8 mtmt -141.9 143.36 28.23 Favored Pre-proline 0 N--CA 1.489 1.51 0 O-C-N 121.209 -0.932 . . . . 0.0 110.078 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -78.58 5.39 5.59 Favored 'Trans proline' 0 C--N 1.304 -1.787 0 O-C-N 124.078 1.568 . . . . 0.0 109.96 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.475 ' CD1' ' N ' ' A' ' 23' ' ' TYR . 28.9 p90 -145.3 159.83 42.43 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.279 -0.888 . . . . 0.0 109.963 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.817 HD12 HD23 ' A' ' 29' ' ' LEU . 0.3 OUTLIER -126.71 143.21 40.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.154 -0.966 . . . . 0.0 109.882 179.816 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.455 ' H ' HD13 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -100.66 150.64 22.53 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.29 -0.881 . . . . 0.0 110.407 -179.756 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.0 -33.12 66.83 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.283 -0.886 . . . . 0.0 109.74 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -61.53 -40.07 93.32 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.335 -0.853 . . . . 0.0 109.67 179.691 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.503 ' HB3' HD11 ' A' ' 24' ' ' ILE . 0.6 OUTLIER -68.56 -48.44 64.27 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.389 -0.819 . . . . 0.0 109.794 179.568 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.956 ' CD1' HD12 ' A' ' 33' ' ' LEU . 4.3 mm? -60.78 -34.24 74.2 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.198 -0.939 . . . . 0.0 109.738 179.612 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.0 mmm-85 -68.96 -34.72 75.8 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.36 -0.837 . . . . 0.0 110.109 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.64 -14.6 27.92 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.344 -0.847 . . . . 0.0 110.579 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.661 ' HB3' HD22 ' A' ' 17' ' ' LEU . 21.1 mm-40 -106.7 -23.53 12.4 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.078 -1.014 . . . . 0.0 110.693 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.956 HD12 ' CD1' ' A' ' 29' ' ' LEU . 6.4 mt -122.61 164.6 25.6 Favored Pre-proline 0 N--CA 1.488 1.431 0 O-C-N 121.073 -1.017 . . . . 0.0 110.249 -179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.442 ' CD ' HD23 ' A' ' 33' ' ' LEU . 33.8 Cg_exo -66.11 144.81 76.95 Favored 'Trans proline' 0 C--N 1.305 -1.761 0 O-C-N 124.036 1.545 . . . . 0.0 109.908 179.759 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.433 ' C ' ' O ' ' A' ' 34' ' ' PRO . 19.4 Cg_endo -40.48 -44.96 4.44 Favored 'Trans proline' 0 C--N 1.304 -1.802 0 O-C-N 124.032 1.543 . . . . 0.0 110.414 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.72 -37.49 86.57 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.244 -0.91 . . . . 0.0 110.729 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.522 ' HG2' HG22 ' B' ' 17' ' ' VAL . 0.0 OUTLIER -69.26 -45.83 68.76 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.137 -0.977 . . . . 0.0 110.554 -179.579 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.55 -44.21 96.39 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.156 -0.965 . . . . 0.0 110.582 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.9 tp60 -66.1 -46.53 77.3 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.096 -1.003 . . . . 0.0 110.473 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -63.28 -45.99 88.87 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.239 -0.913 . . . . 0.0 110.342 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.45 ' SG ' ' O ' ' A' ' 37' ' ' GLN . 74.9 m -60.93 -44.34 97.34 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.253 -0.904 . . . . 0.0 110.54 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 25.5 mt -53.88 -24.2 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.2 -0.937 . . . . 0.0 110.305 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.9 tttm -81.06 -19.43 43.79 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.127 -0.983 . . . . 0.0 110.227 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.591 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 26.4 mmt180 -92.24 -68.5 0.79 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.277 -0.889 . . . . 0.0 110.304 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.469 ' HB2' ' O ' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -55.55 109.6 1.73 Allowed Pre-proline 0 N--CA 1.489 1.489 0 O-C-N 121.186 -0.946 . . . . 0.0 110.324 179.907 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.622 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 19.7 Cg_exo -66.63 -159.11 0.04 OUTLIER 'Trans proline' 0 C--N 1.304 -1.791 0 O-C-N 124.076 1.566 . . . . 0.0 110.217 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.27 152.8 43.79 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.27 -0.894 . . . . 0.0 110.42 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.655 ' CE2' ' HB2' ' A' ' 53' ' ' SER . 0.0 OUTLIER -58.68 -177.93 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.351 -0.843 . . . . 0.0 110.735 179.962 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 89.7 p -157.89 39.7 0.27 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.234 -0.916 . . . . 0.0 110.347 -179.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -91.08 -162.93 38.49 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.424 -1.47 . . . . 0.0 109.424 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo -93.49 -50.24 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.736 0 O-C-N 124.069 1.563 . . . . 0.0 110.061 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.523 ' O ' ' C ' ' A' ' 53' ' ' SER . . . -112.96 -42.26 0.94 Allowed Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.655 ' HB2' ' CE2' ' A' ' 48' ' ' TYR . 0.7 OUTLIER 25.98 -143.25 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.311 0 CA-C-O 121.518 0.675 . . . . 0.0 111.642 179.537 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.568 HG13 ' C ' ' A' ' 53' ' ' SER . 24.5 m -153.32 157.22 32.88 Favored Pre-proline 0 C--N 1.294 -1.814 0 O-C-N 121.491 -0.755 . . . . 0.0 110.567 -179.661 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -68.18 123.51 10.69 Favored 'Trans proline' 0 C--N 1.306 -1.683 0 O-C-N 124.152 1.607 . . . . 0.0 110.223 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 111.02 -20.5 23.91 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.22 140.45 58.74 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.31 -1.112 . . . . 0.0 110.284 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.1 mt -121.66 160.15 25.05 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.24 -0.912 . . . . 0.0 110.015 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.529 ' OD2' ' HB2' ' A' ' 62' ' ' ALA . 6.2 t0 -97.6 111.61 23.81 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.252 -0.905 . . . . 0.0 110.349 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.605 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 11.2 p90 -79.6 -23.42 42.69 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.27 -0.894 . . . . 0.0 109.279 179.354 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.605 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -60.01 -42.96 95.41 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.395 -0.816 . . . . 0.0 109.657 179.584 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.622 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -60.79 -32.83 72.16 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.247 -0.908 . . . . 0.0 109.868 179.648 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.591 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 1.3 t80 -71.63 -36.77 70.86 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.687 -0.633 . . . . 0.0 110.372 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.2 m -61.47 -38.89 88.89 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.147 -0.971 . . . . 0.0 110.457 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.455 ' O ' ' O ' ' A' ' 69' ' ' GLY . 44.8 p -68.37 -42.36 79.26 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.205 -0.934 . . . . 0.0 110.418 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -63.65 -38.11 89.87 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.216 -0.928 . . . . 0.0 110.619 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.77 -42.3 88.65 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.146 -0.971 . . . . 0.0 110.529 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.676 ' CE1' HG21 ' A' ' 6' ' ' THR . 28.3 m-85 -97.78 -34.23 10.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.181 -0.949 . . . . 0.0 110.431 -179.701 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.455 ' O ' ' O ' ' A' ' 65' ' ' SER . . . 133.66 -124.54 3.68 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.433 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 36.3 tt0 50.72 60.19 4.05 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.199 -1.177 . . . . 0.0 110.198 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.0 t -145.23 114.34 6.99 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.212 -0.93 . . . . 0.0 110.179 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -84.03 127.17 33.7 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.213 -0.929 . . . . 0.0 110.239 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.2 mp . . . . . 0 N--CA 1.491 1.62 0 O-C-N 121.241 -0.912 . . . . 0.0 110.24 -179.942 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.47 -52.6 60.71 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.242 -1.152 . . . . 0.0 110.176 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.95 -48.49 71.16 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.276 -0.89 . . . . 0.0 110.035 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.15 -37.43 66.95 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.28 -0.887 . . . . 0.0 109.883 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -66.23 -40.2 90.09 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.274 -0.891 . . . . 0.0 109.804 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.42 -43.78 98.01 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.259 -0.901 . . . . 0.0 109.649 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.502 ' O ' HG23 ' B' ' 17' ' ' VAL . 76.6 t -58.78 -40.34 79.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.193 -0.942 . . . . 0.0 109.485 179.293 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.06 -38.85 92.82 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.46 -0.775 . . . . 0.0 109.966 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 57.2 m -69.12 -45.53 69.95 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.396 -0.815 . . . . 0.0 110.172 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.72 HG11 HD11 ' A' ' 33' ' ' LEU . 70.3 t -62.47 -46.95 95.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.214 -0.928 . . . . 0.0 109.983 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.522 HG22 ' HG2' ' A' ' 37' ' ' GLN . 77.3 t -60.56 -49.15 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.182 -0.949 . . . . 0.0 110.009 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.5 -39.39 76.38 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.303 -0.873 . . . . 0.0 110.107 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.86 -45.39 78.32 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.309 -0.869 . . . . 0.0 110.116 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 53.3 t -61.85 -41.68 91.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.306 -0.871 . . . . 0.0 110.132 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.07 -38.51 91.48 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.299 -0.875 . . . . 0.0 110.169 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 22' ' ' GLN . . . . . 0.45 ' HA ' HG12 ' B' ' 25' ' ' VAL . 1.7 tt0 -55.83 -41.35 74.14 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.193 -0.942 . . . . 0.0 110.295 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.5 -42.53 95.76 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.214 -0.929 . . . . 0.0 110.282 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.2 mmm-85 -70.39 -49.12 52.34 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.3 -0.875 . . . . 0.0 110.317 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 25' ' ' VAL . . . . . 0.45 HG12 ' HA ' ' B' ' 22' ' ' GLN . 3.5 p -66.86 -24.86 33.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.35 -0.844 . . . . 0.0 110.532 -179.614 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.408 ' HB3' ' O ' ' B' ' 25' ' ' VAL . 20.8 ttt-85 60.58 66.42 0.93 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.471 -0.768 . . . . 0.0 110.215 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -106.44 130.93 22.17 Favored Pre-proline 0 N--CA 1.493 1.682 0 O-C-N 121.198 -0.939 . . . . 0.0 110.249 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -80.06 163.54 22.82 Favored 'Trans proline' 0 C--N 1.307 -1.638 0 O-C-N 124.046 1.55 . . . . 0.0 110.369 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.565 0 O-C-N 121.188 -0.945 . . . . 0.0 110.175 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.478 ' O ' ' HB3' ' A' ' 2' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.203 0.525 . . . . 0.0 110.186 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.478 ' HB3' ' O ' ' A' ' 1' ' ' MET . . . 57.28 175.95 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.284 -0.885 . . . . 0.0 110.175 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.441 ' HB3' ' OE2' ' A' ' 8' ' ' GLU . 0.1 OUTLIER -178.62 150.94 0.55 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.187 -0.946 . . . . 0.0 110.284 179.992 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.432 ' O ' ' CB ' ' A' ' 5' ' ' ASP . 4.9 t -169.99 150.64 3.85 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.222 -0.924 . . . . 0.0 110.138 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.432 ' CB ' ' O ' ' A' ' 4' ' ' THR . 0.1 OUTLIER 173.58 -179.72 0.09 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.188 -0.945 . . . . 0.0 110.276 -179.943 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.453 ' HB ' ' CZ ' ' A' ' 68' ' ' TYR . 9.5 p -67.89 -61.54 1.82 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.304 -0.873 . . . . 0.0 110.1 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.02 -44.82 83.22 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.201 -0.937 . . . . 0.0 109.431 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.74 ' HA ' HD12 ' A' ' 11' ' ' ILE . 18.0 tt0 -60.49 -36.2 77.74 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.407 -0.808 . . . . 0.0 109.591 179.314 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -61.8 -48.56 80.07 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.3 -0.875 . . . . 0.0 110.322 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.788 HG12 ' CD2' ' A' ' 14' ' ' PHE . 46.6 t -58.54 -41.22 81.32 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.08 -1.012 . . . . 0.0 109.589 179.574 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.74 HD12 ' HA ' ' A' ' 8' ' ' GLU . 64.8 mt -61.3 -45.66 98.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.412 -0.805 . . . . 0.0 109.472 179.336 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.22 -47.2 83.51 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.32 -0.863 . . . . 0.0 109.144 179.145 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.468 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 14.2 m -62.92 -39.26 94.03 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.284 -0.885 . . . . 0.0 109.009 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.788 ' CD2' HG12 ' A' ' 10' ' ' VAL . 1.2 m-85 -66.98 -43.29 83.38 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.434 -0.791 . . . . 0.0 109.41 179.23 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.554 ' CD ' ' HA ' ' A' ' 20' ' ' ASP . 0.0 OUTLIER -53.18 -43.11 66.85 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.29 -0.881 . . . . 0.0 109.009 179.184 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.59 HD12 ' HB2' ' B' ' 12' ' ' ALA . 39.7 mt -58.89 -44.81 91.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.463 -0.773 . . . . 0.0 109.432 179.117 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 13' ' ' SER . 33.2 mt -65.05 -41.99 94.66 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.232 -0.917 . . . . 0.0 109.779 179.567 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.685 ' HB1' ' O ' ' A' ' 23' ' ' TYR . . . -76.33 -2.07 29.9 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.421 -0.799 . . . . 0.0 110.195 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.455 ' O ' ' C ' ' A' ' 20' ' ' ASP . 0.4 OUTLIER 64.93 77.37 0.31 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.317 -0.864 . . . . 0.0 110.328 179.783 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.554 ' HA ' ' CD ' ' A' ' 15' ' ' ARG . 4.6 p-10 37.44 45.36 0.56 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.593 -0.692 . . . . 0.0 110.517 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 18' ' ' ALA . 10.7 mmtt -122.08 144.89 42.5 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.351 -0.843 . . . . 0.0 110.116 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -65.5 -8.2 18.4 Favored 'Trans proline' 0 C--N 1.304 -1.783 0 O-C-N 124.218 1.641 . . . . 0.0 110.209 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.685 ' O ' ' HB1' ' A' ' 18' ' ' ALA . 19.5 p90 -143.85 167.53 22.1 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.315 -0.866 . . . . 0.0 110.288 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.754 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -123.19 140.66 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.303 -0.873 . . . . 0.0 109.767 179.797 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.754 ' N ' HD13 ' A' ' 24' ' ' ILE . 3.3 mp -81.47 149.96 28.51 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.142 -0.974 . . . . 0.0 110.216 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.511 ' HA ' HD11 ' A' ' 42' ' ' ILE . . . -61.47 -40.03 93.06 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.368 -0.832 . . . . 0.0 110.268 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -63.59 -36.28 83.29 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.219 -0.926 . . . . 0.0 109.899 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.553 ' HB3' HD11 ' A' ' 24' ' ' ILE . 2.6 mm-40 -60.62 -37.53 81.73 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.248 -0.907 . . . . 0.0 109.3 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.713 HD12 ' CD1' ' A' ' 42' ' ' ILE . 22.9 mt -66.53 -36.33 82.42 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.394 -0.816 . . . . 0.0 109.606 179.401 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.0 mtt85 -68.81 -34.53 75.68 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.331 -0.856 . . . . 0.0 110.116 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.402 ' NH1' ' HG2' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -93.9 -18.67 21.71 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.293 -0.88 . . . . 0.0 110.773 -179.499 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.47 ' CG ' ' O ' ' A' ' 28' ' ' GLU . 12.6 mm-40 -99.55 -23.61 15.03 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.025 -1.047 . . . . 0.0 110.745 -179.616 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.797 HD11 HG11 ' B' ' 16' ' ' VAL . 2.3 mt -128.63 141.83 42.86 Favored Pre-proline 0 N--CA 1.488 1.475 0 O-C-N 121.055 -1.028 . . . . 0.0 110.12 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.592 ' HD2' HD23 ' A' ' 33' ' ' LEU . 31.6 Cg_exo -43.58 130.91 7.28 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.825 1.434 . . . . 0.0 109.634 179.51 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.458 ' C ' ' O ' ' A' ' 34' ' ' PRO . 32.3 Cg_exo -35.18 -38.95 0.2 Allowed 'Trans proline' 0 C--N 1.308 -1.598 0 O-C-N 124.274 1.671 . . . . 0.0 110.904 -179.522 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.15 -43.9 85.7 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.35 -0.843 . . . . 0.0 110.954 -179.83 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.71 ' HB3' HD22 ' A' ' 33' ' ' LEU . 2.5 mp0 -70.02 -42.02 73.52 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.081 -1.012 . . . . 0.0 110.99 -179.301 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.496 ' O ' HG12 ' A' ' 42' ' ' ILE . . . -55.87 -45.83 78.44 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.245 -0.909 . . . . 0.0 110.662 -179.375 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -54.53 -46.86 73.64 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.111 -0.993 . . . . 0.0 110.68 -179.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -63.16 -47.01 84.48 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.094 -1.004 . . . . 0.0 110.551 -179.638 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.486 ' O ' ' HG2' ' A' ' 45' ' ' MET . 84.3 m -65.33 -48.36 73.3 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.15 -0.969 . . . . 0.0 110.681 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.713 ' CD1' HD12 ' A' ' 29' ' ' LEU . 15.9 mm -47.58 -31.06 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.127 -0.983 . . . . 0.0 110.876 -179.529 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 10.2 tttt -85.01 -36.7 21.11 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.105 -0.997 . . . . 0.0 110.374 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.569 ' HG3' ' CE1' ' A' ' 63' ' ' PHE . 9.3 mmp_? -60.13 -73.42 0.09 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.34 -0.85 . . . . 0.0 110.271 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.668 ' HE2' ' HA ' ' A' ' 60' ' ' TYR . 21.2 ptp -56.73 138.97 77.24 Favored Pre-proline 0 N--CA 1.488 1.453 0 O-C-N 121.213 -0.929 . . . . 0.0 110.301 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.517 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 20.5 Cg_endo -88.25 -170.19 0.5 Allowed 'Trans proline' 0 C--N 1.306 -1.694 0 O-C-N 123.963 1.507 . . . . 0.0 110.504 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -77.0 131.78 38.64 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.216 -0.928 . . . . 0.0 110.176 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.448 ' O ' ' OG ' ' A' ' 53' ' ' SER . 20.2 t80 -72.12 92.83 1.37 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.275 -0.89 . . . . 0.0 110.159 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -104.07 73.33 1.14 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.203 -0.936 . . . . 0.0 110.357 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.437 ' O ' ' N ' ' A' ' 52' ' ' GLY . . . -101.45 -161.57 27.15 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -68.8 60.27 1.21 Allowed 'Trans proline' 0 C--N 1.307 -1.656 0 O-C-N 123.898 1.473 . . . . 0.0 110.197 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.453 ' O ' ' HB3' ' A' ' 53' ' ' SER . . . 138.51 -86.85 0.21 Allowed Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.453 ' HB3' ' O ' ' A' ' 52' ' ' GLY . 10.8 t 56.06 -179.25 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.34 0 O-C-N 121.244 -1.151 . . . . 0.0 110.257 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 34.4 m -138.35 154.04 73.37 Favored Pre-proline 0 C--N 1.294 -1.833 0 O-C-N 121.762 -0.587 . . . . 0.0 110.119 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -59.55 117.99 4.8 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 124.132 1.596 . . . . 0.0 110.307 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 103.73 17.92 15.58 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -102.34 125.77 49.15 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.171 -1.194 . . . . 0.0 110.335 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.403 ' HA ' ' O ' ' A' ' 46' ' ' PRO . 1.2 mp -114.95 159.54 20.61 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.306 -0.871 . . . . 0.0 109.725 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.483 ' O ' ' HB2' ' A' ' 45' ' ' MET . 4.9 m-20 -108.39 110.61 22.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.024 -1.048 . . . . 0.0 110.479 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.668 ' HA ' ' HE2' ' A' ' 45' ' ' MET . 15.0 p90 -73.35 -26.7 61.13 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.336 -0.852 . . . . 0.0 110.14 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.558 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.13 -36.36 68.16 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.273 -0.892 . . . . 0.0 109.983 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.517 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -68.12 -34.41 76.33 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.248 -0.907 . . . . 0.0 109.885 179.616 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.569 ' CE1' ' HG3' ' A' ' 44' ' ' ARG . 2.7 t80 -71.77 -33.44 68.61 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.591 -0.693 . . . . 0.0 110.246 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.7 p -58.26 -48.19 81.2 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.302 -0.874 . . . . 0.0 110.383 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.403 ' O ' ' N ' ' A' ' 69' ' ' GLY . 3.3 t -68.55 -38.65 80.97 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.223 -0.923 . . . . 0.0 110.324 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.16 -31.03 71.63 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.235 -0.916 . . . . 0.0 110.367 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.605 HD21 ' HB2' ' B' ' 23' ' ' ALA . 0.5 OUTLIER -69.25 -43.27 74.31 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.243 -0.911 . . . . 0.0 110.326 -179.823 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.453 ' CZ ' ' HB ' ' A' ' 6' ' ' THR . 29.5 m-85 -91.81 -25.32 19.05 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.185 -0.947 . . . . 0.0 110.236 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.403 ' N ' ' O ' ' A' ' 65' ' ' SER . . . 65.35 109.96 0.01 OUTLIER Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.435 ' O ' ' CB ' ' A' ' 71' ' ' SER . 3.7 tp10 -155.65 49.59 0.53 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.237 -1.155 . . . . 0.0 110.231 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.435 ' CB ' ' O ' ' A' ' 70' ' ' GLU . 0.9 OUTLIER 65.43 105.33 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.171 -0.956 . . . . 0.0 110.183 -179.962 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -61.47 114.49 3.26 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.254 -0.904 . . . . 0.0 110.263 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.59 0 O-C-N 121.255 -0.903 . . . . 0.0 110.251 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.253 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -107.36 -52.3 2.78 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.211 -1.17 . . . . 0.0 110.231 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.418 ' HA ' HG21 ' A' ' 16' ' ' ILE . 8.6 ttpt -58.19 -47.29 83.87 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.183 -0.948 . . . . 0.0 110.101 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.69 -37.8 74.11 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.197 -0.939 . . . . 0.0 110.128 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -63.65 -40.21 96.28 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.183 -0.948 . . . . 0.0 110.217 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 12' ' ' ALA . . . . . 0.59 ' HB2' HD12 ' A' ' 16' ' ' ILE . . . -62.43 -43.07 99.69 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.284 -0.885 . . . . 0.0 110.036 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 87.4 t -62.71 -40.36 88.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.176 -0.952 . . . . 0.0 109.753 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.64 -36.3 82.38 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.421 -0.799 . . . . 0.0 110.182 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 34.8 m -69.85 -40.22 75.92 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.269 -0.894 . . . . 0.0 110.252 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.797 HG11 HD11 ' A' ' 33' ' ' LEU . 57.6 t -69.01 -41.74 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.254 -0.904 . . . . 0.0 110.243 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 18.6 t -60.9 -44.41 97.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.286 -0.884 . . . . 0.0 110.101 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.35 -44.77 93.89 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.235 -0.915 . . . . 0.0 110.197 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.93 -45.76 87.78 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.237 -0.914 . . . . 0.0 110.082 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.57 HG23 ' O ' ' B' ' 16' ' ' VAL . 88.3 t -61.45 -47.23 94.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.349 -0.844 . . . . 0.0 110.16 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.54 ' HA ' ' HD3' ' B' ' 24' ' ' ARG . 15.0 t70 -55.72 -31.89 62.88 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.124 -0.985 . . . . 0.0 109.709 179.718 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -64.35 -36.49 84.3 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.422 -0.799 . . . . 0.0 110.353 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.605 ' HB2' HD21 ' A' ' 67' ' ' LEU . . . -60.33 -40.38 90.42 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.33 -0.856 . . . . 0.0 110.451 -179.623 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 24' ' ' ARG . . . . . 0.54 ' HD3' ' HA ' ' B' ' 21' ' ' ASP . 0.2 OUTLIER -69.89 -47.27 63.19 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.082 -1.011 . . . . 0.0 109.726 179.903 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 55.2 t -52.45 -20.44 2.04 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.433 0 O-C-N 121.572 -0.705 . . . . 0.0 110.442 -179.559 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 2.8 ttp180 -79.36 12.67 2.29 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.361 -0.837 . . . . 0.0 110.996 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 27' ' ' GLU . . . . . 0.448 ' O ' ' N ' ' B' ' 29' ' ' ARG . 34.0 tt0 -102.96 136.68 19.2 Favored Pre-proline 0 N--CA 1.49 1.559 0 O-C-N 121.203 -0.936 . . . . 0.0 109.944 179.658 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 28' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' B' ' 27' ' ' GLU . 32.5 Cg_exo -62.45 79.83 0.1 Allowed 'Trans proline' 0 C--N 1.304 -1.786 0 O-C-N 124.015 1.534 . . . . 0.0 110.308 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 29' ' ' ARG . . . . . 0.448 ' N ' ' O ' ' B' ' 27' ' ' GLU . 9.3 mmm180 . . . . . 0 N--CA 1.491 1.584 0 O-C-N 121.285 -0.884 . . . . 0.0 110.254 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.7 mpp? . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.253 0.549 . . . . 0.0 110.219 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -153.76 93.24 1.64 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.261 -0.9 . . . . 0.0 110.199 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -128.0 -171.23 2.4 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.211 -0.931 . . . . 0.0 110.208 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 44.5 p -115.32 -173.7 2.37 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.266 -0.896 . . . . 0.0 110.16 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.49 ' O ' ' N ' ' A' ' 7' ' ' ALA . 53.4 m-20 -144.51 -49.4 0.27 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.293 -0.88 . . . . 0.0 110.282 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.452 ' CB ' ' O ' ' A' ' 5' ' ' ASP . 1.2 m 66.19 -61.5 0.29 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.27 -0.893 . . . . 0.0 110.171 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.49 ' N ' ' O ' ' A' ' 5' ' ' ASP . . . -62.74 -40.39 97.07 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.267 -0.896 . . . . 0.0 109.264 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -54.31 -34.44 60.96 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.541 -0.724 . . . . 0.0 109.459 179.053 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -60.08 -40.86 91.02 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.428 -0.795 . . . . 0.0 110.213 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.63 HG12 ' HD2' ' A' ' 14' ' ' PHE . 96.3 t -58.16 -42.42 83.2 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.052 -1.03 . . . . 0.0 109.453 179.514 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.528 HG23 ' HE1' ' A' ' 60' ' ' TYR . 75.3 mt -62.42 -49.29 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.394 -0.816 . . . . 0.0 109.368 179.292 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.09 -46.68 87.66 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.425 -0.797 . . . . 0.0 109.259 179.159 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 45.4 m -63.35 -40.41 97.2 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.339 -0.851 . . . . 0.0 109.223 179.204 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.63 ' HD2' HG12 ' A' ' 10' ' ' VAL . 1.6 m-85 -68.5 -41.2 80.38 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.396 -0.815 . . . . 0.0 109.569 179.221 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.18 -45.95 68.73 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.287 -0.883 . . . . 0.0 109.425 179.477 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.423 HG21 ' HA ' ' B' ' 9' ' ' LYS . 9.6 mt -58.24 -44.58 88.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.314 -0.866 . . . . 0.0 109.286 179.361 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.441 HD21 HD12 ' A' ' 33' ' ' LEU . 4.5 mp -64.97 -39.0 92.82 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.374 -0.829 . . . . 0.0 109.796 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.624 ' HB2' ' HB ' ' A' ' 24' ' ' ILE . . . -81.62 9.66 7.3 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.327 -0.858 . . . . 0.0 110.254 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 60.72 50.02 5.84 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.155 -0.966 . . . . 0.0 110.278 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.1 t70 59.38 58.76 2.88 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.334 -0.854 . . . . 0.0 110.43 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.9 mttp -139.68 141.67 28.82 Favored Pre-proline 0 N--CA 1.49 1.541 0 O-C-N 121.299 -0.876 . . . . 0.0 109.9 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -61.64 -11.79 21.97 Favored 'Trans proline' 0 C--N 1.304 -1.778 0 O-C-N 124.076 1.566 . . . . 0.0 109.913 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 43.4 p90 -138.92 167.45 22.0 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.35 -0.844 . . . . 0.0 110.094 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.67 HD13 ' CD2' ' A' ' 29' ' ' LEU . 9.2 tt -144.67 158.78 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.267 -0.896 . . . . 0.0 110.214 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.536 ' CD2' HG21 ' A' ' 54' ' ' VAL . 16.1 mt -88.14 141.36 28.62 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.277 -0.89 . . . . 0.0 110.099 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.556 ' HB2' ' CD1' ' A' ' 58' ' ' LEU . . . -58.57 -33.7 70.24 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.247 -0.908 . . . . 0.0 110.343 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -62.71 -38.81 91.93 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.205 -0.935 . . . . 0.0 110.134 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -58.59 -40.76 84.07 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.215 -0.928 . . . . 0.0 109.489 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.67 ' CD2' HD13 ' A' ' 24' ' ' ILE . 2.1 mm? -59.37 -36.06 75.06 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.319 -0.863 . . . . 0.0 109.6 179.432 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 44.0 mtt180 -69.14 -34.72 75.45 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.381 -0.824 . . . . 0.0 110.506 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.0 ttt180 -87.26 -18.01 31.21 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.289 -0.882 . . . . 0.0 111.032 -179.322 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -101.73 -23.66 14.19 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.98 -1.075 . . . . 0.0 110.967 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.501 ' CD2' ' HB3' ' A' ' 37' ' ' GLN . 0.1 OUTLIER -126.93 164.87 32.39 Favored Pre-proline 0 C--N 1.303 -1.455 0 O-C-N 121.019 -1.05 . . . . 0.0 110.365 -179.805 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.465 ' HD2' HD23 ' A' ' 33' ' ' LEU . 30.9 Cg_exo -58.08 138.57 86.61 Favored 'Trans proline' 0 C--N 1.302 -1.904 0 O-C-N 124.173 1.617 . . . . 0.0 109.882 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.422 ' C ' ' O ' ' A' ' 34' ' ' PRO . 16.0 Cg_exo -40.11 -40.67 2.86 Favored 'Trans proline' 0 C--N 1.303 -1.817 0 O-C-N 124.052 1.554 . . . . 0.0 110.438 -179.643 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.426 ' OD1' ' CD ' ' A' ' 37' ' ' GLN . 1.4 p30 -65.94 -41.77 90.86 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.242 -0.911 . . . . 0.0 110.896 -179.578 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.501 ' HB3' ' CD2' ' A' ' 33' ' ' LEU . 0.4 OUTLIER -69.35 -39.51 78.08 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.021 -1.049 . . . . 0.0 110.763 -179.382 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.628 ' O ' HD12 ' A' ' 42' ' ' ILE . . . -61.32 -43.53 98.71 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.135 -0.978 . . . . 0.0 110.871 -179.481 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -64.22 -47.67 78.81 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.064 -1.023 . . . . 0.0 110.818 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.61 -43.15 97.73 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.126 -0.984 . . . . 0.0 110.511 -179.611 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.447 ' O ' ' HG2' ' A' ' 45' ' ' MET . 72.7 m -65.05 -49.64 69.33 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.257 -0.902 . . . . 0.0 110.579 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.628 HD12 ' O ' ' A' ' 38' ' ' ALA . 27.5 mt -61.44 -17.6 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.156 -0.965 . . . . 0.0 110.279 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -84.64 -19.67 32.55 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.103 -0.998 . . . . 0.0 110.293 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.435 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 5.1 mmt85 -88.99 -69.69 0.69 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.179 -0.95 . . . . 0.0 110.096 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.488 ' HE2' ' CA ' ' A' ' 60' ' ' TYR . 13.7 ptp -45.65 135.35 6.1 Favored Pre-proline 0 N--CA 1.488 1.43 0 O-C-N 121.243 -0.911 . . . . 0.0 110.248 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 45' ' ' MET . 23.0 Cg_exo -85.24 -146.69 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.75 0 O-C-N 123.968 1.509 . . . . 0.0 110.308 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -93.62 131.78 38.58 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.232 -0.917 . . . . 0.0 110.294 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -48.21 -65.94 0.48 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.242 -0.911 . . . . 0.0 110.037 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -133.26 41.87 3.07 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.172 -0.955 . . . . 0.0 110.244 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.88 -174.42 48.9 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.621 -1.391 . . . . 0.0 109.621 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -70.72 62.85 2.33 Favored 'Trans proline' 0 C--N 1.305 -1.76 0 O-C-N 124.047 1.551 . . . . 0.0 110.299 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.468 ' O ' ' O ' ' A' ' 53' ' ' SER . . . -134.3 -48.52 0.09 OUTLIER Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.631 -1.387 . . . . 0.0 109.631 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.468 ' O ' ' O ' ' A' ' 52' ' ' GLY . 1.5 t -56.76 -152.07 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.268 0 O-C-N 121.279 -1.13 . . . . 0.0 110.879 -179.543 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 1.09 HG22 ' HB2' ' A' ' 57' ' ' ALA . 16.9 m -60.88 -168.12 0.02 OUTLIER Pre-proline 0 N--CA 1.491 1.599 0 O-C-N 121.246 -0.909 . . . . 0.0 110.212 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -92.02 34.69 0.26 Allowed 'Trans proline' 0 C--N 1.305 -1.723 0 O-C-N 123.999 1.526 . . . . 0.0 110.367 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.623 ' H ' HG23 ' A' ' 54' ' ' VAL . . . 167.26 38.88 0.02 OUTLIER Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.661 -1.376 . . . . 0.0 109.661 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 1.09 ' HB2' HG22 ' A' ' 54' ' ' VAL . . . -84.53 116.89 23.37 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.246 -1.149 . . . . 0.0 110.091 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.556 ' CD1' ' HB2' ' A' ' 26' ' ' ALA . 1.5 mt -119.42 159.93 23.28 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.21 -0.931 . . . . 0.0 110.337 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.439 ' O ' ' HB2' ' A' ' 45' ' ' MET . 3.4 m-20 -114.44 113.58 24.68 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.29 -0.881 . . . . 0.0 110.047 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.528 ' HE1' HG23 ' A' ' 11' ' ' ILE . 18.7 p90 -77.7 -22.08 51.02 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.247 -0.908 . . . . 0.0 110.205 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.446 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.26 -36.54 68.68 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.244 -0.91 . . . . 0.0 109.958 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.02 -34.68 76.96 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.277 -0.889 . . . . 0.0 109.865 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.451 ' O ' ' HB2' ' A' ' 67' ' ' LEU . 3.3 t80 -72.06 -29.2 63.9 Favored 'General case' 0 C--N 1.298 -1.674 0 O-C-N 121.578 -0.701 . . . . 0.0 109.938 179.579 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.2 p -65.39 -46.73 78.93 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.355 -0.841 . . . . 0.0 110.115 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 47.5 m -66.36 -43.82 84.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.338 -0.851 . . . . 0.0 109.994 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.95 -31.91 73.38 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.341 -0.849 . . . . 0.0 110.154 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.861 HD21 ' HB2' ' B' ' 23' ' ' ALA . 0.5 OUTLIER -63.4 -41.06 98.73 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.215 -0.928 . . . . 0.0 110.248 -179.966 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.424 ' OH ' HG22 ' A' ' 6' ' ' THR . 35.0 m-85 -97.19 -9.1 28.46 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.289 -0.882 . . . . 0.0 110.369 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -155.25 91.67 0.12 Allowed Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -83.6 91.41 7.43 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.335 -1.097 . . . . 0.0 110.3 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.1 p -148.0 -42.94 0.16 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.257 -0.902 . . . . 0.0 110.147 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.91 140.7 29.17 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.211 -0.931 . . . . 0.0 110.2 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.797 HD22 ' C ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 O-C-N 121.157 -0.964 . . . . 0.0 110.458 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.303 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 8.2 mmtt -96.76 -52.64 3.83 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.298 -1.119 . . . . 0.0 110.295 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.423 ' HA ' HG21 ' A' ' 16' ' ' ILE . 3.0 tttt -63.67 -33.51 75.79 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.271 -0.893 . . . . 0.0 110.213 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.53 -42.73 99.71 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.258 -0.901 . . . . 0.0 110.14 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -61.16 -41.03 96.04 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.214 -0.929 . . . . 0.0 110.085 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.51 -45.21 91.72 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.287 -0.883 . . . . 0.0 110.189 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.465 HG13 ' HG ' ' A' ' 33' ' ' LEU . 71.3 t -60.82 -42.47 92.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.297 -0.877 . . . . 0.0 110.207 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.1 -38.71 80.16 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.249 -0.907 . . . . 0.0 110.182 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 65.3 m -66.49 -38.51 87.44 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.27 -0.894 . . . . 0.0 110.075 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.925 ' O ' HG23 ' B' ' 20' ' ' VAL . 74.0 t -69.91 -46.48 73.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.332 -0.855 . . . . 0.0 110.18 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 80.2 t -58.35 -46.55 89.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.278 -0.889 . . . . 0.0 110.093 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.34 -43.68 98.26 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.268 -0.895 . . . . 0.0 110.071 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.02 -45.63 84.71 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.277 -0.89 . . . . 0.0 110.174 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.925 HG23 ' O ' ' B' ' 16' ' ' VAL . 43.2 t -59.21 -45.32 92.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.328 -0.858 . . . . 0.0 110.165 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.902 ' O ' HG23 ' B' ' 25' ' ' VAL . 12.8 t70 -60.52 -32.92 71.93 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.274 -0.891 . . . . 0.0 110.238 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -66.82 -40.82 88.16 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.206 -0.934 . . . . 0.0 110.478 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.861 ' HB2' HD21 ' A' ' 67' ' ' LEU . . . -65.98 -42.65 89.56 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.247 -0.908 . . . . 0.0 110.961 -179.451 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 24' ' ' ARG . . . . . 0.571 ' HG3' ' N ' ' B' ' 25' ' ' VAL . 3.0 ptp180 -69.76 -31.3 69.18 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.048 -1.032 . . . . 0.0 110.76 -179.505 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 25' ' ' VAL . . . . . 0.902 HG23 ' O ' ' B' ' 21' ' ' ASP . 84.7 t -67.37 -25.16 32.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 120.852 -1.155 . . . . 0.0 109.995 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -106.6 18.96 21.19 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.589 -0.694 . . . . 0.0 109.724 179.674 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -103.59 128.92 26.38 Favored Pre-proline 0 N--CA 1.491 1.592 0 O-C-N 121.433 -0.792 . . . . 0.0 110.161 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -76.77 67.99 7.24 Favored 'Trans proline' 0 C--N 1.304 -1.773 0 O-C-N 124.104 1.581 . . . . 0.0 110.26 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? . . . . . 0 N--CA 1.492 1.633 0 O-C-N 121.258 -0.901 . . . . 0.0 110.112 179.978 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.272 0.558 . . . . 0.0 110.31 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -94.61 177.21 6.0 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.273 -0.892 . . . . 0.0 110.157 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.454 ' O ' ' O ' ' A' ' 4' ' ' THR . 1.8 m-20 -160.38 -38.2 0.05 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.281 -0.887 . . . . 0.0 110.179 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.454 ' O ' ' O ' ' A' ' 3' ' ' ASP . 0.5 OUTLIER 49.06 98.65 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.265 -0.897 . . . . 0.0 110.228 179.983 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.536 ' HB3' ' CB ' ' A' ' 8' ' ' GLU . 0.4 OUTLIER -163.73 144.39 8.75 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.194 -0.941 . . . . 0.0 110.253 -179.892 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.1 m -44.76 -62.85 1.06 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.198 -0.939 . . . . 0.0 110.213 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.82 -44.53 85.34 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.22 -0.925 . . . . 0.0 109.582 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.536 ' CB ' ' HB3' ' A' ' 5' ' ' ASP . 29.1 tp10 -54.56 -35.93 63.81 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.384 -0.822 . . . . 0.0 109.889 179.396 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -60.91 -43.02 99.16 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.376 -0.828 . . . . 0.0 110.26 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.486 HG12 ' HD2' ' A' ' 14' ' ' PHE . 45.0 t -59.98 -49.76 82.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.148 -0.97 . . . . 0.0 109.915 179.653 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 46.2 mt -55.08 -49.15 74.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.322 -0.861 . . . . 0.0 109.44 179.598 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.29 -43.26 83.02 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.297 -0.877 . . . . 0.0 109.096 179.123 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.2 m -66.7 -38.92 87.72 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.374 -0.829 . . . . 0.0 109.308 179.162 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.596 ' HB3' ' CE1' ' A' ' 60' ' ' TYR . 1.2 m-85 -67.83 -40.79 83.71 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.311 -0.868 . . . . 0.0 109.412 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -55.47 -48.9 73.8 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.315 -0.865 . . . . 0.0 109.526 179.284 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 37.7 mt -57.99 -42.2 82.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.391 -0.818 . . . . 0.0 109.917 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.505 ' CD1' ' HB3' ' A' ' 32' ' ' GLU . 2.7 mm? -65.09 -41.63 94.81 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.337 -0.852 . . . . 0.0 110.074 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.796 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -78.76 0.24 27.65 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.41 -0.806 . . . . 0.0 110.151 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.493 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 68.65 60.43 0.37 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.332 -0.855 . . . . 0.0 110.502 179.801 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.9 t70 59.04 52.34 6.38 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.202 -0.936 . . . . 0.0 110.42 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.5 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 32.8 mmtt -134.64 143.1 45.1 Favored Pre-proline 0 N--CA 1.489 1.503 0 O-C-N 121.198 -0.939 . . . . 0.0 110.07 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_endo -72.49 -1.68 10.62 Favored 'Trans proline' 0 C--N 1.305 -1.722 0 O-C-N 124.032 1.543 . . . . 0.0 109.988 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 46.9 p90 -143.92 164.38 30.73 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.276 -0.89 . . . . 0.0 110.142 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.796 HG12 ' HB2' ' A' ' 18' ' ' ALA . 0.4 OUTLIER -129.08 149.44 33.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.211 -0.931 . . . . 0.0 110.034 -179.816 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.671 ' H ' HD13 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -91.68 143.95 26.02 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.225 -0.922 . . . . 0.0 110.205 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.47 -45.44 84.81 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.29 -0.881 . . . . 0.0 110.268 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -59.42 -36.0 75.05 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.323 -0.861 . . . . 0.0 110.395 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.425 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 4.7 tt0 -65.17 -42.82 93.3 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.298 -0.876 . . . . 0.0 110.166 -179.775 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.58 HD11 HG21 ' A' ' 24' ' ' ILE . 25.3 mt -64.01 -35.7 81.58 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.201 -0.937 . . . . 0.0 109.914 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.4 ttm-85 -67.99 -34.8 77.23 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.417 -0.802 . . . . 0.0 110.104 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 22.7 ttt-85 -90.84 -26.21 19.51 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.346 -0.846 . . . . 0.0 110.661 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.505 ' HB3' ' CD1' ' A' ' 17' ' ' LEU . 3.5 mm-40 -92.33 -23.58 19.21 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.226 -0.921 . . . . 0.0 111.235 -179.157 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.679 HD22 ' HB3' ' A' ' 37' ' ' GLN . 0.3 OUTLIER -124.26 164.78 27.88 Favored Pre-proline 0 N--CA 1.49 1.563 0 O-C-N 120.899 -1.126 . . . . 0.0 110.526 -179.562 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.662 ' HD2' HD23 ' A' ' 33' ' ' LEU . 34.3 Cg_exo -63.44 145.46 92.37 Favored 'Trans proline' 0 C--N 1.307 -1.652 0 O-C-N 124.072 1.564 . . . . 0.0 110.178 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -43.87 -35.75 7.32 Favored 'Trans proline' 0 C--N 1.302 -1.876 0 O-C-N 124.081 1.569 . . . . 0.0 110.472 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.97 -47.38 74.79 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.089 -1.007 . . . . 0.0 110.725 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.73 ' HG2' HG22 ' B' ' 17' ' ' VAL . 1.4 mp0 -69.81 -42.96 72.99 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.112 -0.993 . . . . 0.0 110.455 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.466 ' O ' ' CG1' ' A' ' 42' ' ' ILE . . . -56.64 -44.13 80.96 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.248 -0.908 . . . . 0.0 110.476 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -63.38 -49.12 75.1 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.185 -0.947 . . . . 0.0 110.321 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -66.44 -47.93 71.59 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.232 -0.918 . . . . 0.0 110.2 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.403 ' SG ' HG21 ' B' ' 20' ' ' VAL . 71.1 m -63.95 -43.6 95.36 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.207 -0.933 . . . . 0.0 110.147 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.466 ' CG1' ' O ' ' A' ' 38' ' ' ALA . 48.6 mt -61.4 -24.01 32.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.246 -0.908 . . . . 0.0 109.998 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.62 -41.94 15.87 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.212 -0.93 . . . . 0.0 110.224 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.593 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 2.4 mmp_? -66.99 -64.3 0.88 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.193 -0.942 . . . . 0.0 110.106 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.623 ' HE1' ' HB3' ' A' ' 60' ' ' TYR . 1.9 ttm -36.04 101.59 0.22 Allowed Pre-proline 0 N--CA 1.494 1.743 0 O-C-N 121.581 -0.699 . . . . 0.0 111.029 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.434 ' HD3' ' O ' ' A' ' 44' ' ' ARG . 12.7 Cg_endo -68.37 -166.01 0.14 Allowed 'Trans proline' 0 C--N 1.305 -1.746 0 O-C-N 124.0 1.526 . . . . 0.0 109.781 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -81.82 136.37 35.39 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.161 -0.962 . . . . 0.0 110.093 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -85.36 -8.24 58.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.245 -0.909 . . . . 0.0 110.258 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 178.35 177.14 0.45 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.258 -0.902 . . . . 0.0 110.212 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -128.18 -61.23 0.12 Allowed Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -83.9 -4.36 10.54 Favored 'Trans proline' 0 C--N 1.305 -1.757 0 O-C-N 124.128 1.594 . . . . 0.0 110.2 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.457 ' O ' ' HB3' ' A' ' 53' ' ' SER . . . -124.47 -155.98 9.3 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.62 ' OG ' ' HB3' ' A' ' 57' ' ' ALA . 9.0 t 56.6 -177.72 0.05 Allowed 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.318 -1.107 . . . . 0.0 110.197 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.634 HG22 ' HB2' ' A' ' 57' ' ' ALA . 17.2 m -108.58 176.4 1.6 Allowed Pre-proline 0 C--N 1.295 -1.781 0 O-C-N 121.667 -0.645 . . . . 0.0 110.154 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_exo -77.01 65.48 7.78 Favored 'Trans proline' 0 C--N 1.305 -1.711 0 O-C-N 123.963 1.507 . . . . 0.0 110.46 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 150.19 41.09 0.03 OUTLIER Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.769 -1.332 . . . . 0.0 109.769 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.634 ' HB2' HG22 ' A' ' 54' ' ' VAL . . . -120.87 120.05 34.42 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.164 -1.197 . . . . 0.0 110.15 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.431 ' HB3' ' HG2' ' A' ' 45' ' ' MET . 58.3 mt -122.11 156.75 32.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.253 -0.904 . . . . 0.0 110.159 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.509 ' OD1' ' HB3' ' A' ' 61' ' ' ALA . 7.3 t70 -103.91 110.98 23.32 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.135 -0.978 . . . . 0.0 110.583 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.623 ' HB3' ' HE1' ' A' ' 45' ' ' MET . 20.5 p90 -71.36 -25.93 62.59 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.208 -0.933 . . . . 0.0 109.09 179.073 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.581 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.16 -41.48 75.49 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.493 -0.755 . . . . 0.0 109.563 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.471 ' HB2' ' OD2' ' A' ' 59' ' ' ASP . . . -62.1 -37.5 85.3 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.301 -0.875 . . . . 0.0 109.611 179.378 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.593 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 2.6 t80 -71.87 -38.87 69.96 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.643 -0.661 . . . . 0.0 110.008 179.561 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.7 p -60.11 -47.13 87.18 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.339 -0.851 . . . . 0.0 110.294 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.427 ' C ' ' HB3' ' A' ' 70' ' ' GLU . 0.2 OUTLIER -65.41 -35.73 81.8 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.328 -0.858 . . . . 0.0 110.227 -179.814 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.01 -32.74 59.54 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.289 -0.882 . . . . 0.0 110.179 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.775 HD21 ' HB2' ' B' ' 23' ' ' ALA . 0.4 OUTLIER -55.16 -38.0 67.72 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.204 -0.935 . . . . 0.0 110.278 179.962 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -95.22 -35.18 11.94 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.197 -0.939 . . . . 0.0 110.357 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 157.01 96.58 0.12 Allowed Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.454 ' CD ' ' N ' ' A' ' 71' ' ' SER . 12.4 tm-20 -174.73 160.13 2.93 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.262 -1.14 . . . . 0.0 110.205 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.454 ' N ' ' CD ' ' A' ' 70' ' ' GLU . 81.5 p -146.47 90.95 1.98 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.223 -0.923 . . . . 0.0 110.242 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -68.41 141.85 55.57 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.221 -0.925 . . . . 0.0 110.16 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.489 ' CD1' ' O ' ' A' ' 73' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 O-C-N 121.381 -0.824 . . . . 0.0 110.201 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.239 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.07 -20.27 63.23 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.275 -1.133 . . . . 0.0 110.261 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.727 ' O ' HG23 ' B' ' 13' ' ' VAL . 7.5 ttmt -68.14 -33.14 73.94 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.246 -0.909 . . . . 0.0 110.188 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.7 96.96 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.255 -0.903 . . . . 0.0 110.072 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -63.5 -40.48 97.18 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.201 -0.937 . . . . 0.0 110.03 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 12' ' ' ALA . . . . . 0.606 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -66.7 -43.53 84.12 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.285 -0.885 . . . . 0.0 110.032 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.727 HG23 ' O ' ' B' ' 9' ' ' LYS . 59.3 t -63.08 -44.14 99.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.433 -0.792 . . . . 0.0 110.108 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.05 -41.61 92.68 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.268 -0.895 . . . . 0.0 109.921 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 99.9 m -62.6 -42.91 99.85 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.211 -0.931 . . . . 0.0 109.932 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.671 ' O ' HG23 ' B' ' 20' ' ' VAL . 56.7 t -65.17 -45.34 94.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.389 -0.819 . . . . 0.0 109.974 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.73 HG22 ' HG2' ' A' ' 37' ' ' GLN . 76.1 t -60.28 -47.01 94.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.302 -0.874 . . . . 0.0 109.883 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.3 -42.83 82.5 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.288 -0.882 . . . . 0.0 110.04 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.25 -40.63 86.27 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.348 -0.845 . . . . 0.0 109.859 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.671 HG23 ' O ' ' B' ' 16' ' ' VAL . 98.6 t -64.9 -47.28 88.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.308 -0.87 . . . . 0.0 110.113 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 54.2 t0 -64.9 -32.51 74.26 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.262 -0.899 . . . . 0.0 110.087 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 22' ' ' GLN . . . . . 0.578 ' O ' HG12 ' B' ' 25' ' ' VAL . 2.8 tp-100 -58.21 -48.32 80.71 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.233 -0.917 . . . . 0.0 110.123 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.775 ' HB2' HD21 ' A' ' 67' ' ' LEU . . . -60.92 -38.89 87.36 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.318 -0.864 . . . . 0.0 110.37 -179.817 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -68.22 -32.3 72.42 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.169 -0.957 . . . . 0.0 110.318 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 25' ' ' VAL . . . . . 0.578 HG12 ' O ' ' B' ' 22' ' ' GLN . 0.3 OUTLIER -65.35 -20.55 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.293 -0.88 . . . . 0.0 110.281 -179.834 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 62.9 mtp85 -83.82 28.06 0.61 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.417 -0.802 . . . . 0.0 110.788 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.57 138.94 20.38 Favored Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 120.989 -1.069 . . . . 0.0 110.226 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -63.87 92.34 0.17 Allowed 'Trans proline' 0 C--N 1.306 -1.7 0 O-C-N 123.943 1.496 . . . . 0.0 110.369 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.657 0 O-C-N 121.262 -0.899 . . . . 0.0 110.212 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 mtp . . . . . 0 N--CA 1.491 1.625 0 CA-C-O 121.225 0.535 . . . . 0.0 110.204 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -123.04 46.77 2.1 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.249 -0.907 . . . . 0.0 110.207 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.487 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 20.1 p-10 -152.62 98.6 2.38 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.223 -0.923 . . . . 0.0 110.197 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 10.2 t -166.96 -170.13 1.47 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.203 -0.936 . . . . 0.0 110.301 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 48.32 -172.18 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.248 -0.907 . . . . 0.0 110.224 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.2 p -113.69 -53.56 2.68 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.239 -0.913 . . . . 0.0 110.17 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.73 -48.83 73.16 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.208 -0.932 . . . . 0.0 109.874 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.689 ' HA ' HD12 ' A' ' 11' ' ' ILE . 0.9 OUTLIER -54.75 -36.16 64.52 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.402 -0.811 . . . . 0.0 110.055 179.643 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -61.19 -43.98 98.02 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.272 -0.892 . . . . 0.0 110.226 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.541 HG12 ' HD2' ' A' ' 14' ' ' PHE . 73.2 t -58.07 -45.64 88.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.14 -0.975 . . . . 0.0 109.686 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.689 HD12 ' HA ' ' A' ' 8' ' ' GLU . 36.8 mt -58.05 -47.2 87.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.404 -0.81 . . . . 0.0 109.335 179.389 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.56 -44.01 84.92 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.324 -0.86 . . . . 0.0 108.907 179.104 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.515 ' HA ' ' HB1' ' B' ' 12' ' ' ALA . 46.5 m -65.23 -40.13 93.66 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.373 -0.829 . . . . 0.0 108.976 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.541 ' HD2' HG12 ' A' ' 10' ' ' VAL . 3.1 m-85 -68.53 -41.34 80.05 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.432 -0.793 . . . . 0.0 109.509 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.0 ttt180 -53.5 -45.37 69.64 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.39 -0.819 . . . . 0.0 109.547 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.489 HD12 ' HB2' ' B' ' 12' ' ' ALA . 56.0 mt -61.53 -42.98 96.07 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 O-C-N 121.285 -0.884 . . . . 0.0 109.784 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.418 HD11 HG22 ' B' ' 13' ' ' VAL . 2.7 mp -63.68 -40.47 96.9 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.34 -0.85 . . . . 0.0 109.9 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.433 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -79.53 4.72 14.93 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.377 -0.827 . . . . 0.0 110.218 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.433 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.4 OUTLIER 65.21 58.91 0.85 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.219 -0.926 . . . . 0.0 110.243 -179.986 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 54.51 63.99 1.97 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.263 -0.898 . . . . 0.0 110.345 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.1 mttp -144.86 143.12 19.87 Favored Pre-proline 0 N--CA 1.49 1.542 0 O-C-N 121.266 -0.896 . . . . 0.0 110.007 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -69.89 -4.41 14.05 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 O-C-N 124.037 1.546 . . . . 0.0 110.082 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 50.1 p90 -138.66 165.39 27.04 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.276 -0.89 . . . . 0.0 109.873 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.621 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -139.86 138.53 38.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.165 -0.959 . . . . 0.0 110.277 -179.773 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.646 HD23 ' HB2' ' A' ' 27' ' ' GLU . 5.4 tp -80.3 147.98 30.92 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.281 -0.887 . . . . 0.0 109.911 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.648 ' HB1' ' CD1' ' A' ' 42' ' ' ILE . . . -62.05 -26.85 68.5 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.233 -0.917 . . . . 0.0 110.143 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.646 ' HB2' HD23 ' A' ' 25' ' ' LEU . 4.9 mp0 -70.56 -36.21 73.51 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.334 -0.854 . . . . 0.0 110.318 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.503 ' HB2' HD11 ' A' ' 24' ' ' ILE . 10.6 mt-10 -67.91 -50.18 57.66 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.232 -0.917 . . . . 0.0 110.254 -179.623 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.745 HD12 ' C ' ' A' ' 29' ' ' LEU . 1.2 pp -66.54 -33.81 76.5 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.196 -0.94 . . . . 0.0 109.703 179.787 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.572 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -62.37 -35.73 80.05 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.36 -0.838 . . . . 0.0 109.977 179.908 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.82 -8.53 30.82 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.416 -0.802 . . . . 0.0 110.472 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -98.38 -23.27 15.67 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.1 -1.0 . . . . 0.0 110.673 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.729 HD11 HG11 ' B' ' 16' ' ' VAL . 2.9 mt -120.07 155.77 55.27 Favored Pre-proline 0 N--CA 1.488 1.453 0 O-C-N 121.159 -0.963 . . . . 0.0 110.464 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.492 ' HD2' HD23 ' A' ' 33' ' ' LEU . 51.4 Cg_exo -54.92 144.06 69.22 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 O-C-N 124.022 1.538 . . . . 0.0 110.271 179.702 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.409 ' C ' ' O ' ' A' ' 34' ' ' PRO . 26.5 Cg_endo -39.81 -42.41 3.04 Favored 'Trans proline' 0 C--N 1.304 -1.788 0 O-C-N 124.104 1.581 . . . . 0.0 110.59 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.07 -46.88 76.15 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.293 -0.88 . . . . 0.0 111.102 -179.433 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.827 ' NE2' HG13 ' B' ' 17' ' ' VAL . 33.3 mm-40 -69.53 -41.42 76.01 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.021 -1.05 . . . . 0.0 110.741 -179.291 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.572 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -56.08 -42.01 76.02 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.165 -0.96 . . . . 0.0 110.678 -179.513 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -60.11 -47.9 83.97 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.11 -0.994 . . . . 0.0 110.743 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -58.56 -44.23 89.65 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.189 -0.945 . . . . 0.0 110.559 -179.629 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 72.0 m -65.26 -42.54 93.14 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.173 -0.954 . . . . 0.0 110.358 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.648 ' CD1' ' HB1' ' A' ' 26' ' ' ALA . 1.1 mm -67.67 -21.64 27.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 O-C-N 121.259 -0.901 . . . . 0.0 110.474 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.81 -30.28 28.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.272 -0.892 . . . . 0.0 111.068 -179.303 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.553 ' HG2' ' CE1' ' A' ' 63' ' ' PHE . 1.1 mpt_? -94.32 -64.14 1.11 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.982 -1.074 . . . . 0.0 111.082 -179.229 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.562 ' CE ' ' HB3' ' A' ' 60' ' ' TYR . 5.5 ttm -30.0 112.15 0.29 Allowed Pre-proline 0 N--CA 1.497 1.886 0 O-C-N 121.796 -0.565 . . . . 0.0 111.305 -179.615 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.484 ' O ' HD23 ' A' ' 58' ' ' LEU . 18.9 Cg_endo -81.77 -158.17 0.09 OUTLIER 'Trans proline' 0 C--N 1.308 -1.595 0 O-C-N 124.232 1.648 . . . . 0.0 110.395 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -79.23 143.04 35.71 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.174 -0.954 . . . . 0.0 110.314 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.613 ' CE2' ' HB2' ' A' ' 53' ' ' SER . 0.6 OUTLIER -58.77 -32.49 69.33 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.247 -0.908 . . . . 0.0 110.163 179.992 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 176.45 -49.5 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.155 -0.966 . . . . 0.0 110.189 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.429 ' HA3' ' HD3' ' A' ' 51' ' ' PRO . . . 152.29 -109.28 0.41 Allowed Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.357 -1.497 . . . . 0.0 109.357 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.429 ' HD3' ' HA3' ' A' ' 50' ' ' GLY . 6.4 Cg_exo -67.7 -14.5 42.04 Favored 'Trans proline' 0 C--N 1.307 -1.637 0 O-C-N 123.906 1.477 . . . . 0.0 109.958 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.428 ' O ' ' C ' ' A' ' 53' ' ' SER . . . -64.23 168.29 25.62 Favored Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.613 ' HB2' ' CE2' ' A' ' 48' ' ' TYR . 9.1 t 40.68 -142.52 0.06 Allowed 'General case' 0 C--N 1.306 -1.316 0 O-C-N 121.448 -1.03 . . . . 0.0 110.301 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 21.5 m -124.73 179.49 1.09 Allowed Pre-proline 0 C--N 1.294 -1.816 0 O-C-N 121.741 -0.6 . . . . 0.0 110.12 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -71.31 108.68 2.41 Favored 'Trans proline' 0 C--N 1.305 -1.747 0 O-C-N 123.915 1.482 . . . . 0.0 110.362 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 131.39 -20.68 4.65 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.444 -1.462 . . . . 0.0 109.444 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.34 126.06 26.2 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.243 -1.151 . . . . 0.0 110.251 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.484 HD23 ' O ' ' A' ' 46' ' ' PRO . 1.4 mt -124.17 160.33 28.1 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.322 -0.861 . . . . 0.0 110.054 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.472 ' C ' ' HG3' ' A' ' 45' ' ' MET . 2.1 m-20 -113.91 112.03 22.68 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.144 -0.973 . . . . 0.0 110.694 -179.713 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.562 ' HB3' ' CE ' ' A' ' 45' ' ' MET . 14.2 p90 -73.67 -21.16 60.35 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.402 -0.811 . . . . 0.0 109.784 179.67 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.533 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.64 -36.73 67.34 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.36 -0.838 . . . . 0.0 109.466 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.45 -36.37 78.91 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.352 -0.842 . . . . 0.0 109.424 179.271 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.553 ' CE1' ' HG2' ' A' ' 44' ' ' ARG . 6.5 t80 -71.83 -35.42 69.9 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.787 -0.571 . . . . 0.0 110.06 179.612 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 32.1 t -58.35 -47.51 83.54 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.249 -0.907 . . . . 0.0 109.974 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 11.2 m -62.62 -36.9 84.26 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.197 -0.939 . . . . 0.0 109.901 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.487 ' HA ' ' O ' ' A' ' 69' ' ' GLY . . . -60.63 -37.84 82.78 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.261 -0.899 . . . . 0.0 109.959 179.779 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.96 -42.7 90.52 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.27 -0.894 . . . . 0.0 110.123 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -98.61 4.98 48.11 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.204 -0.935 . . . . 0.0 110.27 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.487 ' O ' ' HA ' ' A' ' 66' ' ' ALA . . . -174.43 98.81 0.13 Allowed Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -111.94 106.44 15.14 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.26 -1.141 . . . . 0.0 110.282 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 43.7 t -121.45 166.56 13.95 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.298 -0.876 . . . . 0.0 109.994 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -105.26 140.23 38.72 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.242 -0.912 . . . . 0.0 110.238 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.2 pp . . . . . 0 N--CA 1.491 1.62 0 O-C-N 121.247 -0.908 . . . . 0.0 110.211 179.979 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.279 0 N-CA-C 109.569 -1.413 . . . . 0.0 109.569 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 31.7 mttp -89.45 -37.41 14.81 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.232 -1.158 . . . . 0.0 110.131 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.463 ' O ' HG23 ' B' ' 13' ' ' VAL . 5.4 ttpt -57.95 -49.48 76.64 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.245 -0.909 . . . . 0.0 110.121 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.88 -38.27 78.44 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.322 -0.861 . . . . 0.0 110.116 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -64.85 -40.71 95.59 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.25 -0.906 . . . . 0.0 110.102 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 12' ' ' ALA . . . . . 0.515 ' HB1' ' HA ' ' A' ' 13' ' ' SER . . . -66.43 -41.9 88.48 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.251 -0.906 . . . . 0.0 110.136 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.463 HG23 ' O ' ' B' ' 9' ' ' LYS . 93.2 t -61.4 -42.18 92.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.204 -0.935 . . . . 0.0 110.135 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.75 -40.87 96.65 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.262 -0.899 . . . . 0.0 110.172 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 14.6 m -62.79 -48.91 77.1 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.272 -0.892 . . . . 0.0 110.082 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.729 HG11 HD11 ' A' ' 33' ' ' LEU . 80.4 t -60.38 -47.23 93.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.25 -0.906 . . . . 0.0 110.084 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.827 HG13 ' NE2' ' A' ' 37' ' ' GLN . 58.2 t -60.58 -48.26 89.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.25 -0.906 . . . . 0.0 110.119 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.2 -44.09 92.25 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.224 -0.922 . . . . 0.0 109.943 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.23 -44.87 78.42 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.361 -0.837 . . . . 0.0 109.934 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.597 HG23 ' O ' ' B' ' 16' ' ' VAL . 99.5 t -67.26 -43.58 88.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.248 -0.907 . . . . 0.0 110.107 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.446 ' O ' HG23 ' B' ' 25' ' ' VAL . 17.2 t70 -57.57 -35.8 70.84 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.282 -0.886 . . . . 0.0 110.116 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -55.03 -45.17 75.17 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.295 -0.878 . . . . 0.0 110.106 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.86 -37.32 85.85 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.347 -0.845 . . . . 0.0 110.192 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -61.12 -41.98 97.7 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.281 -0.887 . . . . 0.0 110.108 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 25' ' ' VAL . . . . . 0.446 HG23 ' O ' ' B' ' 21' ' ' ASP . 72.4 t -56.49 -21.34 12.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.265 -0.897 . . . . 0.0 110.078 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -113.71 30.03 7.55 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.475 -0.765 . . . . 0.0 110.094 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 27' ' ' GLU . . . . . 0.445 ' HA ' ' HD3' ' B' ' 28' ' ' PRO . 24.5 pt-20 -73.13 148.75 89.1 Favored Pre-proline 0 N--CA 1.49 1.567 0 O-C-N 121.287 -0.883 . . . . 0.0 110.145 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 28' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' B' ' 27' ' ' GLU . 24.2 Cg_exo -62.23 -18.88 64.71 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 O-C-N 123.979 1.515 . . . . 0.0 110.074 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 3.1 mmt85 . . . . . 0 N--CA 1.491 1.583 0 O-C-N 121.314 -0.866 . . . . 0.0 110.161 179.991 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.4 ptp . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.221 0.534 . . . . 0.0 110.218 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -140.41 23.14 2.35 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.174 -0.954 . . . . 0.0 110.258 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -128.23 -31.9 2.29 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.243 -0.911 . . . . 0.0 110.185 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 50.89 68.18 0.82 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.276 -0.89 . . . . 0.0 110.182 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.5 ' O ' ' N ' ' A' ' 7' ' ' ALA . 62.8 m-20 -93.52 -9.97 36.47 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.335 -0.853 . . . . 0.0 110.19 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.446 ' CB ' ' O ' ' A' ' 5' ' ' ASP . 1.3 m 67.21 -57.61 0.43 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.225 -0.922 . . . . 0.0 110.264 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.5 ' N ' ' O ' ' A' ' 5' ' ' ASP . . . -60.99 -46.89 88.91 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.271 -0.893 . . . . 0.0 109.843 179.795 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.846 ' HA ' HD12 ' A' ' 11' ' ' ILE . 1.8 tt0 -54.28 -36.56 63.77 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.308 -0.87 . . . . 0.0 109.536 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 10.5 tp60 -62.44 -46.34 88.97 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.328 -0.858 . . . . 0.0 109.949 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.58 HG12 ' CD2' ' A' ' 14' ' ' PHE . 38.4 t -58.7 -41.48 82.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.342 -0.849 . . . . 0.0 109.963 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.846 HD12 ' HA ' ' A' ' 8' ' ' GLU . 51.0 mt -57.92 -49.58 80.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.328 -0.858 . . . . 0.0 109.427 179.531 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.91 -38.33 75.66 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 119.573 -0.851 . . . . 0.0 108.873 178.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.1 m -68.0 -40.55 83.0 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.486 -0.759 . . . . 0.0 109.294 179.048 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.58 ' CD2' HG12 ' A' ' 10' ' ' VAL . 4.1 m-85 -68.23 -41.35 81.36 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.303 -0.873 . . . . 0.0 109.649 179.467 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -54.43 -44.82 72.77 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.284 -0.885 . . . . 0.0 109.452 179.36 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.415 HG21 ' HA ' ' B' ' 9' ' ' LYS . 46.4 mt -62.22 -40.97 89.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.343 -0.848 . . . . 0.0 109.83 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.407 HD13 ' HA ' ' A' ' 17' ' ' LEU . 2.9 mm? -64.74 -41.69 95.74 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.218 -0.926 . . . . 0.0 109.829 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.7 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -81.76 4.24 22.77 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.323 -0.86 . . . . 0.0 110.201 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.456 ' HB3' ' O ' ' A' ' 18' ' ' ALA . 4.9 t 65.09 64.45 0.63 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.199 -0.938 . . . . 0.0 110.278 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 54.94 60.12 3.66 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.267 -0.896 . . . . 0.0 110.368 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.573 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 18.1 mttm -141.66 142.95 27.44 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.3 -0.875 . . . . 0.0 110.01 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -76.07 2.69 6.86 Favored 'Trans proline' 0 C--N 1.304 -1.803 0 O-C-N 124.147 1.604 . . . . 0.0 110.178 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.573 ' CZ ' ' HD3' ' A' ' 21' ' ' LYS . 32.9 p90 -143.7 155.08 44.09 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.307 -0.871 . . . . 0.0 110.107 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.832 HD12 HD23 ' A' ' 29' ' ' LEU . 0.4 OUTLIER -129.18 147.88 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.268 -0.895 . . . . 0.0 110.016 -179.871 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.765 ' H ' HD13 ' A' ' 24' ' ' ILE . 8.0 mp -92.14 146.37 23.78 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.134 -0.979 . . . . 0.0 110.431 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.14 -43.02 99.53 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.345 -0.847 . . . . 0.0 110.304 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -56.28 -39.6 72.92 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.252 -0.905 . . . . 0.0 109.834 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.45 ' HG3' ' OE1' ' A' ' 32' ' ' GLU . 0.7 OUTLIER -63.66 -45.44 90.17 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.427 -0.796 . . . . 0.0 109.523 179.724 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.832 HD23 HD12 ' A' ' 24' ' ' ILE . 3.1 mm? -58.32 -34.29 70.43 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.392 -0.818 . . . . 0.0 109.72 179.633 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 28.1 mtp180 -69.1 -34.78 75.64 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.354 -0.842 . . . . 0.0 110.652 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 10.1 ttt180 -93.88 -25.57 17.26 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.127 -0.983 . . . . 0.0 111.085 -179.176 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.45 ' OE1' ' HG3' ' A' ' 28' ' ' GLU . 2.7 mp0 -90.91 -23.34 20.52 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.0 -1.063 . . . . 0.0 111.197 -179.162 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.783 HD23 ' HD2' ' A' ' 34' ' ' PRO . 0.3 OUTLIER -128.61 160.86 60.59 Favored Pre-proline 0 N--CA 1.489 1.492 0 O-C-N 120.94 -1.1 . . . . 0.0 110.559 -179.606 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.783 ' HD2' HD23 ' A' ' 33' ' ' LEU . 28.0 Cg_exo -58.77 144.12 98.49 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 O-C-N 124.035 1.545 . . . . 0.0 110.241 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -46.64 -30.6 9.12 Favored 'Trans proline' 0 C--N 1.304 -1.78 0 O-C-N 124.093 1.575 . . . . 0.0 110.43 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -65.75 -47.37 75.48 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.22 -0.925 . . . . 0.0 110.556 -179.73 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.621 ' HG2' HG22 ' B' ' 17' ' ' VAL . 2.0 mp0 -69.66 -38.32 77.05 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.197 -0.94 . . . . 0.0 110.254 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.22 -44.03 79.16 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.319 -0.863 . . . . 0.0 110.293 -179.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -64.88 -45.09 87.46 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.254 -0.904 . . . . 0.0 110.317 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -65.6 -47.21 76.48 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.166 -0.959 . . . . 0.0 110.39 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 62.8 m -65.36 -42.74 92.46 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.242 -0.911 . . . . 0.0 110.502 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 68.6 mt -71.68 -16.26 18.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.238 -0.914 . . . . 0.0 110.535 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.9 tptt -84.64 -17.55 38.25 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.221 -0.924 . . . . 0.0 110.263 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.609 ' HB2' ' CD2' ' A' ' 63' ' ' PHE . 4.9 mtt85 -105.13 -66.54 0.97 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.321 -0.862 . . . . 0.0 110.563 -179.628 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.536 ' HE2' ' HA ' ' A' ' 60' ' ' TYR . 3.1 ttm -26.35 108.98 0.2 Allowed Pre-proline 0 N--CA 1.499 1.985 0 O-C-N 121.877 -0.515 . . . . 0.0 111.495 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.484 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 10.8 Cg_endo -79.29 -167.74 0.54 Allowed 'Trans proline' 0 C--N 1.307 -1.646 0 O-C-N 123.971 1.511 . . . . 0.0 110.227 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.439 ' O ' ' C ' ' A' ' 48' ' ' TYR . . . -86.6 121.82 29.66 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.247 -0.908 . . . . 0.0 110.477 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.626 ' CD1' ' O ' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -41.32 136.87 1.57 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.279 -0.888 . . . . 0.0 110.561 179.683 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.8 m -81.32 -99.24 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.933 -1.104 . . . . 0.0 110.22 -179.25 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.633 ' N ' ' CD ' ' A' ' 51' ' ' PRO . . . -125.58 38.92 2.16 Favored Glycine 0 N--CA 1.488 2.149 0 C-N-CA 119.559 -1.305 . . . . 0.0 110.635 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.633 ' CD ' ' N ' ' A' ' 50' ' ' GLY . 68.2 Cg_endo -90.13 20.31 1.05 Allowed 'Trans proline' 0 C--N 1.313 -1.292 0 O-C-N 123.407 1.214 . . . . 0.0 109.769 179.167 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.418 ' O ' ' O ' ' A' ' 53' ' ' SER . . . 92.05 -119.34 5.75 Favored Glycine 0 N--CA 1.489 2.189 0 N-CA-C 109.145 -1.582 . . . . 0.0 109.145 -179.348 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.559 ' OG ' ' CD2' ' A' ' 48' ' ' TYR . 0.3 OUTLIER 47.14 -172.92 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.156 -1.203 . . . . 0.0 110.352 179.9 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.545 ' N ' ' OG ' ' A' ' 53' ' ' SER . 13.0 m -136.2 168.85 15.33 Favored Pre-proline 0 C--N 1.292 -1.9 0 C-N-CA 120.444 -0.503 . . . . 0.0 110.375 -179.615 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.475 ' HD2' ' HB ' ' A' ' 54' ' ' VAL . 9.2 Cg_endo -56.09 136.65 76.08 Favored 'Trans proline' 0 C--N 1.306 -1.668 0 O-C-N 124.075 1.566 . . . . 0.0 110.207 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 104.7 -17.4 46.04 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.359 -1.497 . . . . 0.0 109.359 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.435 ' HB1' ' HB2' ' A' ' 23' ' ' TYR . . . -92.29 120.69 33.08 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.292 -1.123 . . . . 0.0 110.12 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.805 HD22 ' N ' ' A' ' 58' ' ' LEU . 3.0 mm? -92.89 160.54 14.86 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.289 -0.882 . . . . 0.0 109.965 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.533 ' N ' ' HG2' ' A' ' 45' ' ' MET . 0.7 OUTLIER -105.89 110.16 22.36 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.09 -1.006 . . . . 0.0 110.741 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.554 ' CD1' ' CB ' ' A' ' 14' ' ' PHE . 28.6 p90 -77.49 -19.26 56.16 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.672 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.93 -42.59 76.36 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.126 -0.984 . . . . 0.0 108.474 178.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.484 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -61.92 -31.96 72.32 Favored 'General case' 0 N--CA 1.488 1.444 0 CA-C-O 121.931 0.872 . . . . 0.0 108.961 178.451 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.891 ' CE1' HD12 ' A' ' 67' ' ' LEU . 25.7 t80 -60.59 -41.98 95.8 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.792 -0.567 . . . . 0.0 110.412 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.404 ' OG ' ' N ' ' A' ' 65' ' ' SER . 6.2 p -63.1 -50.68 69.56 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.147 -0.971 . . . . 0.0 110.456 -179.626 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.404 ' N ' ' OG ' ' A' ' 64' ' ' SER . 16.0 m -69.54 -35.68 75.67 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.145 -0.972 . . . . 0.0 110.43 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.36 -39.56 81.77 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.35 -0.844 . . . . 0.0 110.872 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.891 HD12 ' CE1' ' A' ' 63' ' ' PHE . 1.3 mt -75.09 -44.06 49.49 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.079 -1.013 . . . . 0.0 110.485 -179.619 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -96.22 14.06 25.36 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.2 -0.938 . . . . 0.0 110.397 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.408 ' O ' ' C ' ' A' ' 70' ' ' GLU . . . -87.54 -97.35 0.9 Allowed Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 179.743 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.408 ' C ' ' O ' ' A' ' 69' ' ' GLY . 2.0 tt0 42.18 38.65 1.17 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.388 -1.066 . . . . 0.0 110.439 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.2 m -90.23 107.67 19.28 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.295 -0.878 . . . . 0.0 110.06 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -69.4 135.62 50.54 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.308 -0.87 . . . . 0.0 110.274 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.69 ' C ' HD12 ' A' ' 73' ' ' LEU . 1.1 pp . . . . . 0 N--CA 1.491 1.624 0 O-C-N 121.269 -0.894 . . . . 0.0 110.309 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.252 0 N-CA-C 109.499 -1.441 . . . . 0.0 109.499 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.89 -34.77 5.0 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.231 -1.158 . . . . 0.0 110.095 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.415 ' HA ' HG21 ' A' ' 16' ' ' ILE . 0.1 OUTLIER -66.06 -40.14 90.67 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.256 -0.903 . . . . 0.0 110.194 179.839 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.43 -43.98 79.96 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.323 -0.861 . . . . 0.0 110.113 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -60.33 -40.85 92.11 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.285 -0.884 . . . . 0.0 110.093 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.86 -45.23 82.93 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.303 -0.873 . . . . 0.0 110.14 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.857 ' O ' HG23 ' B' ' 17' ' ' VAL . 76.5 t -57.77 -42.44 81.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.292 -0.88 . . . . 0.0 110.121 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.97 -40.13 96.78 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.246 -0.909 . . . . 0.0 110.132 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 42.8 m -63.87 -43.74 95.18 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.227 -0.921 . . . . 0.0 110.16 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.574 ' O ' HG23 ' B' ' 20' ' ' VAL . 66.2 t -65.97 -43.61 92.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.263 -0.898 . . . . 0.0 110.096 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.857 HG23 ' O ' ' B' ' 13' ' ' VAL . 31.9 t -63.77 -45.83 96.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.294 -0.879 . . . . 0.0 110.111 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.13 -37.07 83.74 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.258 -0.901 . . . . 0.0 110.041 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.99 -42.68 89.5 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.301 -0.874 . . . . 0.0 110.178 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.574 HG23 ' O ' ' B' ' 16' ' ' VAL . 69.3 t -65.42 -40.73 89.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.252 -0.905 . . . . 0.0 110.141 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.474 ' O ' HG23 ' B' ' 25' ' ' VAL . 0.3 OUTLIER -64.75 -35.98 82.81 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.379 -0.825 . . . . 0.0 110.089 179.984 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.2 -43.62 95.78 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.402 -0.811 . . . . 0.0 110.186 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.92 -35.25 80.56 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.23 -0.919 . . . . 0.0 110.474 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 5.4 ttt180 -68.32 -46.44 70.22 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.124 -0.985 . . . . 0.0 110.359 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 25' ' ' VAL . . . . . 0.474 HG23 ' O ' ' B' ' 21' ' ' ASP . 60.7 t -60.91 -21.79 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.209 -0.932 . . . . 0.0 110.282 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 2.1 tpt85 52.14 58.57 5.29 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.405 -0.809 . . . . 0.0 110.25 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -101.33 131.12 23.5 Favored Pre-proline 0 N--CA 1.493 1.707 0 O-C-N 121.285 -0.885 . . . . 0.0 110.273 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -61.99 -157.08 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.733 0 O-C-N 123.988 1.52 . . . . 0.0 110.227 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 5.2 ptt-85 . . . . . 0 N--CA 1.492 1.64 0 O-C-N 121.231 -0.918 . . . . 0.0 110.29 179.935 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.5 mtp . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 121.327 0.584 . . . . 0.0 110.241 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -138.39 70.25 1.38 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.205 -0.934 . . . . 0.0 110.265 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 51.4 -153.54 0.18 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.213 -0.929 . . . . 0.0 110.172 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -120.33 178.73 4.54 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.235 -0.916 . . . . 0.0 110.184 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.507 ' O ' ' N ' ' A' ' 7' ' ' ALA . 1.3 t0 -155.99 48.63 0.5 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.186 -0.946 . . . . 0.0 110.336 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.835 HG22 ' OH ' ' A' ' 68' ' ' TYR . 1.7 m 65.09 -66.6 0.14 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.264 -0.897 . . . . 0.0 110.23 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.507 ' N ' ' O ' ' A' ' 5' ' ' ASP . . . -63.85 -47.56 80.24 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.226 -0.921 . . . . 0.0 109.814 179.726 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -54.45 -36.05 63.67 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.31 -0.869 . . . . 0.0 109.797 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -61.66 -37.6 84.63 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.346 -0.847 . . . . 0.0 110.285 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.497 HG12 ' CD2' ' A' ' 14' ' ' PHE . 17.0 t -58.15 -50.55 77.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.172 -0.955 . . . . 0.0 109.646 179.818 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 23.4 mt -55.01 -49.95 67.13 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 121.276 -0.89 . . . . 0.0 109.153 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.07 -39.31 78.22 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.352 -0.843 . . . . 0.0 108.739 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.46 ' HA ' ' HB1' ' B' ' 12' ' ' ALA . 72.5 m -66.84 -41.11 87.95 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.46 -0.775 . . . . 0.0 109.087 179.023 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.585 ' HB3' ' CE2' ' A' ' 60' ' ' TYR . 5.1 m-85 -67.24 -41.42 85.67 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.368 -0.832 . . . . 0.0 109.322 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.7 ttt-85 -54.52 -44.62 72.91 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.427 -0.796 . . . . 0.0 109.632 179.385 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.631 HD12 ' HB2' ' B' ' 12' ' ' ALA . 44.3 mt -60.93 -44.65 98.41 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.368 -0.832 . . . . 0.0 109.953 179.724 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.492 HD21 HG23 ' B' ' 13' ' ' VAL . 3.2 mm? -64.41 -39.78 94.5 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.224 -0.923 . . . . 0.0 109.84 179.788 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.504 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -77.09 -4.26 43.47 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.306 -0.871 . . . . 0.0 110.044 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.463 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 66.93 63.34 0.47 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.266 -0.896 . . . . 0.0 110.359 179.895 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 55.59 62.16 2.55 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.276 -0.89 . . . . 0.0 110.432 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.504 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 19.3 mttt -144.73 143.89 22.72 Favored Pre-proline 0 N--CA 1.49 1.563 0 O-C-N 121.329 -0.857 . . . . 0.0 109.887 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -73.72 -0.25 9.13 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 O-C-N 123.938 1.494 . . . . 0.0 110.094 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 13.6 p90 -146.38 155.66 42.76 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.286 -0.884 . . . . 0.0 110.283 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.656 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -124.18 142.22 41.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.427 -0.795 . . . . 0.0 109.754 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.656 ' N ' HD13 ' A' ' 24' ' ' ILE . 3.8 mp -80.23 136.54 36.48 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.136 -0.977 . . . . 0.0 110.003 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.32 -41.02 96.33 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.268 -0.895 . . . . 0.0 109.912 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.15 -42.77 77.49 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.38 -0.825 . . . . 0.0 109.541 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.449 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 64.0 tt0 -69.41 -42.39 75.13 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.501 -0.749 . . . . 0.0 109.648 179.541 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.663 HD21 ' CB ' ' A' ' 41' ' ' CYS . 1.2 tp -62.56 -41.4 98.89 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.412 -0.805 . . . . 0.0 108.92 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.936 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -62.43 -33.65 75.22 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.652 -0.655 . . . . 0.0 110.257 179.619 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.3 ttm180 -96.72 -24.8 15.79 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.355 -0.841 . . . . 0.0 111.504 -179.03 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.449 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 7.7 mm-40 -80.06 -21.55 43.3 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.815 -1.178 . . . . 0.0 111.073 -179.088 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.535 HD23 ' HD3' ' A' ' 34' ' ' PRO . 7.3 mt -116.72 169.65 6.96 Favored Pre-proline 0 C--N 1.303 -1.426 0 O-C-N 120.939 -1.101 . . . . 0.0 111.164 -179.076 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.558 ' CB ' ' HD2' ' A' ' 35' ' ' PRO . 35.3 Cg_exo -58.41 -149.39 0.01 OUTLIER 'Trans proline' 0 C--N 1.307 -1.62 0 O-C-N 124.225 1.645 . . . . 0.0 109.984 179.668 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.558 ' HD2' ' CB ' ' A' ' 34' ' ' PRO . 10.8 Cg_endo -96.24 -44.19 0.02 OUTLIER 'Trans proline' 0 C--N 1.308 -1.603 0 O-C-N 123.647 1.34 . . . . 0.0 110.451 179.686 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.2 -41.17 90.57 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.309 -0.869 . . . . 0.0 111.096 -179.631 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.774 ' HG2' HG22 ' B' ' 17' ' ' VAL . 10.7 mp0 -69.68 -44.82 69.67 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.061 -1.024 . . . . 0.0 111.011 -179.252 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.936 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -62.58 -46.76 86.85 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.306 -0.871 . . . . 0.0 110.769 -179.391 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 15.0 tm0? -65.86 -43.99 86.79 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.177 -0.952 . . . . 0.0 111.067 -179.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -65.51 -42.39 92.1 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.065 -1.022 . . . . 0.0 110.631 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.663 ' CB ' HD21 ' A' ' 29' ' ' LEU . 34.9 m -58.08 -50.51 73.2 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.189 -0.944 . . . . 0.0 110.548 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.438 HD12 ' O ' ' A' ' 38' ' ' ALA . 0.5 OUTLIER -58.4 -22.36 19.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.107 -0.995 . . . . 0.0 110.131 -179.924 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -82.15 -15.41 53.43 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.136 -0.978 . . . . 0.0 110.609 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.55 ' HG3' ' CE1' ' A' ' 63' ' ' PHE . 0.8 OUTLIER -113.68 -60.03 1.94 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.033 -1.042 . . . . 0.0 110.682 -179.818 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.564 ' CE ' ' HB3' ' A' ' 60' ' ' TYR . 3.0 ttm -35.3 100.37 0.19 Allowed Pre-proline 0 N--CA 1.495 1.804 0 O-C-N 121.547 -0.72 . . . . 0.0 111.085 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.504 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 18.7 Cg_exo -71.59 -168.09 0.33 Allowed 'Trans proline' 0 C--N 1.305 -1.757 0 O-C-N 124.099 1.578 . . . . 0.0 110.073 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.21 146.49 43.3 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.249 -0.907 . . . . 0.0 110.127 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.576 ' CE2' ' CB ' ' A' ' 53' ' ' SER . 0.1 OUTLIER -53.56 -177.54 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.223 -0.923 . . . . 0.0 110.429 -179.917 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -162.29 77.65 0.49 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.246 -0.909 . . . . 0.0 110.102 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -172.79 158.09 27.84 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -70.04 114.43 3.75 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 124.009 1.531 . . . . 0.0 110.368 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.508 ' O ' ' HB2' ' A' ' 53' ' ' SER . . . 101.58 133.21 8.01 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.673 -1.371 . . . . 0.0 109.673 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.576 ' CB ' ' CE2' ' A' ' 48' ' ' TYR . 45.2 t 178.23 -152.1 0.02 OUTLIER 'General case' 0 C--N 1.307 -1.251 0 O-C-N 121.454 -1.027 . . . . 0.0 110.054 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.451 ' HB ' ' HD2' ' A' ' 55' ' ' PRO . 33.5 m -146.57 171.65 6.15 Favored Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.232 -0.917 . . . . 0.0 110.208 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.451 ' HD2' ' HB ' ' A' ' 54' ' ' VAL . 19.7 Cg_endo -72.86 74.31 2.88 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 O-C-N 123.945 1.498 . . . . 0.0 110.207 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 141.64 44.23 0.06 OUTLIER Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.359 -1.496 . . . . 0.0 109.359 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.667 ' C ' HD22 ' A' ' 58' ' ' LEU . . . -106.36 112.72 25.86 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.183 -1.186 . . . . 0.0 110.361 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.786 HD22 ' N ' ' A' ' 58' ' ' LEU . 3.3 mm? -105.94 160.29 15.38 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.25 -0.907 . . . . 0.0 109.511 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.483 ' C ' ' HG3' ' A' ' 45' ' ' MET . 1.7 m-20 -113.71 111.02 21.12 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.111 -0.993 . . . . 0.0 111.055 -179.365 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.585 ' CE2' ' HB3' ' A' ' 14' ' ' PHE . 15.6 p90 -76.35 -22.76 54.49 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.376 -0.828 . . . . 0.0 109.901 179.422 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.55 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.79 -38.91 70.56 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.341 -0.849 . . . . 0.0 109.632 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.504 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -68.3 -34.68 76.6 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.208 -0.932 . . . . 0.0 109.424 179.376 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.55 ' CE1' ' HG3' ' A' ' 44' ' ' ARG . 4.4 t80 -72.0 -35.84 69.57 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.655 -0.653 . . . . 0.0 110.044 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.5 p -60.83 -49.88 75.71 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.234 -0.916 . . . . 0.0 110.333 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 66.0 p -64.98 -43.84 91.28 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.162 -0.962 . . . . 0.0 110.218 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.48 -31.63 69.52 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.305 -0.872 . . . . 0.0 110.216 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.572 ' CD2' ' HB2' ' B' ' 23' ' ' ALA . 0.6 OUTLIER -65.61 -36.97 85.27 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.203 -0.935 . . . . 0.0 110.202 -179.926 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.835 ' OH ' HG22 ' A' ' 6' ' ' THR . 11.1 m-85 -86.77 -21.43 26.54 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.291 -0.881 . . . . 0.0 110.203 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -132.64 116.34 1.77 Allowed Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.554 -1.419 . . . . 0.0 109.554 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -74.02 -61.62 1.79 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.185 -1.185 . . . . 0.0 110.218 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -174.11 -60.64 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.226 -0.921 . . . . 0.0 110.199 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -83.23 115.32 21.9 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.177 -0.952 . . . . 0.0 110.213 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.661 0 O-C-N 121.273 -0.892 . . . . 0.0 110.188 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.256 0 N-CA-C 109.571 -1.411 . . . . 0.0 109.571 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.74 -48.86 4.35 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.194 -1.18 . . . . 0.0 110.17 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.76 -45.3 94.5 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.164 -0.96 . . . . 0.0 110.15 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.9 -35.72 69.3 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.232 -0.917 . . . . 0.0 110.042 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -65.26 -45.49 84.34 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.259 -0.901 . . . . 0.0 110.126 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 12' ' ' ALA . . . . . 0.631 ' HB2' HD12 ' A' ' 16' ' ' ILE . . . -62.91 -39.16 93.72 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.248 -0.907 . . . . 0.0 110.106 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.771 ' O ' HG23 ' B' ' 17' ' ' VAL . 25.1 t -62.45 -42.73 96.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.357 -0.839 . . . . 0.0 110.154 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.7 -40.24 83.06 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.264 -0.898 . . . . 0.0 110.097 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.3 m -62.36 -48.19 80.88 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.32 -0.863 . . . . 0.0 110.203 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.407 ' O ' HG23 ' B' ' 20' ' ' VAL . 46.7 t -64.07 -43.62 97.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.247 -0.908 . . . . 0.0 110.268 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.774 HG22 ' HG2' ' A' ' 37' ' ' GLN . 45.2 t -63.01 -49.31 84.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.244 -0.91 . . . . 0.0 110.317 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.34 -32.67 74.15 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.186 -0.946 . . . . 0.0 110.305 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.47 -44.88 77.53 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.198 -0.939 . . . . 0.0 110.411 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.407 HG23 ' O ' ' B' ' 16' ' ' VAL . 97.6 t -67.17 -42.52 88.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.237 -0.914 . . . . 0.0 110.361 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -65.14 -31.73 73.07 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.255 -0.903 . . . . 0.0 110.447 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 22' ' ' GLN . . . . . 0.73 ' O ' HG12 ' B' ' 25' ' ' VAL . 6.1 tp60 -64.16 -49.54 71.7 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.173 -0.954 . . . . 0.0 110.573 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.572 ' HB2' ' CD2' ' A' ' 67' ' ' LEU . . . -65.19 -34.69 78.97 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.101 -0.999 . . . . 0.0 110.505 -179.774 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.7 ttp85 -66.65 -36.56 82.85 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.289 -0.882 . . . . 0.0 110.634 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 25' ' ' VAL . . . . . 0.73 HG12 ' O ' ' B' ' 22' ' ' GLN . 1.3 p -74.04 -21.18 17.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.049 -1.032 . . . . 0.0 110.304 -179.712 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 2.1 ttm180 51.18 57.9 6.12 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.402 -0.811 . . . . 0.0 110.215 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -101.84 126.3 34.34 Favored Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.359 -0.838 . . . . 0.0 110.171 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_exo -87.93 -46.7 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.633 0 O-C-N 123.982 1.517 . . . . 0.0 110.318 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 7.1 mtt-85 . . . . . 0 N--CA 1.493 1.683 0 O-C-N 121.299 -0.876 . . . . 0.0 110.232 179.925 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 121.254 0.549 . . . . 0.0 110.258 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -146.65 -86.62 0.1 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.265 -0.897 . . . . 0.0 110.251 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.41 ' O ' ' C ' ' A' ' 4' ' ' THR . 3.7 t0 51.67 -176.95 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.214 -0.929 . . . . 0.0 110.103 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.415 ' O ' ' CG ' ' A' ' 5' ' ' ASP . 0.0 OUTLIER 43.62 54.65 5.37 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.235 -0.916 . . . . 0.0 110.279 179.954 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.415 ' CG ' ' O ' ' A' ' 4' ' ' THR . 11.1 m-20 -165.29 136.17 3.88 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.219 -0.926 . . . . 0.0 110.406 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.64 ' CG2' ' CZ ' ' A' ' 68' ' ' TYR . 31.3 m -108.54 -71.12 0.77 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.24 -0.913 . . . . 0.0 109.985 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.7 -38.29 89.83 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.181 -0.949 . . . . 0.0 109.098 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -59.14 -35.05 72.81 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.585 -0.697 . . . . 0.0 109.57 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.408 ' O ' ' OG ' ' A' ' 13' ' ' SER . 1.8 tt0 -60.87 -44.29 97.25 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.338 -0.851 . . . . 0.0 110.311 -179.507 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.44 HG12 ' CD2' ' A' ' 14' ' ' PHE . 95.7 t -65.66 -41.46 90.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 120.978 -1.076 . . . . 0.0 109.846 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 75.2 mt -65.54 -47.47 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.273 -0.892 . . . . 0.0 109.448 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.76 -45.99 85.16 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.338 -0.851 . . . . 0.0 108.763 179.159 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.498 ' HB2' ' CG2' ' B' ' 16' ' ' VAL . 1.5 p -63.12 -42.98 99.63 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.416 -0.803 . . . . 0.0 108.949 178.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.44 ' CD2' HG12 ' A' ' 10' ' ' VAL . 1.1 m-85 -63.61 -41.8 98.28 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.319 -0.863 . . . . 0.0 109.266 179.2 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.625 ' NH2' ' CE2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -55.98 -41.49 74.86 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.482 -0.761 . . . . 0.0 109.321 179.14 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.642 HD12 ' HB2' ' B' ' 12' ' ' ALA . 77.1 mt -61.82 -45.08 99.47 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 O-C-N 121.355 -0.84 . . . . 0.0 109.953 179.545 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.447 HD22 ' HB3' ' A' ' 32' ' ' GLU . 19.9 mt -65.09 -41.31 95.12 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.183 -0.948 . . . . 0.0 110.092 179.718 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.492 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -73.52 -0.26 14.57 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.253 -0.905 . . . . 0.0 110.229 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.476 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 0.1 OUTLIER 56.71 54.59 7.13 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.216 -0.927 . . . . 0.0 110.381 179.834 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.476 ' HB2' ' O ' ' A' ' 19' ' ' SER . 0.8 OUTLIER 58.43 45.25 16.93 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.255 -0.903 . . . . 0.0 110.384 179.765 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.533 ' O ' ' NH2' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -113.15 145.78 33.86 Favored Pre-proline 0 N--CA 1.494 1.746 0 O-C-N 121.15 -0.969 . . . . 0.0 110.267 179.849 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.576 ' HG2' ' CE2' ' A' ' 23' ' ' TYR . 12.3 Cg_endo -61.25 -11.39 18.92 Favored 'Trans proline' 0 C--N 1.303 -1.838 0 O-C-N 123.971 1.511 . . . . 0.0 109.843 179.292 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.576 ' CE2' ' HG2' ' A' ' 22' ' ' PRO . 8.4 p90 -150.2 170.82 18.05 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.243 -0.911 . . . . 0.0 110.292 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.827 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.3 OUTLIER -123.11 145.09 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.329 -0.857 . . . . 0.0 109.878 179.906 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.827 ' N ' HD13 ' A' ' 24' ' ' ILE . 0.4 OUTLIER -94.44 146.75 23.86 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.157 -0.964 . . . . 0.0 110.281 -179.739 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.514 ' HB2' HD11 ' A' ' 58' ' ' LEU . . . -62.42 -34.49 76.87 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.214 -0.929 . . . . 0.0 110.009 179.864 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -70.43 -34.17 72.16 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.357 -0.84 . . . . 0.0 110.223 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.48 ' O ' ' HG2' ' A' ' 32' ' ' GLU . 1.5 tp10 -66.32 -50.94 61.94 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.334 -0.854 . . . . 0.0 110.297 -179.711 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.875 HD12 ' N ' ' A' ' 30' ' ' ARG . 4.4 pp -66.94 -33.57 75.86 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.086 -1.009 . . . . 0.0 109.081 179.243 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.875 ' N ' HD12 ' A' ' 29' ' ' LEU . 4.6 mtt-85 -55.82 -34.8 65.69 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.432 -0.793 . . . . 0.0 109.795 179.304 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -92.81 -18.68 22.57 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.366 -0.834 . . . . 0.0 110.373 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 28' ' ' GLU . 43.8 mm-40 -92.35 -23.32 19.28 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.122 -0.986 . . . . 0.0 110.53 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.605 HD22 ' HB3' ' A' ' 37' ' ' GLN . 0.5 OUTLIER -122.62 144.28 42.03 Favored Pre-proline 0 N--CA 1.487 1.388 0 O-C-N 121.158 -0.964 . . . . 0.0 110.342 -179.791 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.441 ' O ' ' C ' ' A' ' 35' ' ' PRO . 2.4 Cg_endo -46.42 136.54 15.34 Favored 'Trans proline' 0 C--N 1.305 -1.743 0 O-C-N 123.945 1.497 . . . . 0.0 109.67 179.545 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.441 ' C ' ' O ' ' A' ' 34' ' ' PRO . 26.5 Cg_exo -38.07 -37.75 0.66 Allowed 'Trans proline' 0 C--N 1.304 -1.78 0 O-C-N 124.112 1.585 . . . . 0.0 110.784 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -65.93 -47.64 74.04 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.242 -0.911 . . . . 0.0 110.862 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.605 ' HB3' HD22 ' A' ' 33' ' ' LEU . 2.2 mp0 -70.31 -45.55 66.02 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.176 -0.953 . . . . 0.0 110.714 -179.548 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.72 ' HB1' ' CD1' ' A' ' 29' ' ' LEU . . . -55.98 -44.74 78.83 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.279 -0.888 . . . . 0.0 110.663 -179.45 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.8 -40.29 79.55 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.238 -0.914 . . . . 0.0 110.664 -179.627 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.11 -45.43 85.17 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.159 -0.963 . . . . 0.0 110.573 -179.769 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.51 ' O ' ' HG2' ' A' ' 45' ' ' MET . 49.2 m -65.29 -51.44 60.69 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.178 -0.951 . . . . 0.0 110.731 -179.616 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.589 HD11 ' HG3' ' A' ' 30' ' ' ARG . 97.3 mt -45.26 -27.89 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.098 -1.001 . . . . 0.0 110.29 -179.68 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.8 tttp -86.14 -37.36 18.84 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.307 -0.871 . . . . 0.0 110.245 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.598 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 19.1 mmt180 -69.11 -76.47 0.09 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.358 -0.839 . . . . 0.0 110.75 -179.491 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.559 ' CB ' ' O ' ' A' ' 59' ' ' ASP . 2.8 ptp -39.42 102.73 0.26 Allowed Pre-proline 0 N--CA 1.493 1.675 0 O-C-N 121.417 -0.802 . . . . 0.0 110.41 -179.225 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.958 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 13.6 Cg_endo -59.8 -158.79 0.02 OUTLIER 'Trans proline' 0 C--N 1.307 -1.634 0 O-C-N 124.448 1.762 . . . . 0.0 110.986 -179.341 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.474 ' O ' ' O ' ' A' ' 48' ' ' TYR . . . -75.12 120.19 20.3 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.419 -0.801 . . . . 0.0 110.888 -179.513 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.474 ' O ' ' O ' ' A' ' 47' ' ' ALA . 24.2 p90 -41.32 166.76 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.478 -0.764 . . . . 0.0 110.68 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -174.99 63.91 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.308 -0.87 . . . . 0.0 110.133 179.831 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.414 ' O ' ' OG ' ' A' ' 53' ' ' SER . . . -137.82 -179.22 16.77 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -62.29 133.66 44.61 Favored 'Trans proline' 0 C--N 1.305 -1.757 0 O-C-N 123.997 1.525 . . . . 0.0 110.328 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.871 ' O ' HG13 ' A' ' 54' ' ' VAL . . . 84.65 5.26 86.82 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.46 ' C ' ' O ' ' A' ' 52' ' ' GLY . 0.0 OUTLIER -35.9 139.03 0.15 Allowed 'General case' 0 C--N 1.308 -1.224 0 O-C-N 121.697 -0.884 . . . . 0.0 111.045 -179.69 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.871 HG13 ' O ' ' A' ' 52' ' ' GLY . 27.4 m -143.15 165.78 23.92 Favored Pre-proline 0 C--N 1.296 -1.723 0 O-C-N 121.69 -0.631 . . . . 0.0 110.273 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -69.27 140.98 45.93 Favored 'Trans proline' 0 C--N 1.306 -1.669 0 O-C-N 123.929 1.489 . . . . 0.0 110.342 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 90.49 -11.85 70.13 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.437 ' O ' ' CD1' ' A' ' 48' ' ' TYR . . . -79.11 146.41 33.23 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.178 -1.19 . . . . 0.0 110.354 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.514 HD11 ' HB2' ' A' ' 26' ' ' ALA . 64.8 mt -132.7 153.48 51.1 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.277 -0.889 . . . . 0.0 109.666 179.759 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.559 ' O ' ' CB ' ' A' ' 45' ' ' MET . 12.6 t0 -86.98 109.62 19.5 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.033 -1.042 . . . . 0.0 110.326 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.625 ' CE2' ' NH2' ' A' ' 15' ' ' ARG . 26.1 p90 -83.57 -21.96 32.49 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.327 -0.858 . . . . 0.0 109.123 179.17 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.429 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -67.46 -37.72 83.36 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.454 -0.779 . . . . 0.0 109.548 179.472 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.958 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -63.66 -33.02 74.7 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.148 -0.97 . . . . 0.0 109.846 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.598 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 4.1 t80 -71.84 -34.48 69.32 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.503 -0.748 . . . . 0.0 110.163 179.699 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 33.7 p -66.44 -49.77 65.61 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.238 -0.914 . . . . 0.0 110.458 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.44 ' O ' ' N ' ' A' ' 69' ' ' GLY . 0.2 OUTLIER -64.74 -39.56 93.83 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.202 -0.936 . . . . 0.0 110.308 -179.974 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.88 -36.38 80.15 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.246 -0.909 . . . . 0.0 110.329 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.563 HD21 ' O ' ' B' ' 19' ' ' ALA . 0.4 OUTLIER -58.57 -42.25 87.55 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.162 -0.961 . . . . 0.0 110.251 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.64 ' CZ ' ' CG2' ' A' ' 6' ' ' THR . 10.5 m-85 -97.92 -23.74 15.69 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.316 -0.865 . . . . 0.0 110.218 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.44 ' N ' ' O ' ' A' ' 65' ' ' SER . . . -65.65 -129.03 0.01 OUTLIER Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -113.56 -170.13 1.64 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.192 -1.181 . . . . 0.0 110.205 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 60.1 p -79.99 -150.33 0.06 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.291 -0.881 . . . . 0.0 110.188 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -94.17 130.02 40.53 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.155 -0.965 . . . . 0.0 110.233 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.636 0 O-C-N 121.351 -0.843 . . . . 0.0 110.178 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 7' ' ' GLY . . . . . 0.518 ' O ' ' N ' ' B' ' 9' ' ' LYS . . . . . . . . 0 N--CA 1.49 2.234 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.452 ' CB ' ' O ' ' B' ' 7' ' ' GLY . 0.0 OUTLIER 66.28 -62.56 0.26 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.202 -1.176 . . . . 0.0 110.241 -179.89 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.557 ' HA ' HG21 ' A' ' 16' ' ' ILE . 0.6 OUTLIER -58.19 -44.54 88.12 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.166 -0.959 . . . . 0.0 110.051 179.859 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.98 -34.89 78.48 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.266 -0.897 . . . . 0.0 109.982 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -65.55 -40.41 92.83 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.259 -0.9 . . . . 0.0 109.924 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 12' ' ' ALA . . . . . 0.706 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -62.89 -39.38 94.3 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.322 -0.861 . . . . 0.0 109.871 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.841 ' O ' HG23 ' B' ' 17' ' ' VAL . 99.4 t -60.37 -41.59 87.86 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.349 -0.844 . . . . 0.0 109.883 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.78 -42.27 95.22 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.321 -0.862 . . . . 0.0 110.061 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 22.2 m -61.91 -46.07 90.96 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.215 -0.928 . . . . 0.0 110.061 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.706 HG23 ' O ' ' B' ' 12' ' ' ALA . 21.1 t -64.39 -41.76 93.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.228 -0.92 . . . . 0.0 110.014 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.841 HG23 ' O ' ' B' ' 13' ' ' VAL . 91.0 t -60.09 -46.23 94.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.275 -0.891 . . . . 0.0 110.136 179.771 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.17 -42.21 98.17 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.238 -0.913 . . . . 0.0 110.18 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.563 ' O ' HD21 ' A' ' 67' ' ' LEU . . . -65.37 -43.82 89.52 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.256 -0.902 . . . . 0.0 110.212 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.507 HG22 ' HZ ' ' A' ' 63' ' ' PHE . 55.7 t -67.46 -45.57 85.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.256 -0.902 . . . . 0.0 110.169 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.442 ' O ' HG23 ' B' ' 25' ' ' VAL . 9.3 t0 -57.25 -33.47 67.62 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.349 -0.844 . . . . 0.0 110.241 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.03 -45.88 90.22 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.248 -0.908 . . . . 0.0 110.211 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -58.51 -35.02 71.61 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.175 -0.953 . . . . 0.0 110.198 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 44.7 ttt180 -66.0 -35.26 80.08 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.218 -0.926 . . . . 0.0 110.185 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 25' ' ' VAL . . . . . 0.442 HG23 ' O ' ' B' ' 21' ' ' ASP . 78.0 t -60.91 -21.68 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.244 -0.91 . . . . 0.0 110.296 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 3.9 ttt180 63.08 69.25 0.59 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.48 -0.763 . . . . 0.0 110.121 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.8 139.15 85.68 Favored Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.363 -0.836 . . . . 0.0 110.202 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -75.84 70.21 5.93 Favored 'Trans proline' 0 C--N 1.305 -1.721 0 O-C-N 123.949 1.5 . . . . 0.0 110.29 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 O-C-N 121.166 -0.959 . . . . 0.0 110.29 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.191 0.519 . . . . 0.0 110.193 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -173.08 -81.29 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.221 -0.924 . . . . 0.0 110.242 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -140.91 177.09 8.29 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.218 -0.926 . . . . 0.0 110.276 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.6 m -130.16 164.54 24.25 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.289 -0.882 . . . . 0.0 110.134 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.506 ' O ' ' N ' ' A' ' 7' ' ' ALA . 0.2 OUTLIER -173.45 51.48 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.23 -0.919 . . . . 0.0 110.325 -179.968 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.994 HG22 ' CE2' ' A' ' 68' ' ' TYR . 1.9 m 64.59 -68.36 0.1 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.23 -0.919 . . . . 0.0 110.375 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.506 ' N ' ' O ' ' A' ' 5' ' ' ASP . . . -68.36 -39.6 81.76 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.258 -0.901 . . . . 0.0 109.831 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.62 ' HA ' HD12 ' A' ' 11' ' ' ILE . 5.8 tm-20 -67.39 -36.45 81.33 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.392 -0.817 . . . . 0.0 109.9 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 6.0 tp60 -61.29 -45.97 92.24 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.327 -0.858 . . . . 0.0 110.139 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.747 HG12 ' HD2' ' A' ' 14' ' ' PHE . 75.6 t -58.05 -44.88 88.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.24 -0.913 . . . . 0.0 110.071 179.844 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.62 HD12 ' HA ' ' A' ' 8' ' ' GLU . 73.1 mt -54.78 -48.51 73.12 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.239 -0.913 . . . . 0.0 109.716 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.74 -42.67 84.39 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.173 -0.954 . . . . 0.0 109.099 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.438 ' HB2' ' CG2' ' B' ' 16' ' ' VAL . 2.2 m -68.1 -39.75 82.77 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.496 -0.753 . . . . 0.0 109.356 179.134 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.747 ' HD2' HG12 ' A' ' 10' ' ' VAL . 2.4 m-85 -68.58 -42.09 78.73 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.307 -0.871 . . . . 0.0 109.528 179.293 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.3 ttt-85 -53.34 -46.78 69.63 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.284 -0.885 . . . . 0.0 109.42 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.604 HD12 ' HB2' ' B' ' 12' ' ' ALA . 37.8 mt -59.42 -42.54 87.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.352 -0.842 . . . . 0.0 109.571 179.446 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.663 HD11 ' CG2' ' B' ' 13' ' ' VAL . 4.4 mp -63.99 -41.55 97.47 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.358 -0.839 . . . . 0.0 109.806 179.742 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.632 ' HB1' ' O ' ' A' ' 23' ' ' TYR . . . -74.45 -2.81 27.19 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.342 -0.849 . . . . 0.0 110.141 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.43 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.3 OUTLIER 65.29 74.69 0.38 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.263 -0.898 . . . . 0.0 110.258 -179.921 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.8 t0 49.04 59.08 4.7 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.264 -0.897 . . . . 0.0 110.317 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.583 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 11.2 mttt -148.6 144.81 18.88 Favored Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.19 -0.944 . . . . 0.0 110.169 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -77.25 4.33 5.96 Favored 'Trans proline' 0 C--N 1.305 -1.748 0 O-C-N 124.063 1.559 . . . . 0.0 110.117 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.632 ' O ' ' HB1' ' A' ' 18' ' ' ALA . 48.8 p90 -148.99 175.34 11.39 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.208 -0.932 . . . . 0.0 110.319 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.6 tt -151.33 156.96 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.274 -0.891 . . . . 0.0 110.119 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.2 mp -89.26 149.05 23.25 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.264 -0.897 . . . . 0.0 110.258 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.502 ' O ' ' HG ' ' A' ' 29' ' ' LEU . . . -58.03 -34.79 70.45 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.27 -0.894 . . . . 0.0 110.028 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -70.76 -34.11 71.49 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.269 -0.894 . . . . 0.0 110.018 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.453 ' O ' ' CG ' ' A' ' 32' ' ' GLU . 3.8 tp10 -62.5 -50.97 69.27 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.3 -0.875 . . . . 0.0 110.513 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.769 HD12 ' C ' ' A' ' 29' ' ' LEU . 3.5 pp -66.98 -33.16 74.96 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.006 -1.059 . . . . 0.0 109.295 179.444 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.76 ' N ' HD12 ' A' ' 29' ' ' LEU . 3.2 ttt85 -58.18 -34.75 70.68 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.394 -0.816 . . . . 0.0 109.61 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.8 ttt180 -91.62 -29.85 16.67 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.433 -0.792 . . . . 0.0 110.196 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.453 ' CG ' ' O ' ' A' ' 28' ' ' GLU . 5.0 mm-40 -82.2 -23.56 35.39 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.174 -0.954 . . . . 0.0 110.26 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.755 HD23 ' HD2' ' A' ' 34' ' ' PRO . 6.5 mt -119.96 146.9 43.15 Favored Pre-proline 0 N--CA 1.489 1.476 0 O-C-N 121.257 -0.902 . . . . 0.0 110.094 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.755 ' HD2' HD23 ' A' ' 33' ' ' LEU . 1.1 Cg_endo -53.67 158.19 8.62 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 O-C-N 123.938 1.493 . . . . 0.0 110.284 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -50.54 -39.44 55.35 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 124.108 1.583 . . . . 0.0 110.69 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.97 -46.46 81.39 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.21 -0.932 . . . . 0.0 110.445 -179.793 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.574 ' CB ' HD22 ' A' ' 33' ' ' LEU . 58.5 mm-40 -69.66 -38.33 77.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.25 -0.906 . . . . 0.0 110.686 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.617 ' HA ' HD13 ' A' ' 29' ' ' LEU . . . -57.46 -42.12 81.91 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.203 -0.936 . . . . 0.0 110.798 -179.497 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.5 tp60 -60.69 -47.08 87.87 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.179 -0.951 . . . . 0.0 110.692 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -66.0 -43.87 86.49 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.21 -0.931 . . . . 0.0 110.586 -179.599 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.453 ' HB3' HD22 ' A' ' 29' ' ' LEU . 3.2 m -62.67 -42.91 99.88 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.223 -0.923 . . . . 0.0 111.005 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.73 HG13 HD21 ' A' ' 29' ' ' LEU . 68.6 mt -75.2 -12.35 14.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.067 -1.021 . . . . 0.0 110.524 -179.435 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.88 -16.07 49.01 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.23 -0.919 . . . . 0.0 111.129 -179.359 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.514 ' O ' ' C ' ' A' ' 45' ' ' MET . 1.1 mpp_? -117.26 -56.66 2.22 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.086 -1.009 . . . . 0.0 110.997 -179.479 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.539 ' HE2' ' HA ' ' A' ' 60' ' ' TYR . 3.9 ttm -29.48 94.52 0.06 OUTLIER Pre-proline 0 N--CA 1.498 1.964 0 O-C-N 121.691 -0.63 . . . . 0.0 111.531 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.471 ' N ' ' O ' ' A' ' 44' ' ' ARG . 11.5 Cg_endo -59.07 -174.6 0.08 OUTLIER 'Trans proline' 0 C--N 1.307 -1.641 0 O-C-N 124.121 1.59 . . . . 0.0 110.363 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.62 74.26 7.53 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.192 -0.942 . . . . 0.0 110.303 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.435 ' HA ' ' CG ' ' A' ' 59' ' ' ASP . 1.1 t80 42.6 -118.66 0.48 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.319 -0.863 . . . . 0.0 110.43 179.689 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -100.4 160.41 14.36 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.96 -1.087 . . . . 0.0 110.386 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.425 ' N ' ' CD ' ' A' ' 51' ' ' PRO . . . -70.3 -34.58 69.12 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.425 ' CD ' ' N ' ' A' ' 50' ' ' GLY . 44.8 Cg_endo -115.18 130.07 0.02 OUTLIER 'Trans proline' 0 C--N 1.306 -1.683 0 O-C-N 123.972 1.511 . . . . 0.0 110.257 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.44 ' O ' ' HB3' ' A' ' 53' ' ' SER . . . 93.17 -134.49 12.18 Favored Glycine 0 N--CA 1.489 2.202 0 N-CA-C 109.354 -1.498 . . . . 0.0 109.354 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.44 ' HB3' ' O ' ' A' ' 52' ' ' GLY . 11.0 t 55.81 -178.63 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.277 -1.131 . . . . 0.0 110.115 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.464 ' CG2' ' HB2' ' A' ' 57' ' ' ALA . 20.2 m -123.77 164.08 31.1 Favored Pre-proline 0 C--N 1.295 -1.765 0 O-C-N 121.72 -0.613 . . . . 0.0 110.098 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -75.24 55.35 4.04 Favored 'Trans proline' 0 C--N 1.305 -1.72 0 O-C-N 123.907 1.477 . . . . 0.0 110.381 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 170.82 35.01 0.03 OUTLIER Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.565 ' C ' HD22 ' A' ' 58' ' ' LEU . . . -134.51 128.69 33.87 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.225 -1.162 . . . . 0.0 110.227 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.849 HD22 ' N ' ' A' ' 58' ' ' LEU . 2.1 mm? -112.77 156.4 22.91 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.226 -0.921 . . . . 0.0 109.785 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.485 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.6 OUTLIER -111.53 110.46 20.89 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.068 -1.02 . . . . 0.0 110.441 -179.855 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.539 ' HA ' ' HE2' ' A' ' 45' ' ' MET . 18.4 p90 -75.02 -21.75 58.89 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.263 -0.898 . . . . 0.0 109.593 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.519 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.9 -39.15 71.17 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.295 -0.878 . . . . 0.0 109.457 179.723 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.47 -32.33 73.2 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.34 -0.85 . . . . 0.0 109.087 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.473 ' O ' ' HB3' ' A' ' 67' ' ' LEU . 2.0 t80 -61.78 -38.53 88.39 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-O 121.192 0.52 . . . . 0.0 110.35 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 25.1 m -56.79 -49.67 74.62 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.329 -0.857 . . . . 0.0 110.825 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.434 ' O ' ' HA3' ' A' ' 69' ' ' GLY . 14.0 m -66.18 -36.16 82.36 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.076 -1.015 . . . . 0.0 110.74 -179.514 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.88 -30.12 56.08 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.145 -0.972 . . . . 0.0 110.842 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.543 ' O ' HD12 ' A' ' 67' ' ' LEU . 0.3 OUTLIER -78.18 -46.77 19.64 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.066 -1.021 . . . . 0.0 109.945 -179.632 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.994 ' CE2' HG22 ' A' ' 6' ' ' THR . 12.4 m-85 -100.42 15.26 28.43 Favored 'General case' 0 N--CA 1.492 1.652 0 C-N-CA 119.939 -0.705 . . . . 0.0 110.463 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.434 ' HA3' ' O ' ' A' ' 65' ' ' SER . . . -92.67 51.57 2.64 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.519 -1.432 . . . . 0.0 109.519 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -131.64 -65.6 0.75 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.246 -1.149 . . . . 0.0 110.296 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.8 m -63.02 113.88 3.37 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.238 -0.914 . . . . 0.0 110.249 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -68.42 105.59 2.24 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.249 -0.907 . . . . 0.0 110.27 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.0 tp . . . . . 0 N--CA 1.491 1.577 0 O-C-N 121.252 -0.905 . . . . 0.0 110.204 179.965 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 7' ' ' GLY . . . . . 0.521 ' O ' ' N ' ' B' ' 9' ' ' LYS . . . . . . . . 0 N--CA 1.49 2.296 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.44 ' HE3' HD13 ' A' ' 16' ' ' ILE . 1.5 ttpt 66.22 -62.04 0.27 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.268 -1.137 . . . . 0.0 110.143 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.521 ' N ' ' O ' ' B' ' 7' ' ' GLY . 1.4 ttmt -58.75 -40.25 83.29 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.122 -0.986 . . . . 0.0 110.001 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.06 -35.43 80.21 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.24 -0.912 . . . . 0.0 109.888 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.6 tm-20 -65.96 -40.32 91.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.373 -0.83 . . . . 0.0 110.144 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 12' ' ' ALA . . . . . 0.604 ' HB2' HD12 ' A' ' 16' ' ' ILE . . . -62.54 -41.76 99.09 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.338 -0.851 . . . . 0.0 110.068 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.766 ' O ' HG23 ' B' ' 17' ' ' VAL . 58.1 t -63.36 -40.55 89.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.264 -0.897 . . . . 0.0 109.892 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.77 -39.04 87.33 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.369 -0.832 . . . . 0.0 110.276 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 23.7 m -66.15 -43.67 86.36 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.212 -0.93 . . . . 0.0 110.312 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.438 ' CG2' ' HB2' ' A' ' 13' ' ' SER . 61.5 t -67.53 -40.41 84.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.283 -0.886 . . . . 0.0 110.363 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.766 HG23 ' O ' ' B' ' 13' ' ' VAL . 98.8 t -58.14 -49.0 83.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.233 -0.917 . . . . 0.0 110.498 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.44 -38.83 92.4 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.24 -0.912 . . . . 0.0 110.276 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.45 -46.04 74.24 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.261 -0.9 . . . . 0.0 110.145 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.554 HG11 ' OE1' ' A' ' 37' ' ' GLN . 83.8 t -67.49 -45.92 84.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.291 -0.881 . . . . 0.0 110.091 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.401 ' HB2' ' O ' ' B' ' 17' ' ' VAL . 2.5 t70 -57.46 -38.23 74.13 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.204 -0.935 . . . . 0.0 110.194 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.27 -45.32 72.41 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.226 -0.921 . . . . 0.0 109.946 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.417 ' HB2' HD13 ' A' ' 67' ' ' LEU . . . -64.52 -38.81 92.32 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.372 -0.83 . . . . 0.0 109.84 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 22.1 ttt-85 -61.87 -35.72 79.14 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.232 -0.918 . . . . 0.0 109.928 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 78.0 t -76.5 -21.67 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.29 -0.881 . . . . 0.0 110.199 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.49 20.37 3.96 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.361 -0.837 . . . . 0.0 110.103 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 27' ' ' GLU . . . . . 0.482 ' HA ' ' HD3' ' B' ' 28' ' ' PRO . 28.8 tp10 -105.95 125.17 33.83 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.319 -0.863 . . . . 0.0 110.37 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 28' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' B' ' 27' ' ' GLU . 7.4 Cg_exo -59.11 -24.74 75.08 Favored 'Trans proline' 0 C--N 1.307 -1.616 0 O-C-N 123.993 1.523 . . . . 0.0 110.253 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 14.5 tpt85 . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.277 -0.89 . . . . 0.0 110.236 -179.836 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 ttt . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.241 0.544 . . . . 0.0 110.173 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 47.52 86.12 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.265 -0.897 . . . . 0.0 110.2 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.447 ' HB2' ' HG2' ' A' ' 8' ' ' GLU . 4.8 p-10 -125.86 -170.84 2.26 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.307 -0.871 . . . . 0.0 110.255 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.413 ' HB ' ' HB2' ' A' ' 8' ' ' GLU . 0.2 OUTLIER -122.05 -176.19 3.29 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.256 -0.902 . . . . 0.0 110.201 179.889 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.524 ' O ' ' N ' ' A' ' 7' ' ' ALA . 6.1 p-10 -121.49 156.14 33.43 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.231 -0.918 . . . . 0.0 110.272 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.548 ' CG2' ' CE1' ' A' ' 68' ' ' TYR . 3.4 m 64.08 -69.11 0.09 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.378 -0.826 . . . . 0.0 110.076 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.524 ' N ' ' O ' ' A' ' 5' ' ' ASP . . . -66.57 -44.43 82.29 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.243 -0.91 . . . . 0.0 109.64 179.557 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.447 ' HG2' ' HB2' ' A' ' 3' ' ' ASP . 14.9 tp10 -58.83 -36.52 74.65 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.482 -0.761 . . . . 0.0 109.914 179.636 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.49 -47.68 84.52 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.324 -0.86 . . . . 0.0 110.113 -179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.517 HG12 ' CD2' ' A' ' 14' ' ' PHE . 24.5 t -57.98 -51.18 73.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.289 -0.882 . . . . 0.0 109.784 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.404 HG23 ' HE1' ' A' ' 60' ' ' TYR . 16.5 mt -57.88 -49.7 80.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.392 -0.818 . . . . 0.0 109.621 179.516 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.91 -41.89 83.6 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.289 -0.882 . . . . 0.0 109.183 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 65.3 m -67.96 -37.09 81.14 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.392 -0.817 . . . . 0.0 109.33 179.177 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.591 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 2.1 m-85 -67.91 -44.14 77.61 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.31 -0.869 . . . . 0.0 109.644 179.452 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.68 -48.12 72.79 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.266 -0.896 . . . . 0.0 109.608 179.531 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 60.8 mt -60.33 -42.95 92.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.313 -0.867 . . . . 0.0 109.776 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.604 HD12 ' CD ' ' A' ' 32' ' ' GLU . 1.8 mm? -62.5 -40.54 97.03 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.32 -0.863 . . . . 0.0 109.915 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.486 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -82.9 7.62 14.87 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.394 -0.816 . . . . 0.0 110.295 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.486 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.8 OUTLIER 67.37 66.27 0.4 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.208 -0.933 . . . . 0.0 110.278 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.454 ' N ' ' OD1' ' A' ' 20' ' ' ASP . 1.0 OUTLIER 49.52 62.03 2.84 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.273 -0.892 . . . . 0.0 110.38 179.906 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.598 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 25.6 mttm -140.84 141.96 26.4 Favored Pre-proline 0 N--CA 1.488 1.454 0 O-C-N 121.235 -0.916 . . . . 0.0 110.074 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -72.02 -1.03 9.39 Favored 'Trans proline' 0 C--N 1.305 -1.748 0 O-C-N 124.059 1.558 . . . . 0.0 110.211 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.598 ' CZ ' ' HD3' ' A' ' 21' ' ' LYS . 39.6 p90 -142.07 162.39 35.61 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.287 -0.883 . . . . 0.0 110.035 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.832 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -128.1 140.6 48.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.151 -0.968 . . . . 0.0 110.238 -179.84 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.832 ' N ' HD13 ' A' ' 24' ' ' ILE . 1.1 mt -80.33 144.61 32.63 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.265 -0.897 . . . . 0.0 110.167 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.496 ' HA ' ' CD2' ' A' ' 29' ' ' LEU . . . -62.65 -36.54 83.16 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.338 -0.851 . . . . 0.0 110.296 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -68.25 -34.6 76.51 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.105 -0.997 . . . . 0.0 109.936 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.484 ' O ' ' CG ' ' A' ' 32' ' ' GLU . 62.2 mt-10 -65.88 -50.36 64.8 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.29 -0.881 . . . . 0.0 110.003 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.55 HD12 ' CB ' ' A' ' 38' ' ' ALA . 1.7 pp -67.2 -32.99 74.43 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.2 -0.938 . . . . 0.0 109.933 179.62 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.636 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 6.8 mtt180 -66.35 -34.16 77.35 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.28 -0.887 . . . . 0.0 110.639 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 31' ' ' ARG . 1.5 ttt180 -95.36 -25.54 16.25 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.176 -0.953 . . . . 0.0 111.614 -178.705 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.648 ' HG3' HD12 ' A' ' 33' ' ' LEU . 15.5 pt-20 -92.13 -24.16 19.19 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.815 -1.178 . . . . 0.0 111.204 -178.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.694 HD23 ' CB ' ' A' ' 37' ' ' GLN . 0.1 OUTLIER -108.63 141.89 24.27 Favored Pre-proline 0 N--CA 1.492 1.643 0 O-C-N 121.043 -1.035 . . . . 0.0 110.427 -179.972 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.423 ' O ' ' C ' ' A' ' 35' ' ' PRO . 23.1 Cg_exo -44.54 137.7 8.23 Favored 'Trans proline' 0 C--N 1.303 -1.818 0 O-C-N 124.2 1.632 . . . . 0.0 109.765 179.664 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.423 ' C ' ' O ' ' A' ' 34' ' ' PRO . 37.1 Cg_endo -39.6 -38.49 1.66 Allowed 'Trans proline' 0 C--N 1.305 -1.721 0 O-C-N 124.039 1.547 . . . . 0.0 110.378 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -66.21 -45.71 79.8 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.275 -0.89 . . . . 0.0 110.665 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.694 ' CB ' HD23 ' A' ' 33' ' ' LEU . 52.4 mm-40 -69.97 -42.56 73.0 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.171 -0.955 . . . . 0.0 110.797 -179.429 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.636 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -63.54 -48.76 76.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.107 -0.995 . . . . 0.0 110.521 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.9 tm0? -56.24 -43.08 78.31 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.196 -0.94 . . . . 0.0 110.499 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -66.27 -42.88 87.85 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.228 -0.92 . . . . 0.0 110.285 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 45' ' ' MET . 84.5 m -65.0 -50.93 64.38 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.273 -0.892 . . . . 0.0 110.446 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.539 ' CD1' HD21 ' A' ' 29' ' ' LEU . 19.0 mm -40.41 -32.07 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.291 -0.881 . . . . 0.0 110.325 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.48 -42.19 14.69 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.377 -0.827 . . . . 0.0 110.805 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.586 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 3.9 mmt180 -63.7 -74.71 0.09 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.205 -0.934 . . . . 0.0 110.499 -179.405 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.532 ' HE2' ' CA ' ' A' ' 60' ' ' TYR . 6.8 ptp -56.82 119.48 30.29 Favored Pre-proline 0 N--CA 1.489 1.479 0 O-C-N 121.05 -1.031 . . . . 0.0 110.2 -179.723 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 45' ' ' MET . 11.8 Cg_exo -78.36 -167.05 0.45 Allowed 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 123.972 1.511 . . . . 0.0 110.236 -179.763 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -84.56 139.67 31.95 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.17 -0.956 . . . . 0.0 110.111 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.437 ' CE2' ' HB2' ' A' ' 53' ' ' SER . 24.3 t80 -69.96 100.78 1.65 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.255 -0.903 . . . . 0.0 110.183 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.9 p -84.7 92.72 8.26 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.241 -0.912 . . . . 0.0 110.198 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -124.89 -164.48 11.9 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -83.49 -52.27 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 124.014 1.534 . . . . 0.0 110.16 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.401 ' O ' ' HB3' ' A' ' 53' ' ' SER . . . -100.35 -79.66 1.45 Allowed Glycine 0 N--CA 1.489 2.222 0 N-CA-C 109.359 -1.496 . . . . 0.0 109.359 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.437 ' HB2' ' CE2' ' A' ' 48' ' ' TYR . 10.1 t 54.38 -178.61 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.249 -1.147 . . . . 0.0 110.194 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.404 ' N ' ' OG ' ' A' ' 53' ' ' SER . 5.0 m -134.05 165.62 35.37 Favored Pre-proline 0 C--N 1.295 -1.763 0 O-C-N 121.741 -0.599 . . . . 0.0 110.205 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -70.05 103.63 1.24 Allowed 'Trans proline' 0 C--N 1.306 -1.71 0 O-C-N 123.991 1.522 . . . . 0.0 110.369 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.485 ' O ' ' CD2' ' A' ' 58' ' ' LEU . . . 121.69 15.94 4.29 Favored Glycine 0 N--CA 1.489 2.201 0 N-CA-C 109.724 -1.351 . . . . 0.0 109.724 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.69 ' C ' HD22 ' A' ' 58' ' ' LEU . . . -91.02 121.02 32.48 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.121 -1.223 . . . . 0.0 110.174 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.841 HD22 ' N ' ' A' ' 58' ' ' LEU . 2.5 mm? -116.62 159.61 21.92 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.307 -0.87 . . . . 0.0 110.08 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.453 ' O ' ' HB2' ' A' ' 45' ' ' MET . 88.1 m-20 -109.32 114.36 27.97 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.248 -0.907 . . . . 0.0 110.183 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.591 ' HB2' ' CD2' ' A' ' 14' ' ' PHE . 23.8 p90 -84.31 -24.85 29.67 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.246 -0.909 . . . . 0.0 110.094 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.501 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.26 -35.9 67.94 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.243 -0.911 . . . . 0.0 109.93 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.99 -33.0 73.8 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.289 -0.882 . . . . 0.0 109.972 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.586 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 1.8 t80 -71.66 -32.75 68.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.558 -0.714 . . . . 0.0 110.053 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.8 t -66.27 -47.31 74.08 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.279 -0.888 . . . . 0.0 110.325 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.483 ' O ' ' N ' ' A' ' 69' ' ' GLY . 2.7 t -65.51 -36.83 85.0 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.192 -0.943 . . . . 0.0 110.357 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -75.21 -28.81 60.1 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.185 -0.947 . . . . 0.0 110.272 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.824 HD21 ' HB1' ' B' ' 19' ' ' ALA . 0.4 OUTLIER -78.48 -45.25 22.54 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.214 -0.929 . . . . 0.0 109.584 179.966 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.548 ' CE1' ' CG2' ' A' ' 6' ' ' THR . 17.4 m-85 -93.38 -23.88 18.28 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.485 -0.76 . . . . 0.0 110.281 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.483 ' N ' ' O ' ' A' ' 65' ' ' SER . . . -91.17 56.74 3.23 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 53.87 176.46 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.262 -1.14 . . . . 0.0 110.156 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 37.7 p -132.87 115.3 15.09 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.292 -0.88 . . . . 0.0 110.231 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -71.28 138.68 49.57 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.248 -0.907 . . . . 0.0 110.29 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.434 ' HA ' HD22 ' A' ' 73' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 O-C-N 121.28 -0.887 . . . . 0.0 110.215 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.282 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 4.8 mttt -149.45 -45.32 0.14 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.283 -1.128 . . . . 0.0 110.086 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 14.1 ttmt -61.56 -49.56 76.18 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.269 -0.894 . . . . 0.0 110.083 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.15 -38.14 67.87 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.222 -0.924 . . . . 0.0 109.945 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -66.09 -40.06 90.51 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.286 -0.884 . . . . 0.0 109.814 179.664 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.7 -37.05 84.95 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.32 -0.863 . . . . 0.0 110.07 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.63 ' O ' HG23 ' B' ' 17' ' ' VAL . 76.6 t -62.49 -40.85 89.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.215 -0.928 . . . . 0.0 109.826 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.28 -38.07 82.44 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.345 -0.847 . . . . 0.0 109.999 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 56.3 m -62.93 -50.33 71.24 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.37 -0.831 . . . . 0.0 110.059 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 92.8 t -62.32 -43.91 98.6 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.318 -0.864 . . . . 0.0 110.053 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.63 HG23 ' O ' ' B' ' 13' ' ' VAL . 93.5 t -59.83 -45.24 95.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.256 -0.903 . . . . 0.0 110.038 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.47 -38.06 89.69 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.179 -0.951 . . . . 0.0 110.094 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.824 ' HB1' HD21 ' A' ' 67' ' ' LEU . . . -64.66 -44.15 91.32 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.256 -0.902 . . . . 0.0 110.178 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.56 HG22 ' CZ ' ' A' ' 63' ' ' PHE . 56.4 t -66.16 -39.78 85.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.238 -0.914 . . . . 0.0 110.265 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.401 ' O ' HG23 ' B' ' 25' ' ' VAL . 6.6 t0 -65.46 -31.51 72.64 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.192 -0.942 . . . . 0.0 110.234 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -62.59 -38.21 89.23 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.283 -0.885 . . . . 0.0 110.318 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.74 -39.19 93.68 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.202 -0.936 . . . . 0.0 110.38 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.1 -44.26 92.85 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.246 -0.909 . . . . 0.0 109.965 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 25' ' ' VAL . . . . . 0.401 HG23 ' O ' ' B' ' 21' ' ' ASP . 95.4 t -52.48 -19.37 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.376 -0.828 . . . . 0.0 110.476 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 9.4 ttt180 -71.84 8.75 1.08 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.169 -0.957 . . . . 0.0 111.671 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -84.89 145.22 43.28 Favored Pre-proline 0 N--CA 1.492 1.657 0 O-C-N 121.01 -1.056 . . . . 0.0 109.971 179.47 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -46.28 -75.75 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.66 0 O-C-N 123.855 1.45 . . . . 0.0 110.413 -179.76 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 9.5 mmt180 . . . . . 0 N--CA 1.492 1.64 0 O-C-N 121.184 -0.948 . . . . 0.0 110.186 -179.908 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.493 1.68 0 CA-C-O 121.235 0.541 . . . . 0.0 110.115 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -59.05 -168.27 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.27 -0.893 . . . . 0.0 110.187 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.442 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 19.5 p-10 -132.74 93.01 3.14 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.249 -0.907 . . . . 0.0 110.124 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 15.1 t -140.9 9.2 2.14 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.309 -0.869 . . . . 0.0 110.114 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -131.22 -175.52 3.72 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.277 -0.889 . . . . 0.0 110.27 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -95.46 -47.53 6.23 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.292 -0.88 . . . . 0.0 110.233 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.11 -47.69 83.48 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.235 -0.915 . . . . 0.0 109.82 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -54.4 -36.23 63.71 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.422 -0.799 . . . . 0.0 109.791 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -61.46 -44.58 96.85 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.401 -0.812 . . . . 0.0 110.281 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.544 HG12 ' CD2' ' A' ' 14' ' ' PHE . 41.7 t -62.64 -41.27 91.54 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.14 -0.975 . . . . 0.0 109.967 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 58.6 mt -59.3 -47.11 91.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.32 -0.862 . . . . 0.0 109.743 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.63 -42.59 83.69 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.265 -0.897 . . . . 0.0 109.055 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.454 ' O ' ' HB1' ' B' ' 12' ' ' ALA . 0.0 OUTLIER -67.74 -38.42 83.5 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.437 -0.789 . . . . 0.0 109.21 178.914 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.544 ' CD2' HG12 ' A' ' 10' ' ' VAL . 0.9 OUTLIER -68.42 -43.22 77.64 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.33 -0.857 . . . . 0.0 109.647 179.284 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.1 ttt180 -53.42 -46.42 69.78 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.264 -0.898 . . . . 0.0 109.565 179.479 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.496 HG21 ' HA ' ' B' ' 9' ' ' LYS . 42.7 mt -58.13 -45.01 88.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.23 -0.918 . . . . 0.0 109.705 179.562 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.447 HD11 ' CG2' ' B' ' 13' ' ' VAL . 1.3 mp -63.13 -41.65 99.35 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.396 -0.815 . . . . 0.0 109.74 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.564 ' HB2' ' HB ' ' A' ' 24' ' ' ILE . . . -75.92 -1.78 27.14 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.319 -0.863 . . . . 0.0 110.04 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 67.61 62.43 0.43 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.29 -0.881 . . . . 0.0 110.446 179.997 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' A' ' 19' ' ' SER . 87.0 m-20 54.1 61.22 3.15 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.257 -0.902 . . . . 0.0 110.362 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.418 ' HE3' ' O ' ' A' ' 18' ' ' ALA . 39.2 mtmt -149.03 142.71 16.3 Favored Pre-proline 0 N--CA 1.489 1.495 0 O-C-N 121.297 -0.877 . . . . 0.0 109.86 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -69.9 -3.57 12.37 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 O-C-N 123.981 1.516 . . . . 0.0 110.095 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 33.1 p90 -145.74 159.16 43.58 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.252 -0.905 . . . . 0.0 110.154 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.564 ' HB ' ' HB2' ' A' ' 18' ' ' ALA . 10.5 tt -136.15 153.84 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.213 -0.929 . . . . 0.0 110.216 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.438 HD23 ' HA ' ' A' ' 25' ' ' LEU . 39.9 mt -80.86 134.3 35.74 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.196 -0.94 . . . . 0.0 110.234 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.412 ' HB2' ' CD1' ' A' ' 58' ' ' LEU . . . -55.52 -40.12 71.39 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.231 -0.918 . . . . 0.0 109.875 179.728 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -61.68 -38.29 87.27 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.319 -0.863 . . . . 0.0 109.729 179.622 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.432 ' HG2' ' OE2' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -68.66 -43.73 75.59 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.297 -0.877 . . . . 0.0 109.229 179.315 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.763 ' CD1' HD12 ' A' ' 33' ' ' LEU . 0.8 OUTLIER -64.27 -39.95 94.98 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.513 -0.742 . . . . 0.0 109.199 179.124 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.639 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -58.38 -34.77 71.08 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.544 -0.722 . . . . 0.0 110.236 179.826 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.8 ttt85 -93.12 -17.93 23.2 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.258 -0.901 . . . . 0.0 110.441 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.432 ' OE2' ' HG2' ' A' ' 28' ' ' GLU . 0.4 OUTLIER -88.56 -23.25 23.2 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.168 -0.957 . . . . 0.0 110.352 -179.893 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.763 HD12 ' CD1' ' A' ' 29' ' ' LEU . 13.1 mt -123.61 143.93 42.99 Favored Pre-proline 0 C--N 1.304 -1.381 0 O-C-N 121.231 -0.918 . . . . 0.0 110.383 -179.51 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.429 ' HD2' ' HB2' ' A' ' 37' ' ' GLN . 30.3 Cg_exo -46.62 145.19 6.68 Favored 'Trans proline' 0 C--N 1.305 -1.747 0 O-C-N 123.951 1.5 . . . . 0.0 109.918 179.714 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.424 ' O ' ' HB2' ' A' ' 39' ' ' GLN . 27.8 Cg_endo -42.12 -40.47 6.48 Favored 'Trans proline' 0 C--N 1.304 -1.802 0 O-C-N 123.94 1.495 . . . . 0.0 110.371 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -65.77 -46.92 76.97 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.226 -0.921 . . . . 0.0 110.578 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.474 ' OE1' HG13 ' B' ' 17' ' ' VAL . 1.2 mp0 -69.41 -43.63 73.03 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.219 -0.926 . . . . 0.0 110.289 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.639 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -61.19 -48.13 82.95 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.366 -0.834 . . . . 0.0 110.5 -179.651 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.432 ' O ' ' HB2' ' A' ' 43' ' ' LYS . 9.8 tt0 -57.51 -48.04 80.34 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.174 -0.954 . . . . 0.0 110.106 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -64.02 -41.56 97.42 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.262 -0.899 . . . . 0.0 110.241 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 66.9 m -64.53 -50.77 66.04 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.212 -0.93 . . . . 0.0 110.257 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.493 HG13 HD21 ' A' ' 29' ' ' LEU . 64.2 mt -66.72 -14.42 17.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.269 -0.895 . . . . 0.0 109.955 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.541 ' HD3' ' CZ ' ' A' ' 44' ' ' ARG . 9.8 tttp -73.55 -16.23 61.27 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.379 -0.825 . . . . 0.0 110.253 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.649 ' CB ' ' CD1' ' A' ' 63' ' ' PHE . 5.1 mpt_? -119.06 -58.42 1.94 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.358 -0.839 . . . . 0.0 110.647 -179.6 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.629 ' HE2' ' HA ' ' A' ' 60' ' ' TYR . 3.9 ttm -26.96 90.99 0.05 OUTLIER Pre-proline 0 N--CA 1.499 1.994 0 O-C-N 121.973 -0.454 . . . . 0.0 111.529 -179.663 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.52 ' N ' ' O ' ' A' ' 44' ' ' ARG . 18.1 Cg_endo -67.01 -166.5 0.12 Allowed 'Trans proline' 0 C--N 1.305 -1.728 0 O-C-N 124.141 1.601 . . . . 0.0 110.172 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.453 ' O ' ' O ' ' A' ' 48' ' ' TYR . . . -74.4 134.93 42.39 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.259 -0.901 . . . . 0.0 110.231 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.554 ' CD2' ' HB3' ' A' ' 53' ' ' SER . 0.0 OUTLIER -43.53 168.71 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.34 -0.85 . . . . 0.0 110.6 179.952 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.66 -34.75 4.14 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.244 -0.91 . . . . 0.0 110.09 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -70.97 132.85 22.06 Favored Glycine 0 N--CA 1.49 2.241 0 N-CA-C 109.426 -1.469 . . . . 0.0 109.426 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.76 159.88 43.32 Favored 'Trans proline' 0 C--N 1.304 -1.789 0 O-C-N 123.972 1.511 . . . . 0.0 110.173 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.455 ' O ' ' C ' ' A' ' 53' ' ' SER . . . 98.9 -103.34 2.73 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.554 ' HB3' ' CD2' ' A' ' 48' ' ' TYR . 0.3 OUTLIER 39.19 -156.2 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.285 0 O-C-N 121.505 -0.997 . . . . 0.0 110.663 179.789 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.511 ' N ' ' OG ' ' A' ' 53' ' ' SER . 9.6 m -127.94 -179.69 1.03 Allowed Pre-proline 0 C--N 1.294 -1.831 0 O-C-N 121.593 -0.692 . . . . 0.0 110.322 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -78.43 92.29 1.15 Allowed 'Trans proline' 0 C--N 1.306 -1.706 0 O-C-N 123.998 1.525 . . . . 0.0 110.273 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 121.79 26.27 1.96 Allowed Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.02 144.05 26.74 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.213 -1.169 . . . . 0.0 110.205 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.439 ' HB3' ' HG2' ' A' ' 45' ' ' MET . 45.0 mt -130.05 160.15 34.56 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.237 -0.914 . . . . 0.0 109.997 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.486 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.8 OUTLIER -113.38 110.77 20.86 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.086 -1.008 . . . . 0.0 110.706 179.925 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.629 ' HA ' ' HE2' ' A' ' 45' ' ' MET . 18.3 p90 -73.01 -28.12 62.18 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.26 -0.9 . . . . 0.0 109.512 179.283 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.612 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.09 -43.42 78.02 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.445 -0.784 . . . . 0.0 109.881 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.466 ' HB3' ' OD1' ' A' ' 59' ' ' ASP . . . -62.34 -33.3 74.44 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.252 -0.905 . . . . 0.0 109.798 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.649 ' CD1' ' CB ' ' A' ' 44' ' ' ARG . 4.0 t80 -72.12 -34.58 68.7 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.605 -0.684 . . . . 0.0 110.207 179.761 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.28 -49.67 74.73 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.259 -0.901 . . . . 0.0 110.388 -179.716 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.463 ' O ' ' N ' ' A' ' 69' ' ' GLY . 22.1 t -58.46 -39.06 78.9 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.178 -0.951 . . . . 0.0 110.293 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.06 -39.76 75.47 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.32 -0.863 . . . . 0.0 110.245 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.632 HD11 ' CZ ' ' A' ' 63' ' ' PHE . 1.8 mt -59.91 -40.04 87.44 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.24 -0.913 . . . . 0.0 110.277 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -98.77 -16.08 19.07 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.238 -0.914 . . . . 0.0 110.252 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.463 ' N ' ' O ' ' A' ' 65' ' ' SER . . . 91.53 172.11 42.71 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.4 -1.48 . . . . 0.0 109.4 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.441 ' O ' ' CB ' ' A' ' 71' ' ' SER . 23.1 tp10 -157.69 -64.16 0.09 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.192 -1.181 . . . . 0.0 110.247 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.441 ' CB ' ' O ' ' A' ' 70' ' ' GLU . 0.3 OUTLIER 65.28 150.34 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.287 -0.883 . . . . 0.0 110.25 -179.991 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -84.55 124.3 31.26 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.301 -0.874 . . . . 0.0 110.199 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.491 1.611 0 O-C-N 121.191 -0.943 . . . . 0.0 110.216 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 7' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' B' ' 9' ' ' LYS . . . . . . . . 0 N--CA 1.491 2.308 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.454 ' CB ' ' O ' ' B' ' 7' ' ' GLY . 0.7 OUTLIER 65.77 -64.74 0.19 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.267 -1.137 . . . . 0.0 110.218 179.995 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.497 ' N ' ' O ' ' B' ' 7' ' ' GLY . 1.4 ttpt -62.39 -42.3 99.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.23 -0.919 . . . . 0.0 110.011 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.31 -36.11 75.04 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.265 -0.897 . . . . 0.0 109.911 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.42 -42.16 83.68 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.253 -0.904 . . . . 0.0 109.938 179.739 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 12' ' ' ALA . . . . . 0.561 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -62.72 -40.89 98.6 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.299 -0.875 . . . . 0.0 109.445 179.494 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.596 ' O ' HG23 ' B' ' 17' ' ' VAL . 73.7 t -63.36 -40.39 88.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.356 -0.84 . . . . 0.0 109.493 179.307 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.71 -35.82 79.15 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.39 -0.819 . . . . 0.0 110.074 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 2.4 m -70.07 -47.22 62.82 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.214 -0.929 . . . . 0.0 110.319 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.561 HG23 ' O ' ' B' ' 12' ' ' ALA . 23.1 t -62.33 -43.09 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.248 -0.908 . . . . 0.0 110.352 -179.757 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.596 HG23 ' O ' ' B' ' 13' ' ' VAL . 88.1 t -62.08 -51.04 77.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.276 -0.89 . . . . 0.0 110.334 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.68 -40.16 86.89 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.213 -0.929 . . . . 0.0 110.286 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.85 -41.21 97.84 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.201 -0.937 . . . . 0.0 110.196 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.47 HG23 ' O ' ' B' ' 16' ' ' VAL . 71.5 t -66.79 -41.29 87.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.191 -0.943 . . . . 0.0 110.223 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.617 ' O ' HG23 ' B' ' 25' ' ' VAL . 13.6 t70 -64.58 -39.59 94.0 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.273 -0.892 . . . . 0.0 110.307 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -58.44 -47.52 83.7 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.085 -1.009 . . . . 0.0 110.308 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.499 ' HB2' HD22 ' A' ' 67' ' ' LEU . . . -57.3 -40.8 78.6 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.31 -0.869 . . . . 0.0 110.345 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 3.4 mmm-85 -66.19 -40.64 90.56 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.262 -0.899 . . . . 0.0 110.192 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 25' ' ' VAL . . . . . 0.617 HG23 ' O ' ' B' ' 21' ' ' ASP . 58.7 t -63.05 -21.54 28.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.275 -0.891 . . . . 0.0 110.221 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 4.9 ttt-85 -109.95 22.38 15.7 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.384 -0.823 . . . . 0.0 110.191 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -85.45 120.62 73.3 Favored Pre-proline 0 N--CA 1.493 1.696 0 O-C-N 121.264 -0.897 . . . . 0.0 110.242 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -50.24 175.78 0.04 OUTLIER 'Trans proline' 0 C--N 1.306 -1.687 0 O-C-N 123.969 1.51 . . . . 0.0 110.229 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 3.7 ttt85 . . . . . 0 N--CA 1.492 1.661 0 O-C-N 121.307 -0.871 . . . . 0.0 110.208 -179.935 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 ttt . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.268 0.556 . . . . 0.0 110.233 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -155.21 -47.0 0.08 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.245 -0.909 . . . . 0.0 110.138 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -123.13 175.47 6.62 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.182 -0.949 . . . . 0.0 110.066 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 46.1 p -142.54 120.85 12.31 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.192 -0.942 . . . . 0.0 110.185 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -168.56 -68.97 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.186 -0.946 . . . . 0.0 110.272 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -149.17 -67.01 0.22 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.189 -0.945 . . . . 0.0 110.208 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.504 ' O ' HD12 ' A' ' 11' ' ' ILE . . . -63.55 -50.01 71.19 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.243 -0.91 . . . . 0.0 109.821 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -36.7 65.53 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.392 -0.817 . . . . 0.0 109.942 179.674 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.1 tp60 -61.61 -37.49 84.12 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.232 -0.917 . . . . 0.0 110.2 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.435 HG12 ' HD2' ' A' ' 14' ' ' PHE . 66.9 t -58.13 -43.49 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.163 -0.961 . . . . 0.0 109.951 179.805 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.504 HD12 ' O ' ' A' ' 7' ' ' ALA . 2.2 mp -62.77 -48.66 87.05 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.278 -0.889 . . . . 0.0 109.54 179.541 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.69 -42.31 83.39 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.213 -0.93 . . . . 0.0 109.095 179.184 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.418 ' HA ' ' HB1' ' B' ' 12' ' ' ALA . 4.7 p -66.68 -39.14 88.0 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.394 -0.816 . . . . 0.0 109.046 178.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.541 ' HB3' ' CZ ' ' A' ' 60' ' ' TYR . 1.1 m-85 -68.6 -41.91 78.92 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.374 -0.829 . . . . 0.0 109.522 179.039 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.9 ttt180 -54.12 -44.02 70.97 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.341 -0.849 . . . . 0.0 109.629 179.463 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.635 HG21 ' HA ' ' B' ' 9' ' ' LYS . 68.3 mt -62.63 -44.93 99.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.409 -0.807 . . . . 0.0 109.859 179.607 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.404 HD23 HD12 ' A' ' 33' ' ' LEU . 6.4 mp -65.0 -34.4 78.36 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.373 -0.829 . . . . 0.0 109.899 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.491 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -81.07 -1.62 44.9 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.32 -0.863 . . . . 0.0 110.162 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.414 ' HB3' ' O ' ' A' ' 18' ' ' ALA . 8.8 t 59.01 74.75 0.43 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.251 -0.905 . . . . 0.0 110.206 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 47.77 62.63 2.37 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.267 -0.896 . . . . 0.0 110.208 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.586 ' HD2' ' CZ ' ' A' ' 23' ' ' TYR . 0.8 OUTLIER -145.96 142.91 18.34 Favored Pre-proline 0 N--CA 1.489 1.493 0 O-C-N 121.239 -0.913 . . . . 0.0 110.144 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -76.37 3.2 6.51 Favored 'Trans proline' 0 C--N 1.303 -1.831 0 O-C-N 124.094 1.576 . . . . 0.0 110.127 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.586 ' CZ ' ' HD2' ' A' ' 21' ' ' LYS . 9.1 p90 -148.91 167.9 24.5 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.224 -0.922 . . . . 0.0 110.228 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.718 HD13 ' H ' ' A' ' 25' ' ' LEU . 0.3 OUTLIER -129.11 145.48 35.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.19 -0.944 . . . . 0.0 110.053 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.718 ' H ' HD13 ' A' ' 24' ' ' ILE . 4.7 mt -89.42 151.18 22.16 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.236 -0.915 . . . . 0.0 110.235 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.82 -39.35 91.49 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.229 -0.92 . . . . 0.0 110.046 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -65.52 -34.9 79.33 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.298 -0.876 . . . . 0.0 110.077 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.454 ' HB3' HD11 ' A' ' 24' ' ' ILE . 12.2 mm-40 -62.07 -46.42 89.17 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.399 -0.813 . . . . 0.0 110.15 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.404 HD21 HG13 ' A' ' 24' ' ' ILE . 21.7 mt -59.86 -35.38 74.67 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.237 -0.914 . . . . 0.0 109.961 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.2 mmm-85 -69.06 -35.74 76.87 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.299 -0.876 . . . . 0.0 110.696 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -90.1 -29.79 18.09 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.149 -0.969 . . . . 0.0 110.71 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.434 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 3.1 mm-40 -91.61 -23.19 19.94 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.107 -0.996 . . . . 0.0 110.57 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.924 HD22 ' HB3' ' A' ' 37' ' ' GLN . 0.3 OUTLIER -128.48 144.95 53.97 Favored Pre-proline 0 N--CA 1.489 1.48 0 O-C-N 121.073 -1.017 . . . . 0.0 110.385 -179.715 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.781 ' HD2' HD23 ' A' ' 33' ' ' LEU . 2.6 Cg_endo -49.01 142.09 20.8 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 O-C-N 124.082 1.57 . . . . 0.0 110.107 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -43.31 -33.56 4.01 Favored 'Trans proline' 0 C--N 1.304 -1.792 0 O-C-N 124.005 1.529 . . . . 0.0 110.611 -179.792 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -65.38 -47.11 77.52 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.112 -0.992 . . . . 0.0 110.341 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.924 ' HB3' HD22 ' A' ' 33' ' ' LEU . 1.7 mp0 -70.18 -42.1 72.85 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.189 -0.945 . . . . 0.0 110.355 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.28 -42.61 77.74 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.258 -0.901 . . . . 0.0 110.62 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -60.53 -48.55 81.29 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.168 -0.957 . . . . 0.0 110.429 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -63.51 -46.74 84.69 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.162 -0.961 . . . . 0.0 110.471 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 89.0 m -65.3 -41.06 94.47 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.257 -0.902 . . . . 0.0 110.623 -179.615 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 63.0 mt -67.85 -23.03 28.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.183 -0.948 . . . . 0.0 110.601 -179.703 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -84.79 -23.54 29.12 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.191 -0.943 . . . . 0.0 110.783 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.502 ' HG2' ' CE1' ' A' ' 63' ' ' PHE . 0.7 OUTLIER -92.49 -56.91 2.85 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.108 -0.995 . . . . 0.0 110.641 -179.544 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.565 ' HE1' ' HB3' ' A' ' 60' ' ' TYR . 0.6 OUTLIER -33.98 103.57 0.23 Allowed Pre-proline 0 N--CA 1.496 1.839 0 O-C-N 121.606 -0.684 . . . . 0.0 111.059 -179.845 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.426 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 32.2 Cg_exo -60.6 -146.3 0.01 OUTLIER 'Trans proline' 0 C--N 1.307 -1.65 0 O-C-N 124.122 1.59 . . . . 0.0 110.359 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.433 ' O ' ' C ' ' A' ' 48' ' ' TYR . . . -99.28 115.14 28.47 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.363 -0.836 . . . . 0.0 110.031 179.853 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.572 ' CD2' ' HB3' ' A' ' 53' ' ' SER . 23.1 p90 -41.7 156.57 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.391 -0.818 . . . . 0.0 110.343 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -153.42 41.34 0.54 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.305 -0.872 . . . . 0.0 110.077 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -104.89 -164.16 24.09 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -100.16 164.03 0.47 Allowed 'Trans proline' 0 C--N 1.307 -1.648 0 O-C-N 123.993 1.523 . . . . 0.0 110.432 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.484 ' O ' ' O ' ' A' ' 53' ' ' SER . . . 49.39 24.46 5.28 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.575 ' O ' HG13 ' A' ' 54' ' ' VAL . 1.0 OUTLIER -54.92 -160.16 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.3 0 O-C-N 121.342 -1.093 . . . . 0.0 110.657 -179.637 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.739 ' CG2' ' HB2' ' A' ' 57' ' ' ALA . 17.3 m -157.03 -177.29 0.72 Allowed Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.264 -0.898 . . . . 0.0 110.149 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.413 ' HD2' ' HB ' ' A' ' 54' ' ' VAL . 12.4 Cg_endo -89.0 105.33 0.41 Allowed 'Trans proline' 0 C--N 1.305 -1.736 0 O-C-N 124.045 1.55 . . . . 0.0 110.292 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 108.9 19.31 8.69 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.739 ' HB2' ' CG2' ' A' ' 54' ' ' VAL . . . -91.35 140.23 29.97 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.334 -1.097 . . . . 0.0 110.356 -179.919 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.459 ' HB3' ' HB3' ' A' ' 45' ' ' MET . 15.0 mt -127.86 154.31 45.62 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.331 -0.856 . . . . 0.0 109.871 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.483 ' C ' ' HG3' ' A' ' 45' ' ' MET . 5.5 m-20 -105.23 110.87 23.4 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.105 -0.997 . . . . 0.0 110.552 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.565 ' HB3' ' HE1' ' A' ' 45' ' ' MET . 22.2 p90 -80.42 -21.22 42.43 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.322 -0.861 . . . . 0.0 109.759 179.542 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.509 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.9 -37.85 69.42 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.372 -0.83 . . . . 0.0 109.808 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.426 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -65.06 -33.75 76.78 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.246 -0.909 . . . . 0.0 109.642 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.502 ' CE1' ' HG2' ' A' ' 44' ' ' ARG . 1.5 t80 -71.91 -35.93 69.83 Favored 'General case' 0 C--N 1.299 -1.597 0 O-C-N 121.553 -0.717 . . . . 0.0 109.874 179.539 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.34 -49.61 76.58 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.279 -0.888 . . . . 0.0 110.074 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 41.8 m -64.3 -36.85 85.44 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.183 -0.948 . . . . 0.0 110.05 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.47 -34.43 72.39 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.297 -0.877 . . . . 0.0 110.024 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.59 HD21 ' HB2' ' B' ' 23' ' ' ALA . 0.2 OUTLIER -61.38 -44.75 96.62 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.285 -0.884 . . . . 0.0 109.955 179.891 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -99.95 3.96 44.67 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.298 -0.876 . . . . 0.0 110.129 179.676 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.461 ' O ' ' HB3' ' A' ' 70' ' ' GLU . . . -73.82 -135.47 0.31 Allowed Glycine 0 N--CA 1.489 2.207 0 N-CA-C 109.752 -1.339 . . . . 0.0 109.752 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.461 ' HB3' ' O ' ' A' ' 69' ' ' GLY . 9.2 tt0 63.83 69.53 0.54 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.275 -1.132 . . . . 0.0 110.077 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.4 ' OG ' ' N ' ' A' ' 72' ' ' ASP . 1.8 t -167.59 179.13 5.02 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.312 -0.868 . . . . 0.0 110.099 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.4 ' N ' ' OG ' ' A' ' 71' ' ' SER . 13.6 p-10 -101.74 131.72 47.86 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.203 -0.935 . . . . 0.0 110.248 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.638 0 O-C-N 121.228 -0.92 . . . . 0.0 110.275 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.265 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.453 ' O ' ' HG3' ' B' ' 8' ' ' LYS . 5.5 ptpp? -101.54 37.75 1.74 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.237 -1.155 . . . . 0.0 110.264 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.635 ' HA ' HG21 ' A' ' 16' ' ' ILE . 3.4 ttmt -57.66 -49.18 77.34 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.191 -0.943 . . . . 0.0 109.882 179.874 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.69 -33.84 64.53 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.252 -0.905 . . . . 0.0 109.612 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.66 -40.55 84.51 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.352 -0.843 . . . . 0.0 109.878 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 12' ' ' ALA . . . . . 0.599 ' HB2' HD12 ' A' ' 16' ' ' ILE . . . -62.66 -42.78 99.8 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.324 -0.86 . . . . 0.0 109.715 179.682 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.92 ' O ' HG23 ' B' ' 17' ' ' VAL . 70.2 t -59.48 -40.46 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.358 -0.839 . . . . 0.0 109.593 179.464 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.9 -41.41 87.15 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.402 -0.811 . . . . 0.0 109.893 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.11 -44.95 94.21 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.357 -0.839 . . . . 0.0 110.129 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.445 ' O ' HG23 ' B' ' 20' ' ' VAL . 95.6 t -64.31 -42.9 96.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.302 -0.873 . . . . 0.0 109.921 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.92 HG23 ' O ' ' B' ' 13' ' ' VAL . 22.1 t -61.29 -48.21 89.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.311 -0.868 . . . . 0.0 110.025 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.71 -45.87 90.76 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.249 -0.907 . . . . 0.0 109.995 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.01 -45.57 88.35 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.254 -0.904 . . . . 0.0 110.048 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.445 HG23 ' O ' ' B' ' 16' ' ' VAL . 46.9 t -62.6 -43.02 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.156 -0.965 . . . . 0.0 109.887 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.09 -36.85 75.83 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.252 -0.905 . . . . 0.0 109.972 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.63 -44.52 96.07 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.318 -0.864 . . . . 0.0 109.903 179.838 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.59 ' HB2' HD21 ' A' ' 67' ' ' LEU . . . -63.1 -35.08 79.08 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.308 -0.87 . . . . 0.0 110.258 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 44.3 ttt180 -67.08 -38.74 86.26 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.311 -0.868 . . . . 0.0 110.369 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 23.7 t -78.49 -21.53 13.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.184 -0.948 . . . . 0.0 110.328 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 7.0 ttp180 -103.44 23.27 12.83 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.271 -0.893 . . . . 0.0 110.279 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -97.53 149.83 36.14 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.194 -0.941 . . . . 0.0 110.142 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -97.18 107.2 0.09 OUTLIER 'Trans proline' 0 C--N 1.304 -1.768 0 O-C-N 123.919 1.484 . . . . 0.0 110.391 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 . . . . . 0 N--CA 1.492 1.652 0 O-C-N 121.192 -0.942 . . . . 0.0 110.233 179.972 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 ttp . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.215 0.531 . . . . 0.0 110.176 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -135.3 71.72 1.44 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.241 -0.912 . . . . 0.0 110.285 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -117.7 131.43 56.63 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.245 -0.909 . . . . 0.0 110.132 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 9.8 t -159.39 137.64 10.49 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.225 -0.922 . . . . 0.0 110.349 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -156.43 -79.76 0.08 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.292 -0.88 . . . . 0.0 110.176 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -132.51 -59.27 0.92 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.222 -0.923 . . . . 0.0 110.035 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -66.91 -44.84 79.72 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.307 -0.871 . . . . 0.0 109.681 179.706 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -54.66 -35.71 63.82 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.426 -0.796 . . . . 0.0 109.789 179.44 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -60.9 -45.33 95.06 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.295 -0.878 . . . . 0.0 109.986 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.518 HG12 ' HD2' ' A' ' 14' ' ' PHE . 61.8 t -63.87 -43.83 97.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.183 -0.948 . . . . 0.0 109.46 179.472 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 86.3 mt -60.67 -45.7 97.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.389 -0.819 . . . . 0.0 109.369 179.293 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.54 -41.67 81.4 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.327 -0.858 . . . . 0.0 108.778 179.12 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.546 ' HA ' ' HB1' ' B' ' 12' ' ' ALA . 2.6 m -68.03 -39.53 83.1 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 178.687 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.587 ' HB3' ' CZ ' ' A' ' 60' ' ' TYR . 2.6 m-85 -68.47 -41.96 79.41 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.481 -0.762 . . . . 0.0 109.506 179.205 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -53.39 -45.84 69.43 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.298 -0.876 . . . . 0.0 109.436 179.428 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.471 HG21 ' HA ' ' B' ' 9' ' ' LYS . 49.7 mt -62.34 -41.3 91.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.415 -0.803 . . . . 0.0 109.711 179.387 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.404 HD11 HG22 ' B' ' 13' ' ' VAL . 2.2 mp -65.02 -38.58 91.38 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.313 -0.867 . . . . 0.0 110.0 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.515 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -85.5 3.68 39.28 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.311 -0.868 . . . . 0.0 110.334 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.473 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 0.1 OUTLIER 60.6 61.39 1.73 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.248 -0.908 . . . . 0.0 110.379 179.949 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' A' ' 19' ' ' SER . 1.2 m-20 56.13 61.94 2.55 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.218 -0.926 . . . . 0.0 110.439 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.515 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 89.8 mttt -144.84 138.68 14.58 Favored Pre-proline 0 N--CA 1.489 1.494 0 O-C-N 121.287 -0.883 . . . . 0.0 109.733 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -68.3 -3.69 11.36 Favored 'Trans proline' 0 C--N 1.304 -1.8 0 O-C-N 124.008 1.53 . . . . 0.0 110.44 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 18.5 p90 -138.79 156.52 47.28 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.173 -0.954 . . . . 0.0 110.145 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.798 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -128.93 138.19 55.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.259 -0.9 . . . . 0.0 110.235 -179.803 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.798 ' N ' HD13 ' A' ' 24' ' ' ILE . 0.8 OUTLIER -80.54 141.9 34.67 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.277 -0.889 . . . . 0.0 110.41 -179.862 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.21 -40.63 94.71 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.37 -0.831 . . . . 0.0 110.455 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -55.97 -36.78 68.22 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.273 -0.892 . . . . 0.0 110.516 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.413 ' HB3' HD11 ' A' ' 24' ' ' ILE . 1.9 tt0 -67.42 -45.55 75.79 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.198 -0.939 . . . . 0.0 109.888 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.67 ' HG ' HD12 ' A' ' 24' ' ' ILE . 20.4 mt -60.77 -36.68 79.57 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.241 -0.912 . . . . 0.0 109.756 179.697 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.0 tpt180 -62.21 -34.63 76.84 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.33 -0.856 . . . . 0.0 109.643 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 7.4 ttp180 -92.92 -35.91 13.07 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.325 -0.86 . . . . 0.0 110.212 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -77.98 -23.76 48.27 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.334 -0.853 . . . . 0.0 110.744 -179.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.675 HD22 ' HB3' ' A' ' 37' ' ' GLN . 0.2 OUTLIER -125.46 163.5 38.17 Favored Pre-proline 0 N--CA 1.487 1.409 0 O-C-N 121.094 -1.004 . . . . 0.0 110.422 -179.622 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.485 ' HB2' ' OD2' ' A' ' 36' ' ' ASP . 39.6 Cg_exo -64.58 149.58 89.63 Favored 'Trans proline' 0 C--N 1.305 -1.754 0 O-C-N 124.035 1.545 . . . . 0.0 110.101 179.774 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -43.72 -44.85 11.29 Favored 'Trans proline' 0 C--N 1.304 -1.8 0 O-C-N 124.035 1.545 . . . . 0.0 110.418 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.49 ' OD1' ' NE2' ' A' ' 37' ' ' GLN . 3.4 p30 -65.89 -40.06 91.22 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.174 -0.954 . . . . 0.0 110.68 -179.729 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.675 ' HB3' HD22 ' A' ' 33' ' ' LEU . 76.0 mm-40 -70.07 -38.54 75.77 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.007 -1.058 . . . . 0.0 110.434 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.2 -42.44 93.53 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.162 -0.961 . . . . 0.0 110.363 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.414 ' O ' ' HB2' ' A' ' 43' ' ' LYS . 2.6 tt0 -58.54 -48.98 79.07 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.182 -0.949 . . . . 0.0 110.213 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -66.33 -48.08 71.42 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.242 -0.911 . . . . 0.0 110.17 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 89.6 m -65.39 -43.08 91.78 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.414 -0.804 . . . . 0.0 110.531 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 83.8 mt -71.2 -21.17 21.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.164 -0.96 . . . . 0.0 110.364 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 39' ' ' GLN . 38.5 ttmt -84.31 -43.59 14.64 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.176 -0.952 . . . . 0.0 110.382 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.613 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 1.6 mmp_? -68.83 -62.87 1.2 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.198 -0.939 . . . . 0.0 110.459 -179.806 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.678 ' HE1' ' HB3' ' A' ' 60' ' ' TYR . 2.3 ttm -30.43 118.1 0.33 Allowed Pre-proline 0 N--CA 1.494 1.768 0 O-C-N 121.853 -0.529 . . . . 0.0 111.336 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.565 ' O ' HD23 ' A' ' 58' ' ' LEU . 9.6 Cg_endo -74.14 -157.56 0.06 OUTLIER 'Trans proline' 0 C--N 1.306 -1.694 0 O-C-N 124.084 1.571 . . . . 0.0 110.321 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.602 ' O ' ' CD1' ' A' ' 48' ' ' TYR . . . -97.15 81.12 3.0 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.277 -0.889 . . . . 0.0 110.497 -179.802 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.602 ' CD1' ' O ' ' A' ' 47' ' ' ALA . 16.0 p90 36.4 -160.81 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.904 0 CA-C-O 121.456 0.645 . . . . 0.0 111.3 179.752 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -148.77 11.05 0.84 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.284 -0.885 . . . . 0.0 110.433 -179.74 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -112.24 -164.53 17.01 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.395 -1.482 . . . . 0.0 109.395 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -116.19 18.53 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.65 0 O-C-N 123.84 1.442 . . . . 0.0 110.326 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.479 ' O ' ' O ' ' A' ' 53' ' ' SER . . . -128.1 51.02 0.87 Allowed Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.868 -1.293 . . . . 0.0 109.868 -179.834 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.479 ' O ' ' O ' ' A' ' 52' ' ' GLY . 0.9 OUTLIER -51.56 -171.5 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.276 0 O-C-N 121.27 -1.135 . . . . 0.0 110.555 -179.89 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.961 HG23 ' HB2' ' A' ' 57' ' ' ALA . 0.0 OUTLIER -156.81 179.39 1.37 Allowed Pre-proline 0 N--CA 1.495 1.79 0 O-C-N 121.587 -0.696 . . . . 0.0 109.775 179.746 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.463 ' HD2' ' HB ' ' A' ' 54' ' ' VAL . 6.6 Cg_endo -59.56 78.53 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.733 0 O-C-N 123.948 1.499 . . . . 0.0 110.489 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.601 ' O ' HD23 ' A' ' 25' ' ' LEU . . . 90.92 92.24 1.3 Allowed Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.95 -1.26 . . . . 0.0 109.95 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.961 ' HB2' HG23 ' A' ' 54' ' ' VAL . . . -148.42 130.26 15.18 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.237 -1.155 . . . . 0.0 110.135 179.781 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.565 HD23 ' O ' ' A' ' 46' ' ' PRO . 1.1 mt -135.54 160.34 38.78 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.245 -0.91 . . . . 0.0 110.29 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.454 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.5 OUTLIER -107.16 111.26 23.6 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.34 -0.85 . . . . 0.0 110.138 179.759 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.678 ' HB3' ' HE1' ' A' ' 45' ' ' MET . 17.9 p90 -72.57 -23.69 61.0 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.286 -0.883 . . . . 0.0 110.081 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.516 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.88 -35.81 66.92 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.251 -0.906 . . . . 0.0 109.787 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.2 -34.26 75.93 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.285 -0.885 . . . . 0.0 109.821 179.521 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.613 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 12.1 t80 -72.04 -34.81 69.07 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.633 -0.667 . . . . 0.0 110.292 179.761 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.4 m -57.04 -49.72 74.95 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.21 -0.932 . . . . 0.0 110.461 -179.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.502 ' O ' ' N ' ' A' ' 69' ' ' GLY . 1.2 m -57.89 -35.71 71.39 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.171 -0.956 . . . . 0.0 110.614 -179.693 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.17 -46.09 82.24 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.13 -0.981 . . . . 0.0 110.635 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.469 HD21 ' CE1' ' A' ' 63' ' ' PHE . 0.1 OUTLIER -62.08 -43.54 98.61 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.253 -0.904 . . . . 0.0 110.593 -179.695 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -90.29 -16.62 28.93 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.182 -0.948 . . . . 0.0 110.509 -179.633 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.502 ' N ' ' O ' ' A' ' 65' ' ' SER . . . 112.09 124.27 4.37 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.429 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 10.4 pt-20 -104.61 39.36 1.69 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.266 -1.138 . . . . 0.0 110.243 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.6 t -146.61 170.03 17.77 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.169 -0.957 . . . . 0.0 110.226 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 46.8 t0 -69.42 133.75 48.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.18 -0.95 . . . . 0.0 110.153 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 24.0 mt . . . . . 0 N--CA 1.491 1.59 0 O-C-N 121.261 -0.899 . . . . 0.0 110.223 179.976 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.323 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.93 -39.77 4.71 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.19 -1.183 . . . . 0.0 110.203 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.759 ' O ' HG23 ' B' ' 13' ' ' VAL . 0.0 OUTLIER -70.81 -51.01 29.45 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.206 -0.934 . . . . 0.0 110.027 179.945 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.34 -40.57 71.37 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.258 -0.901 . . . . 0.0 109.943 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -65.63 -40.77 92.92 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.331 -0.856 . . . . 0.0 110.168 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 12' ' ' ALA . . . . . 0.546 ' HB1' ' HA ' ' A' ' 13' ' ' SER . . . -67.43 -38.01 83.9 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.269 -0.894 . . . . 0.0 110.2 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.759 HG23 ' O ' ' B' ' 9' ' ' LYS . 46.9 t -63.13 -44.14 99.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.328 -0.858 . . . . 0.0 110.152 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.2 -41.84 89.52 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.195 -0.94 . . . . 0.0 110.226 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 28.3 m -63.77 -37.43 87.32 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.317 -0.864 . . . . 0.0 110.234 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.664 ' O ' HG23 ' B' ' 20' ' ' VAL . 88.0 t -68.89 -46.43 79.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.202 -0.936 . . . . 0.0 110.198 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.517 HG23 ' O ' ' B' ' 13' ' ' VAL . 59.3 t -58.74 -43.52 88.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.225 -0.922 . . . . 0.0 110.195 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.97 -44.72 91.88 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.266 -0.897 . . . . 0.0 110.243 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.27 -43.54 94.49 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.196 -0.94 . . . . 0.0 110.22 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.664 HG23 ' O ' ' B' ' 16' ' ' VAL . 61.2 t -66.96 -42.5 88.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.323 -0.861 . . . . 0.0 110.328 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.856 ' O ' HG23 ' B' ' 25' ' ' VAL . 3.1 t0 -60.82 -31.63 71.03 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.252 -0.905 . . . . 0.0 110.376 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -59.24 -51.24 70.83 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.184 -0.948 . . . . 0.0 110.251 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.4 -38.24 87.06 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.245 -0.909 . . . . 0.0 110.148 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.68 -32.38 74.03 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.385 -0.822 . . . . 0.0 110.512 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 25' ' ' VAL . . . . . 0.856 HG23 ' O ' ' B' ' 21' ' ' ASP . 79.2 t -64.22 -26.36 40.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.213 -0.929 . . . . 0.0 110.586 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 15.0 mmt180 -108.5 28.74 8.06 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.401 -0.812 . . . . 0.0 110.181 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -79.95 124.15 83.27 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.306 -0.871 . . . . 0.0 110.007 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -47.62 -58.45 1.73 Allowed 'Trans proline' 0 C--N 1.307 -1.635 0 O-C-N 123.952 1.501 . . . . 0.0 110.219 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 O-C-N 121.261 -0.9 . . . . 0.0 110.225 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.9 mtp . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.286 0.565 . . . . 0.0 110.114 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.9 176.94 10.29 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.288 -0.882 . . . . 0.0 110.143 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -171.6 101.9 0.19 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.209 -0.932 . . . . 0.0 110.257 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 60.65 109.04 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.279 -0.888 . . . . 0.0 110.252 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -109.96 40.4 1.93 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.289 -0.882 . . . . 0.0 110.204 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.417 HG22 ' CE1' ' A' ' 68' ' ' TYR . 6.6 m -110.64 -67.41 1.0 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.326 -0.859 . . . . 0.0 110.159 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.54 -46.04 84.54 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.249 -0.907 . . . . 0.0 109.71 179.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -57.61 -36.65 72.06 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.402 -0.811 . . . . 0.0 109.879 179.57 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 37.3 tt0 -61.61 -45.85 92.33 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.263 -0.898 . . . . 0.0 110.115 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.495 HG21 ' HE2' ' A' ' 68' ' ' TYR . 54.1 t -59.47 -42.11 86.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.109 -0.995 . . . . 0.0 109.745 179.675 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 86.8 mt -65.31 -48.12 84.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 121.321 -0.862 . . . . 0.0 109.36 179.388 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.56 -39.81 77.53 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.282 -0.886 . . . . 0.0 108.792 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.485 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 7.0 m -67.21 -43.92 80.87 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 178.912 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.532 ' CB ' ' CD1' ' A' ' 60' ' ' TYR . 5.8 m-85 -67.32 -40.71 85.98 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.474 -0.766 . . . . 0.0 109.309 179.044 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.517 ' HG2' ' HA ' ' A' ' 20' ' ' ASP . 17.2 ttt180 -52.93 -40.95 64.01 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.407 -0.808 . . . . 0.0 109.223 179.241 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.412 HG21 ' HA ' ' B' ' 9' ' ' LYS . 49.1 mt -64.55 -43.91 96.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.407 -0.808 . . . . 0.0 110.224 179.741 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 13' ' ' SER . 15.5 mt -62.96 -41.73 99.62 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.087 -1.008 . . . . 0.0 110.096 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.693 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -83.59 13.31 4.7 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.311 -0.868 . . . . 0.0 110.299 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.429 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 65.69 57.8 0.83 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.21 -0.931 . . . . 0.0 110.28 179.899 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.517 ' HA ' ' HG2' ' A' ' 15' ' ' ARG . 0.6 OUTLIER 55.42 63.29 2.13 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.303 -0.873 . . . . 0.0 110.48 179.858 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -147.34 143.7 18.47 Favored Pre-proline 0 N--CA 1.49 1.565 0 O-C-N 121.202 -0.936 . . . . 0.0 110.034 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.467 ' O ' ' CD1' ' A' ' 23' ' ' TYR . 14.5 Cg_endo -72.89 -1.23 10.14 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 124.153 1.607 . . . . 0.0 110.114 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.666 ' CZ ' ' CE1' ' A' ' 48' ' ' TYR . 10.7 m-85 -130.44 150.06 51.84 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.262 -0.899 . . . . 0.0 109.866 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.693 HG12 ' HB2' ' A' ' 18' ' ' ALA . 0.1 OUTLIER -135.28 145.01 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.116 -0.99 . . . . 0.0 110.106 -179.828 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.577 ' N ' HD13 ' A' ' 24' ' ' ILE . 2.1 mp -80.09 153.54 28.67 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.267 -0.896 . . . . 0.0 110.061 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.462 ' O ' ' HB2' ' A' ' 29' ' ' LEU . . . -66.32 -45.37 80.54 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.249 -0.907 . . . . 0.0 110.071 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.84 -36.93 77.84 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.143 -0.973 . . . . 0.0 109.687 179.705 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.548 ' HB3' HD11 ' A' ' 24' ' ' ILE . 0.9 OUTLIER -58.37 -38.7 77.81 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.294 -0.878 . . . . 0.0 109.183 179.273 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.466 ' HG ' HD12 ' A' ' 24' ' ' ILE . 20.3 mt -61.42 -38.04 85.67 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.42 -0.8 . . . . 0.0 109.571 179.377 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 14.4 mtp85 -68.27 -34.03 75.45 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.306 -0.871 . . . . 0.0 110.077 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 15.4 ttt-85 -87.17 -21.56 25.85 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.284 -0.885 . . . . 0.0 110.7 -179.66 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 0.5 OUTLIER -99.02 -23.83 15.14 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.048 -1.033 . . . . 0.0 110.646 -179.552 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.791 HD22 ' HB3' ' A' ' 37' ' ' GLN . 3.5 mt -124.01 162.17 42.85 Favored Pre-proline 0 C--N 1.304 -1.39 0 O-C-N 121.11 -0.994 . . . . 0.0 110.196 -179.715 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.487 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 34.8 Cg_exo -62.72 179.86 0.64 Allowed 'Trans proline' 0 C--N 1.304 -1.768 0 O-C-N 123.918 1.483 . . . . 0.0 109.889 179.418 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.487 ' HD2' ' HB3' ' A' ' 34' ' ' PRO . 19.0 Cg_endo -63.99 -49.26 4.07 Favored 'Trans proline' 0 C--N 1.304 -1.772 0 O-C-N 123.941 1.495 . . . . 0.0 110.35 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -66.01 -40.94 91.55 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.292 -0.88 . . . . 0.0 110.863 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.791 ' HB3' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -69.65 -40.9 76.2 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.07 -1.019 . . . . 0.0 110.564 -179.5 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.45 -40.74 89.61 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.151 -0.968 . . . . 0.0 110.353 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -66.08 -48.87 69.56 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.187 -0.946 . . . . 0.0 110.509 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -62.08 -45.58 92.88 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.237 -0.914 . . . . 0.0 110.593 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 68.7 m -60.74 -44.33 96.8 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.149 -0.969 . . . . 0.0 110.514 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 72.3 mt -61.17 -32.84 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.169 -0.957 . . . . 0.0 110.404 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -76.44 -24.49 53.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.136 -0.978 . . . . 0.0 110.346 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.639 ' CD ' ' CE1' ' A' ' 63' ' ' PHE . 0.1 OUTLIER -84.07 -61.79 1.73 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.207 -0.933 . . . . 0.0 110.142 179.987 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.519 ' HE2' ' HA ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -34.39 103.46 0.23 Allowed Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.672 -0.642 . . . . 0.0 111.241 179.89 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -60.91 -155.48 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.725 0 O-C-N 123.889 1.468 . . . . 0.0 109.683 179.361 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -101.44 123.75 46.01 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.098 -1.001 . . . . 0.0 110.368 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.666 ' CE1' ' CZ ' ' A' ' 23' ' ' TYR . 3.0 t80 -56.46 -83.12 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.273 -0.892 . . . . 0.0 110.153 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.407 ' N ' ' CG ' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -136.4 146.84 46.91 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.286 -0.884 . . . . 0.0 110.237 179.929 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -77.13 -56.98 3.82 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -97.4 128.58 0.27 Allowed 'Trans proline' 0 C--N 1.306 -1.709 0 O-C-N 123.977 1.514 . . . . 0.0 110.344 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.483 ' O ' ' O ' ' A' ' 53' ' ' SER . . . 116.07 -69.65 0.27 Allowed Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.514 ' HB3' ' CD2' ' A' ' 48' ' ' TYR . 93.4 p -55.51 -157.53 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.328 0 O-C-N 121.41 -1.053 . . . . 0.0 110.734 -179.545 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.434 ' HB ' ' HD2' ' A' ' 55' ' ' PRO . 16.6 m -134.7 173.03 6.27 Favored Pre-proline 0 N--CA 1.491 1.592 0 O-C-N 121.204 -0.935 . . . . 0.0 110.208 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.434 ' HD2' ' HB ' ' A' ' 54' ' ' VAL . 19.6 Cg_endo -76.25 55.71 4.7 Favored 'Trans proline' 0 C--N 1.304 -1.782 0 O-C-N 124.033 1.544 . . . . 0.0 110.178 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 174.74 35.68 0.04 OUTLIER Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -131.57 111.11 11.46 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.205 -1.173 . . . . 0.0 110.204 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.479 ' HB3' ' HB3' ' A' ' 45' ' ' MET . 54.5 mt -114.57 159.77 20.04 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.322 -0.861 . . . . 0.0 110.198 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.478 ' C ' ' HG3' ' A' ' 45' ' ' MET . 13.5 p30 -110.34 111.09 22.15 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.253 -0.905 . . . . 0.0 110.468 179.766 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.572 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 24.8 p90 -74.8 -27.35 60.27 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.169 -0.957 . . . . 0.0 109.268 179.435 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.572 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.12 -44.74 79.43 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.446 -0.784 . . . . 0.0 109.591 179.616 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.48 -32.83 72.85 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.254 -0.904 . . . . 0.0 109.472 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.639 ' CE1' ' CD ' ' A' ' 44' ' ' ARG . 1.1 t80 -71.67 -40.34 69.69 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.626 -0.671 . . . . 0.0 109.983 179.641 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 21.0 p -58.92 -45.14 91.07 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.295 -0.878 . . . . 0.0 110.23 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 16.3 t -60.51 -39.69 88.69 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.276 -0.89 . . . . 0.0 110.219 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.26 -40.7 51.22 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.215 -0.928 . . . . 0.0 110.104 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.692 ' O ' HD12 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -66.48 -45.55 79.31 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.274 -0.891 . . . . 0.0 109.68 179.821 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.507 ' N ' ' HG ' ' A' ' 67' ' ' LEU . 3.9 m-85 -94.47 6.47 48.67 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.632 -0.668 . . . . 0.0 110.223 -179.911 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -142.78 105.84 0.41 Allowed Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -124.96 65.77 1.12 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.29 -1.124 . . . . 0.0 110.218 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.4 t -126.39 -64.66 1.02 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.293 -0.879 . . . . 0.0 110.219 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -96.37 135.23 38.52 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.274 -0.891 . . . . 0.0 110.193 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.469 ' HA ' HD22 ' A' ' 73' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.64 0 O-C-N 121.205 -0.934 . . . . 0.0 110.209 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 7' ' ' GLY . . . . . 0.519 ' O ' ' CB ' ' B' ' 8' ' ' LYS . . . . . . . . 0 N--CA 1.49 2.262 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.519 ' CB ' ' O ' ' B' ' 7' ' ' GLY . 33.3 tttt 73.78 -48.07 0.66 Allowed 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.405 -1.056 . . . . 0.0 110.767 -179.852 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.69 ' O ' HG23 ' B' ' 13' ' ' VAL . 7.2 ttmt -57.02 -33.85 67.59 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.038 -1.038 . . . . 0.0 110.037 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.38 -38.65 88.0 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.269 -0.894 . . . . 0.0 109.664 179.587 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -65.39 -42.1 93.0 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.296 -0.877 . . . . 0.0 109.807 179.576 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 12' ' ' ALA . . . . . 0.401 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -63.16 -33.05 74.63 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.35 -0.844 . . . . 0.0 109.888 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.69 HG23 ' O ' ' B' ' 9' ' ' LYS . 87.8 t -65.72 -42.29 92.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.287 -0.883 . . . . 0.0 110.135 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.71 -39.56 81.17 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.23 -0.919 . . . . 0.0 110.245 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.5 m -65.97 -43.74 87.01 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.301 -0.874 . . . . 0.0 110.193 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.658 ' O ' HG23 ' B' ' 20' ' ' VAL . 67.9 t -64.93 -43.22 96.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.246 -0.909 . . . . 0.0 110.06 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.728 HG22 ' HG2' ' A' ' 37' ' ' GLN . 43.6 t -58.58 -50.44 78.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.288 -0.883 . . . . 0.0 110.039 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.8 -46.69 88.44 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.251 -0.905 . . . . 0.0 109.822 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.78 -45.96 87.4 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.342 -0.849 . . . . 0.0 109.901 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.658 HG23 ' O ' ' B' ' 16' ' ' VAL . 75.3 t -63.26 -44.14 99.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.278 -0.889 . . . . 0.0 109.642 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -59.61 -40.25 86.91 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.399 -0.813 . . . . 0.0 109.708 179.67 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -54.21 -40.13 67.34 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.231 -0.918 . . . . 0.0 109.532 179.539 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.504 ' HB2' HD13 ' A' ' 67' ' ' LEU . . . -60.04 -39.39 85.77 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.344 -0.847 . . . . 0.0 109.627 179.552 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 6.9 ttm-85 -60.26 -45.12 94.37 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.261 -0.899 . . . . 0.0 109.69 179.506 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 64.9 t -70.54 -21.14 22.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.384 -0.822 . . . . 0.0 109.781 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.484 ' O ' ' HD3' ' B' ' 28' ' ' PRO . 28.3 ttm-85 56.87 47.02 18.68 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.442 -0.786 . . . . 0.0 110.278 179.822 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -81.18 107.76 8.61 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.252 -0.905 . . . . 0.0 110.008 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 28' ' ' PRO . . . . . 0.484 ' HD3' ' O ' ' B' ' 26' ' ' ARG . 43.5 Cg_endo -72.22 -59.97 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.712 0 O-C-N 123.945 1.497 . . . . 0.0 110.409 -179.674 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 3.7 tpt180 . . . . . 0 N--CA 1.489 1.522 0 O-C-N 121.249 -0.907 . . . . 0.0 110.175 -179.899 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 121.26 0.553 . . . . 0.0 110.236 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 46.51 84.79 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.26 -0.9 . . . . 0.0 110.316 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -154.45 -162.37 1.39 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.222 -0.924 . . . . 0.0 110.226 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.426 ' CG2' ' HB3' ' A' ' 7' ' ' ALA . 8.0 t -50.3 176.55 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.203 -0.936 . . . . 0.0 110.177 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -107.45 -32.26 7.8 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.191 -0.943 . . . . 0.0 110.28 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.643 HG22 ' CE2' ' A' ' 68' ' ' TYR . 3.6 m -61.49 -50.91 70.85 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.247 -0.908 . . . . 0.0 110.15 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.426 ' HB3' ' CG2' ' A' ' 4' ' ' THR . . . -69.99 -45.2 67.8 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.253 -0.904 . . . . 0.0 109.864 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -54.78 -37.07 65.58 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.34 -0.85 . . . . 0.0 109.806 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.0 tp60 -61.98 -45.0 95.55 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.306 -0.871 . . . . 0.0 110.0 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.826 HG12 ' CD2' ' A' ' 14' ' ' PHE . 17.3 t -60.36 -45.14 96.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.238 -0.914 . . . . 0.0 109.947 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 69.2 mt -59.4 -49.65 82.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.319 -0.863 . . . . 0.0 109.911 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.97 -47.91 81.54 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.186 -0.947 . . . . 0.0 109.343 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.41 ' HB2' HG23 ' B' ' 16' ' ' VAL . 2.0 p -65.42 -36.06 82.8 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.336 -0.852 . . . . 0.0 109.201 179.161 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.826 ' CD2' HG12 ' A' ' 10' ' ' VAL . 1.0 OUTLIER -68.29 -43.99 76.46 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.431 -0.793 . . . . 0.0 109.323 179.308 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.2 ttt180 -53.53 -48.44 69.04 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.391 -0.818 . . . . 0.0 108.974 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.523 HG21 ' HA ' ' B' ' 9' ' ' LYS . 50.7 mt -58.93 -43.42 88.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.412 -0.805 . . . . 0.0 109.566 179.195 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.1 mp -64.94 -36.05 83.13 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.324 -0.86 . . . . 0.0 110.033 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.641 ' HB1' ' O ' ' A' ' 23' ' ' TYR . . . -81.04 0.78 34.29 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.311 -0.868 . . . . 0.0 110.149 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.459 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 3.3 t 65.28 76.14 0.34 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.259 -0.901 . . . . 0.0 110.172 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.409 ' C ' ' O ' ' A' ' 19' ' ' SER . 10.4 t70 42.85 56.34 4.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.284 -0.885 . . . . 0.0 110.298 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.459 ' HG3' ' O ' ' A' ' 19' ' ' SER . 9.5 mttm -143.94 143.85 24.43 Favored Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.225 -0.922 . . . . 0.0 110.116 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.464 ' O ' ' CD1' ' A' ' 23' ' ' TYR . 19.2 Cg_endo -76.27 3.36 6.32 Favored 'Trans proline' 0 C--N 1.304 -1.795 0 O-C-N 124.049 1.552 . . . . 0.0 110.182 179.905 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.641 ' O ' ' HB1' ' A' ' 18' ' ' ALA . 47.7 m-85 -141.91 165.84 26.37 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.305 -0.872 . . . . 0.0 110.429 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.57 HD13 ' HB3' ' A' ' 28' ' ' GLU . 0.3 OUTLIER -132.48 146.32 33.1 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.376 -0.827 . . . . 0.0 109.841 179.932 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.496 ' N ' HD13 ' A' ' 24' ' ' ILE . 49.2 mt -92.33 155.64 17.79 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.164 -0.96 . . . . 0.0 110.344 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.574 ' HA ' HD21 ' A' ' 29' ' ' LEU . . . -63.07 -38.97 93.32 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.35 -0.844 . . . . 0.0 110.056 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.05 -33.99 70.81 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.226 -0.921 . . . . 0.0 109.705 179.473 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.57 ' HB3' HD13 ' A' ' 24' ' ' ILE . 19.9 tt0 -62.9 -51.27 67.62 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.357 -0.839 . . . . 0.0 110.227 -179.563 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.64 HD13 ' HA ' ' A' ' 38' ' ' ALA . 4.0 pp -67.8 -33.28 74.49 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.01 -1.056 . . . . 0.0 109.221 179.132 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.494 ' N ' HD12 ' A' ' 29' ' ' LEU . 0.0 OUTLIER -65.55 -33.91 77.02 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.233 -0.917 . . . . 0.0 110.539 179.908 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -89.73 -15.1 33.22 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.062 -1.023 . . . . 0.0 111.395 -179.147 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.538 ' HG2' ' HA ' ' A' ' 29' ' ' LEU . 12.1 pt-20 -108.79 -24.32 11.35 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.797 -1.19 . . . . 0.0 111.329 -179.339 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.637 HD22 ' HB3' ' A' ' 37' ' ' GLN . 0.5 OUTLIER -110.1 146.32 33.95 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 120.944 -1.098 . . . . 0.0 110.173 -179.929 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.428 ' O ' ' C ' ' A' ' 35' ' ' PRO . 47.8 Cg_exo -48.17 140.75 19.2 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 O-C-N 123.934 1.491 . . . . 0.0 110.194 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.428 ' C ' ' O ' ' A' ' 34' ' ' PRO . 29.8 Cg_endo -41.12 -38.15 3.07 Favored 'Trans proline' 0 C--N 1.304 -1.804 0 O-C-N 124.062 1.559 . . . . 0.0 110.263 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -65.74 -44.16 86.79 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.308 -0.87 . . . . 0.0 110.441 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.637 ' HB3' HD22 ' A' ' 33' ' ' LEU . 62.6 mm-40 -68.95 -42.19 77.02 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.197 -0.939 . . . . 0.0 110.26 -179.731 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.64 ' HA ' HD13 ' A' ' 29' ' ' LEU . . . -56.25 -43.4 78.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.23 -0.919 . . . . 0.0 110.248 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -65.9 -44.75 84.3 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.24 -0.912 . . . . 0.0 110.148 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.09 -47.81 78.6 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.233 -0.917 . . . . 0.0 110.009 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.489 ' O ' ' HG2' ' A' ' 45' ' ' MET . 60.9 m -65.84 -51.0 62.57 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.453 -0.779 . . . . 0.0 111.082 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.637 HD11 HD11 ' A' ' 29' ' ' LEU . 44.3 mt -50.84 -28.49 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 O-C-N 121.208 -0.932 . . . . 0.0 110.675 -179.282 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 6.1 tttt -85.81 -27.14 25.33 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.218 -0.926 . . . . 0.0 110.693 -179.672 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.583 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 13.8 mmt180 -76.72 -71.63 0.39 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.245 -0.909 . . . . 0.0 110.801 -179.452 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.548 ' HE2' ' CA ' ' A' ' 60' ' ' TYR . 12.0 ptp -57.33 122.48 55.0 Favored Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 121.173 -0.954 . . . . 0.0 110.498 -179.636 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.404 ' O ' HD23 ' A' ' 58' ' ' LEU . 18.7 Cg_endo -75.5 -158.61 0.08 OUTLIER 'Trans proline' 0 C--N 1.307 -1.657 0 O-C-N 123.95 1.5 . . . . 0.0 110.199 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.471 ' O ' ' N ' ' A' ' 49' ' ' SER . . . -90.47 134.1 34.58 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.186 -0.947 . . . . 0.0 110.274 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.547 ' CE1' ' CZ ' ' A' ' 23' ' ' TYR . 3.7 t80 -61.88 79.35 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.279 -0.888 . . . . 0.0 110.272 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.471 ' N ' ' O ' ' A' ' 47' ' ' ALA . 33.5 p -67.26 176.87 2.05 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.228 -0.92 . . . . 0.0 110.251 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 156.06 -148.06 17.59 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -85.05 -20.35 3.51 Favored 'Trans proline' 0 C--N 1.304 -1.767 0 O-C-N 124.021 1.537 . . . . 0.0 110.237 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -148.42 -70.14 0.01 OUTLIER Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.422 -1.471 . . . . 0.0 109.422 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.403 ' OG ' ' N ' ' A' ' 54' ' ' VAL . 10.0 t 53.7 -178.59 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.186 -1.185 . . . . 0.0 110.081 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.403 ' N ' ' OG ' ' A' ' 53' ' ' SER . 21.6 m -140.33 175.96 2.82 Favored Pre-proline 0 C--N 1.296 -1.745 0 O-C-N 121.716 -0.615 . . . . 0.0 110.09 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -86.64 118.94 1.58 Allowed 'Trans proline' 0 C--N 1.305 -1.741 0 O-C-N 123.949 1.5 . . . . 0.0 110.272 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 120.58 -20.26 8.87 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -77.01 122.27 24.68 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.318 -1.107 . . . . 0.0 110.179 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.429 ' HB3' ' HG3' ' A' ' 45' ' ' MET . 70.8 mt -118.99 156.89 28.81 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.278 -0.889 . . . . 0.0 110.33 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.404 ' O ' ' HB2' ' A' ' 45' ' ' MET . 0.7 OUTLIER -107.81 113.29 26.42 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.278 -0.888 . . . . 0.0 110.212 -179.964 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.548 ' CA ' ' HE2' ' A' ' 45' ' ' MET . 26.0 p90 -83.78 -23.29 31.57 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.214 -0.929 . . . . 0.0 110.339 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.482 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.02 -41.46 74.99 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.119 -0.988 . . . . 0.0 109.508 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.51 -32.42 73.77 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.321 -0.862 . . . . 0.0 109.612 179.313 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.583 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 5.3 t80 -69.65 -33.09 72.12 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 121.62 -0.675 . . . . 0.0 110.252 179.725 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.447 ' O ' ' HB2' ' A' ' 68' ' ' TYR . 5.8 p -63.92 -50.05 70.21 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.222 -0.924 . . . . 0.0 110.154 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.492 ' O ' ' N ' ' A' ' 69' ' ' GLY . 25.8 t -68.8 -35.39 76.96 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.203 -0.936 . . . . 0.0 110.108 179.839 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.18 -46.17 68.17 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.333 -0.854 . . . . 0.0 110.512 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.678 HD12 ' C ' ' A' ' 67' ' ' LEU . 0.3 OUTLIER -69.33 -38.19 78.06 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.1 -1.0 . . . . 0.0 110.112 -179.84 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.643 ' CE2' HG22 ' A' ' 6' ' ' THR . 2.4 m-85 -96.84 2.9 52.33 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.484 -0.76 . . . . 0.0 110.248 179.721 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 65' ' ' SER . . . -76.12 -166.14 21.17 Favored Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.675 -1.37 . . . . 0.0 109.675 -179.8 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -136.46 -44.32 0.61 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.359 -1.083 . . . . 0.0 110.289 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.92 115.56 15.75 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.205 -0.934 . . . . 0.0 110.308 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -69.89 110.33 4.95 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.271 -0.893 . . . . 0.0 110.248 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 14.7 tp . . . . . 0 N--CA 1.492 1.646 0 O-C-N 121.2 -0.937 . . . . 0.0 110.162 179.927 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 7' ' ' GLY . . . . . 0.449 ' C ' ' CD ' ' B' ' 8' ' ' LYS . . . . . . . . 0 N--CA 1.49 2.268 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.52 ' HG2' ' N ' ' B' ' 9' ' ' LYS . 0.0 OUTLIER -177.77 -29.64 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.279 -1.13 . . . . 0.0 110.408 179.824 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.523 ' HA ' HG21 ' A' ' 16' ' ' ILE . 0.7 OUTLIER -57.61 -51.1 70.87 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.008 -1.058 . . . . 0.0 109.834 179.914 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.11 -33.98 67.89 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.252 -0.905 . . . . 0.0 109.581 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -68.7 -40.75 79.85 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.406 -0.809 . . . . 0.0 109.809 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.04 -35.87 81.69 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.344 -0.847 . . . . 0.0 109.983 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.487 HG23 ' O ' ' B' ' 9' ' ' LYS . 57.8 t -61.62 -43.4 96.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.359 -0.838 . . . . 0.0 110.043 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.87 -35.57 75.08 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.236 -0.915 . . . . 0.0 110.131 179.838 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 17.0 m -68.16 -48.6 64.86 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.271 -0.893 . . . . 0.0 109.956 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.41 HG23 ' HB2' ' A' ' 13' ' ' SER . 74.1 t -61.22 -44.32 98.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.237 -0.914 . . . . 0.0 110.13 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.537 HG22 ' HG3' ' A' ' 37' ' ' GLN . 44.1 t -58.46 -48.07 86.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.227 -0.921 . . . . 0.0 110.05 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.3 -39.81 88.24 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.348 -0.845 . . . . 0.0 110.134 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.54 -44.29 82.82 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.274 -0.891 . . . . 0.0 110.006 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.449 ' HB ' ' OE1' ' A' ' 37' ' ' GLN . 77.5 t -63.79 -47.49 90.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.21 -0.931 . . . . 0.0 110.138 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.499 ' O ' HG23 ' B' ' 25' ' ' VAL . 4.1 t70 -55.2 -38.05 67.88 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.18 -0.95 . . . . 0.0 109.636 179.643 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -63.38 -36.88 85.19 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.395 -0.816 . . . . 0.0 109.953 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.554 ' HB1' HH21 ' A' ' 44' ' ' ARG . . . -64.76 -39.48 93.68 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.305 -0.872 . . . . 0.0 110.3 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 24' ' ' ARG . . . . . 0.441 ' CG ' ' N ' ' B' ' 25' ' ' VAL . 0.5 OUTLIER -62.33 -44.92 95.36 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.257 -0.902 . . . . 0.0 109.845 -179.96 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 25' ' ' VAL . . . . . 0.499 HG23 ' O ' ' B' ' 21' ' ' ASP . 13.6 t -65.99 -24.51 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.256 -0.902 . . . . 0.0 110.039 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.05 16.41 11.29 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.514 -0.741 . . . . 0.0 109.584 179.609 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 27' ' ' GLU . . . . . 0.415 ' HB3' ' O ' ' B' ' 24' ' ' ARG . 17.8 tt0 -105.3 143.56 27.02 Favored Pre-proline 0 N--CA 1.491 1.583 0 O-C-N 121.407 -0.808 . . . . 0.0 110.472 -179.661 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -80.13 99.75 1.2 Allowed 'Trans proline' 0 C--N 1.306 -1.709 0 O-C-N 124.069 1.563 . . . . 0.0 110.295 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 54.6 ttm-85 . . . . . 0 N--CA 1.492 1.635 0 O-C-N 121.183 -0.948 . . . . 0.0 110.16 179.969 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 ptt? . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.244 0.545 . . . . 0.0 110.189 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -109.32 -77.19 0.6 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.231 -0.918 . . . . 0.0 110.17 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.415 ' O ' ' HG2' ' A' ' 8' ' ' GLU . 1.7 p30 -168.83 -160.41 0.28 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.287 -0.883 . . . . 0.0 110.117 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -131.08 127.47 38.24 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.21 -0.931 . . . . 0.0 110.135 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -172.16 169.91 5.35 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.221 -0.924 . . . . 0.0 110.193 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.608 ' CG2' ' CE1' ' A' ' 68' ' ' TYR . 2.9 m -55.57 -51.33 67.48 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.26 -0.9 . . . . 0.0 110.09 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -69.84 -44.31 70.15 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.205 -0.934 . . . . 0.0 109.774 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 3' ' ' ASP . 19.7 tp10 -54.98 -36.41 65.35 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.371 -0.831 . . . . 0.0 109.697 179.583 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.402 ' O ' ' OG ' ' A' ' 13' ' ' SER . 1.1 tp60 -61.25 -44.83 96.61 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.295 -0.878 . . . . 0.0 109.858 179.89 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 59.2 t -58.38 -41.22 80.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.244 -0.91 . . . . 0.0 109.549 179.405 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.578 HG23 ' HE1' ' A' ' 60' ' ' TYR . 69.2 mt -66.71 -43.91 89.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.419 -0.801 . . . . 0.0 109.492 179.295 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.59 -43.27 84.5 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.276 -0.89 . . . . 0.0 108.861 179.14 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.447 ' O ' HD23 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -66.74 -38.66 87.1 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 178.71 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.565 ' HB3' ' CE2' ' A' ' 60' ' ' TYR . 1.2 m-85 -68.38 -42.28 79.36 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.491 -0.755 . . . . 0.0 109.437 179.124 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.77 -43.37 72.73 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.296 -0.878 . . . . 0.0 109.399 179.303 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.429 ' CD1' ' HB2' ' B' ' 12' ' ' ALA . 80.9 mt -63.79 -44.83 98.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.314 -0.866 . . . . 0.0 109.624 179.402 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.495 HD13 ' HA ' ' A' ' 17' ' ' LEU . 3.2 mm? -63.31 -34.75 78.36 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.32 -0.863 . . . . 0.0 109.735 179.585 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.731 ' HB1' ' O ' ' A' ' 23' ' ' TYR . . . -79.92 2.44 23.43 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.375 -0.828 . . . . 0.0 110.112 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.482 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 4.3 t 60.27 80.3 0.21 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.282 -0.886 . . . . 0.0 110.113 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.482 ' O ' ' HG2' ' A' ' 21' ' ' LYS . 6.3 m-20 45.31 59.33 3.6 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.346 -0.846 . . . . 0.0 110.438 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.482 ' HG2' ' O ' ' A' ' 20' ' ' ASP . 18.4 mttp -153.5 141.72 14.01 Favored Pre-proline 0 N--CA 1.489 1.502 0 O-C-N 121.25 -0.906 . . . . 0.0 110.047 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.512 ' HG2' ' CE2' ' A' ' 23' ' ' TYR . 23.4 Cg_endo -78.36 6.25 4.89 Favored 'Trans proline' 0 C--N 1.303 -1.824 0 O-C-N 124.172 1.617 . . . . 0.0 110.232 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.731 ' O ' ' HB1' ' A' ' 18' ' ' ALA . 22.1 m-85 -135.91 166.16 23.97 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.277 -0.889 . . . . 0.0 110.107 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.64 HD13 ' H ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -138.45 140.58 39.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.137 -0.977 . . . . 0.0 110.062 -179.945 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.64 ' H ' HD13 ' A' ' 24' ' ' ILE . 4.4 mp -83.55 154.45 23.81 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.174 -0.953 . . . . 0.0 110.019 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.83 -45.28 71.57 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.254 -0.904 . . . . 0.0 110.304 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -56.54 -39.69 73.84 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.268 -0.895 . . . . 0.0 109.937 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -59.26 -41.62 89.26 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.327 -0.858 . . . . 0.0 109.199 179.613 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 1.037 HD13 HD12 ' A' ' 33' ' ' LEU . 2.0 mm? -61.52 -33.82 74.47 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.53 -0.731 . . . . 0.0 109.417 179.265 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 14.8 mmm-85 -68.91 -34.38 75.31 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.381 -0.824 . . . . 0.0 110.322 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.2 -25.45 15.29 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.146 -0.971 . . . . 0.0 111.413 -179.139 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.482 ' HB3' HD12 ' A' ' 17' ' ' LEU . 12.3 mm-40 -91.64 -23.59 19.79 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 120.925 -1.109 . . . . 0.0 111.449 -178.918 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 1.037 HD12 HD13 ' A' ' 29' ' ' LEU . 7.8 mt -123.85 163.64 33.93 Favored Pre-proline 0 N--CA 1.487 1.392 0 O-C-N 120.847 -1.158 . . . . 0.0 110.734 -179.297 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.518 ' HD3' HD23 ' A' ' 33' ' ' LEU . 21.7 Cg_exo -61.52 139.33 81.2 Favored 'Trans proline' 0 C--N 1.306 -1.69 0 O-C-N 124.114 1.586 . . . . 0.0 110.003 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.431 ' C ' ' O ' ' A' ' 34' ' ' PRO . 31.7 Cg_endo -39.98 -41.65 3.03 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 O-C-N 124.065 1.561 . . . . 0.0 110.511 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -66.0 -37.58 86.31 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.283 -0.885 . . . . 0.0 111.081 -179.535 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.875 ' OE1' HG22 ' B' ' 17' ' ' VAL . 0.1 OUTLIER -69.64 -42.16 74.62 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.928 -1.107 . . . . 0.0 110.42 -179.562 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.489 ' O ' HG12 ' A' ' 42' ' ' ILE . . . -56.01 -48.3 76.17 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.179 -0.951 . . . . 0.0 110.288 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -56.11 -48.83 75.43 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.086 -1.009 . . . . 0.0 110.469 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -62.56 -48.12 80.88 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.152 -0.968 . . . . 0.0 110.101 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 56.6 m -65.26 -47.29 77.25 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.255 -0.903 . . . . 0.0 110.046 179.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.489 HG12 ' O ' ' A' ' 38' ' ' ALA . 16.2 mm -57.41 -22.88 18.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.389 -0.819 . . . . 0.0 110.109 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 26.1 tttt -84.47 -24.14 29.6 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.284 -0.885 . . . . 0.0 110.385 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.603 ' HB3' ' CG ' ' A' ' 63' ' ' PHE . 10.6 mmt180 -93.65 -67.92 0.83 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.246 -0.909 . . . . 0.0 110.275 -179.858 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.505 ' HE1' ' HB3' ' A' ' 60' ' ' TYR . 2.0 ttm -36.62 105.44 0.3 Allowed Pre-proline 0 N--CA 1.493 1.721 0 O-C-N 121.598 -0.689 . . . . 0.0 111.001 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.458 ' HD2' ' OD1' ' A' ' 59' ' ' ASP . 37.6 Cg_exo -71.57 -158.79 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.729 0 O-C-N 124.03 1.542 . . . . 0.0 109.785 179.453 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -99.86 124.96 45.71 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.083 -1.011 . . . . 0.0 110.25 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -63.11 137.29 58.19 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.284 -0.885 . . . . 0.0 110.064 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 19.9 p -127.72 105.96 8.81 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.246 -0.909 . . . . 0.0 110.13 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -130.74 -122.68 2.43 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.632 -1.387 . . . . 0.0 109.632 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -97.08 19.18 0.48 Allowed 'Trans proline' 0 C--N 1.305 -1.757 0 O-C-N 123.97 1.511 . . . . 0.0 110.243 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 147.93 -37.37 1.1 Allowed Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.401 ' OG ' ' N ' ' A' ' 54' ' ' VAL . 9.6 t 52.87 -179.65 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.308 0 O-C-N 121.255 -1.144 . . . . 0.0 110.179 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 1.024 ' CG2' ' HB2' ' A' ' 57' ' ' ALA . 32.7 m -108.75 165.32 12.89 Favored Pre-proline 0 C--N 1.294 -1.808 0 O-C-N 121.71 -0.619 . . . . 0.0 110.151 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -74.61 80.86 2.22 Favored 'Trans proline' 0 C--N 1.304 -1.784 0 O-C-N 123.989 1.521 . . . . 0.0 110.208 -179.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 127.28 39.23 0.38 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 1.024 ' HB2' ' CG2' ' A' ' 54' ' ' VAL . . . -111.57 115.68 29.58 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.124 -1.221 . . . . 0.0 110.275 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.409 ' HB3' ' HB3' ' A' ' 45' ' ' MET . 1.1 mt -111.62 157.75 20.05 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.226 -0.921 . . . . 0.0 110.181 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.475 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.7 OUTLIER -110.52 111.44 22.69 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.125 -0.984 . . . . 0.0 110.397 179.738 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.578 ' HE1' HG23 ' A' ' 11' ' ' ILE . 22.7 p90 -73.66 -24.82 60.03 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.217 -0.927 . . . . 0.0 109.182 179.362 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.547 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.65 -42.68 79.36 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.465 -0.772 . . . . 0.0 109.765 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.45 -40.3 86.39 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.298 -0.876 . . . . 0.0 109.874 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.603 ' CG ' ' HB3' ' A' ' 44' ' ' ARG . 1.7 t80 -71.97 -35.17 69.46 Favored 'General case' 0 C--N 1.298 -1.666 0 O-C-N 121.591 -0.693 . . . . 0.0 110.384 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 70.3 m -58.37 -43.48 88.46 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.21 -0.931 . . . . 0.0 110.465 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.468 ' O ' ' N ' ' A' ' 69' ' ' GLY . 0.3 OUTLIER -61.28 -40.69 95.05 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.173 -0.954 . . . . 0.0 110.272 -179.855 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.61 -31.94 67.46 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.281 -0.887 . . . . 0.0 110.452 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.722 HD21 ' HB2' ' B' ' 23' ' ' ALA . 0.5 OUTLIER -64.67 -44.41 90.48 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.109 -0.994 . . . . 0.0 110.386 -179.825 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.608 ' CE1' ' CG2' ' A' ' 6' ' ' THR . 28.4 m-85 -99.54 -25.98 14.25 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.198 -0.939 . . . . 0.0 110.27 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.468 ' N ' ' O ' ' A' ' 65' ' ' SER . . . -82.65 68.36 3.55 Favored Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.414 ' OE2' ' HB3' ' A' ' 71' ' ' SER . 2.0 pp20? -109.99 -22.64 11.73 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.214 -1.168 . . . . 0.0 110.179 179.851 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.414 ' HB3' ' OE2' ' A' ' 70' ' ' GLU . 22.3 t -172.23 95.89 0.15 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.304 -0.873 . . . . 0.0 110.178 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -64.49 111.49 2.71 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.254 -0.904 . . . . 0.0 110.189 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.2 pp . . . . . 0 N--CA 1.492 1.625 0 O-C-N 121.272 -0.893 . . . . 0.0 110.136 -179.997 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.315 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.52 34.33 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.271 -1.135 . . . . 0.0 110.134 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.815 ' O ' HG23 ' B' ' 13' ' ' VAL . 0.3 OUTLIER -58.32 -40.34 81.82 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.291 -0.88 . . . . 0.0 110.159 -179.944 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.11 -46.5 79.1 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.23 -0.919 . . . . 0.0 109.964 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -62.12 -40.95 97.63 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.277 -0.89 . . . . 0.0 110.032 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 12' ' ' ALA . . . . . 0.468 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -64.33 -37.11 86.33 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.342 -0.849 . . . . 0.0 110.184 179.936 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.929 ' O ' HG23 ' B' ' 17' ' ' VAL . 42.7 t -65.31 -45.09 94.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.321 -0.862 . . . . 0.0 110.128 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.33 -35.94 74.75 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.234 -0.916 . . . . 0.0 110.173 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 15.0 m -67.54 -40.95 85.01 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.378 -0.826 . . . . 0.0 110.347 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.85 ' O ' HG23 ' B' ' 20' ' ' VAL . 57.4 t -69.91 -40.18 78.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.248 -0.908 . . . . 0.0 110.168 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.929 HG23 ' O ' ' B' ' 13' ' ' VAL . 16.7 t -61.45 -47.41 93.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.365 -0.834 . . . . 0.0 110.238 -179.845 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.86 -46.01 92.27 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.253 -0.904 . . . . 0.0 110.322 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.04 -41.4 95.23 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.228 -0.92 . . . . 0.0 110.287 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.85 HG23 ' O ' ' B' ' 16' ' ' VAL . 75.1 t -67.1 -39.44 83.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.25 -0.906 . . . . 0.0 110.425 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.44 -33.73 76.55 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.235 -0.916 . . . . 0.0 110.333 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 22' ' ' GLN . . . . . 0.995 ' O ' HG12 ' B' ' 25' ' ' VAL . 28.8 tt0 -58.09 -49.38 77.14 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.286 -0.884 . . . . 0.0 110.267 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.722 ' HB2' HD21 ' A' ' 67' ' ' LEU . . . -66.15 -37.32 85.39 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.235 -0.915 . . . . 0.0 110.411 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 51.1 ttt-85 -70.35 -36.45 74.2 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.268 -0.895 . . . . 0.0 110.648 -179.609 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 25' ' ' VAL . . . . . 0.995 HG12 ' O ' ' B' ' 22' ' ' GLN . 3.3 p -52.51 -23.16 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.082 -1.011 . . . . 0.0 110.275 -179.664 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 1.3 ttt180 -102.97 19.81 18.75 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.439 -0.788 . . . . 0.0 110.158 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.71 124.8 53.69 Favored Pre-proline 0 N--CA 1.491 1.582 0 O-C-N 121.334 -0.854 . . . . 0.0 110.274 -179.82 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -68.56 149.52 74.26 Favored 'Trans proline' 0 C--N 1.306 -1.708 0 O-C-N 124.013 1.533 . . . . 0.0 110.206 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 43.9 mtt85 . . . . . 0 N--CA 1.49 1.553 0 O-C-N 121.161 -0.962 . . . . 0.0 110.233 -179.928 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.654 0 CA-C-O 121.236 0.541 . . . . 0.0 110.173 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -108.99 163.34 13.39 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.232 -0.918 . . . . 0.0 110.186 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -88.61 60.27 5.52 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.2 -0.938 . . . . 0.0 110.222 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.434 HG21 ' HB3' ' A' ' 8' ' ' GLU . 9.6 t -103.84 -146.38 0.38 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.264 -0.898 . . . . 0.0 110.127 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -96.22 -84.89 0.35 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.259 -0.9 . . . . 0.0 110.192 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.5 m -156.6 -43.55 0.07 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.258 -0.901 . . . . 0.0 110.141 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.568 ' HA ' ' CZ ' ' A' ' 68' ' ' TYR . . . -69.99 -41.48 74.34 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.335 -0.853 . . . . 0.0 109.873 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.434 ' HB3' HG21 ' A' ' 4' ' ' THR . 2.1 tp10 -59.66 -36.9 77.35 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.278 -0.889 . . . . 0.0 109.742 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -64.58 -44.04 91.94 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.439 -0.788 . . . . 0.0 110.284 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.628 HG21 ' OH ' ' A' ' 68' ' ' TYR . 54.3 t -57.87 -43.75 85.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.203 -0.936 . . . . 0.0 109.86 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.494 HD12 ' O ' ' A' ' 7' ' ' ALA . 5.5 mt -63.74 -49.16 83.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.329 -0.857 . . . . 0.0 109.351 179.35 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.06 -43.15 86.78 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.294 -0.879 . . . . 0.0 108.92 179.114 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.499 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 1.0 OUTLIER -63.56 -46.63 85.02 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.608 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.578 ' HB3' ' CE2' ' A' ' 60' ' ' TYR . 3.6 m-85 -59.81 -43.14 94.63 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.465 -0.772 . . . . 0.0 109.129 178.747 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -52.96 -40.59 63.82 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.04 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.405 HG21 ' HA ' ' B' ' 9' ' ' LYS . 61.6 mt -67.1 -44.93 87.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.541 -0.724 . . . . 0.0 110.267 179.41 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.568 HD13 ' OE1' ' A' ' 32' ' ' GLU . 9.3 mt -57.88 -42.11 83.9 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.929 -1.107 . . . . 0.0 109.698 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.446 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -79.5 4.07 16.79 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.378 -0.826 . . . . 0.0 110.298 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.448 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 0.3 OUTLIER 64.91 66.8 0.55 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.268 -0.895 . . . . 0.0 110.234 179.959 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 52.11 59.88 4.22 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.213 -0.929 . . . . 0.0 110.308 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.448 ' HG3' ' O ' ' A' ' 19' ' ' SER . 20.9 mttt -143.51 142.05 20.27 Favored Pre-proline 0 N--CA 1.49 1.525 0 O-C-N 121.182 -0.949 . . . . 0.0 110.014 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -69.81 -3.15 11.47 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 O-C-N 124.089 1.573 . . . . 0.0 110.263 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.523 ' CD1' ' O ' ' A' ' 23' ' ' TYR . 7.0 p90 -143.4 152.37 41.5 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.239 -0.913 . . . . 0.0 110.055 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.404 HD13 HG21 ' A' ' 24' ' ' ILE . 3.9 tt -123.0 147.39 27.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.243 -0.911 . . . . 0.0 110.344 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.503 ' HB2' ' HB2' ' A' ' 28' ' ' GLU . 1.2 mp -80.48 141.43 35.22 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.241 -0.912 . . . . 0.0 109.92 179.867 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.496 ' O ' ' HG ' ' A' ' 29' ' ' LEU . . . -60.27 -40.6 90.94 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.203 -0.936 . . . . 0.0 110.471 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -65.01 -35.17 80.34 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.165 -0.959 . . . . 0.0 110.124 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.503 ' HB2' ' HB2' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -68.8 -49.98 54.04 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.366 -0.834 . . . . 0.0 109.869 179.992 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.725 HD12 ' C ' ' A' ' 29' ' ' LEU . 0.9 OUTLIER -66.82 -34.07 77.01 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.373 -0.829 . . . . 0.0 110.042 179.834 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.76 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 17.2 ttp180 -69.18 -34.48 75.0 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.319 -0.863 . . . . 0.0 111.12 -179.642 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.551 ' NH1' ' HB3' ' A' ' 31' ' ' ARG . 5.0 ttp-105 -86.48 -22.46 26.43 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.007 -1.058 . . . . 0.0 111.32 -178.91 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.568 ' OE1' HD13 ' A' ' 17' ' ' LEU . 12.8 pt-20 -90.7 -24.03 20.55 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.831 -1.168 . . . . 0.0 110.776 -179.542 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.589 HD23 ' HD2' ' A' ' 34' ' ' PRO . 7.6 mt -103.17 155.91 36.06 Favored Pre-proline 0 N--CA 1.488 1.457 0 O-C-N 121.122 -0.986 . . . . 0.0 110.409 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.589 ' HD2' HD23 ' A' ' 33' ' ' LEU . 6.2 Cg_exo -59.18 142.54 99.36 Favored 'Trans proline' 0 C--N 1.302 -1.892 0 O-C-N 124.069 1.563 . . . . 0.0 109.775 179.593 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.429 ' C ' ' O ' ' A' ' 34' ' ' PRO . 33.7 Cg_exo -37.72 -44.08 1.56 Allowed 'Trans proline' 0 C--N 1.305 -1.749 0 O-C-N 124.055 1.555 . . . . 0.0 110.917 -179.481 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.486 ' OD1' ' HB2' ' A' ' 34' ' ' PRO . 2.9 p-10 -65.9 -45.82 80.58 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.091 -1.006 . . . . 0.0 111.04 -179.606 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.626 ' HG2' HG22 ' B' ' 17' ' ' VAL . 0.6 OUTLIER -69.82 -37.85 76.36 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.951 -1.093 . . . . 0.0 110.705 -179.53 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.76 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -60.96 -43.86 98.13 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.369 -0.832 . . . . 0.0 110.952 -179.478 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.3 tm0? -60.09 -44.92 94.46 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.255 -0.903 . . . . 0.0 110.849 -179.367 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -62.21 -41.72 98.63 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.237 -0.914 . . . . 0.0 110.922 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 27.5 m -62.69 -50.88 69.41 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.128 -0.982 . . . . 0.0 110.755 -179.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.644 HD12 HD11 ' A' ' 29' ' ' LEU . 1.1 mt -63.84 -18.01 21.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.203 -0.935 . . . . 0.0 110.188 -179.736 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.45 ' C ' ' HD2' ' A' ' 44' ' ' ARG . 9.2 tttt -83.22 -16.01 48.19 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.25 -0.906 . . . . 0.0 110.772 -179.69 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.592 ' HB3' ' CG ' ' A' ' 63' ' ' PHE . 2.0 mpt_? -114.32 -62.26 1.62 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.106 -0.996 . . . . 0.0 110.675 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.492 ' HE1' ' HB3' ' A' ' 60' ' ' TYR . 2.3 ttm -32.88 111.1 0.35 Allowed Pre-proline 0 N--CA 1.497 1.92 0 O-C-N 121.618 -0.676 . . . . 0.0 111.272 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.428 ' O ' ' HA ' ' A' ' 58' ' ' LEU . 12.3 Cg_endo -80.06 177.68 8.02 Favored 'Trans proline' 0 C--N 1.306 -1.687 0 O-C-N 124.024 1.539 . . . . 0.0 110.194 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.87 133.17 46.24 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.252 -0.905 . . . . 0.0 110.237 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.444 ' CB ' ' O ' ' A' ' 57' ' ' ALA . 7.7 t80 -59.23 107.8 0.6 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.24 -0.912 . . . . 0.0 110.08 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -107.92 148.89 29.03 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.252 -0.905 . . . . 0.0 110.222 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 148.46 -150.91 23.15 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -78.7 106.74 2.15 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 O-C-N 124.084 1.57 . . . . 0.0 110.222 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.497 ' O ' ' HB2' ' A' ' 53' ' ' SER . . . 72.34 156.91 3.22 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.497 ' HB2' ' O ' ' A' ' 52' ' ' GLY . 34.6 t 178.37 -163.83 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.338 0 O-C-N 121.364 -1.08 . . . . 0.0 110.331 179.713 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.806 ' CG2' ' HB2' ' A' ' 57' ' ' ALA . 15.4 m -144.89 170.91 7.31 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.323 -0.861 . . . . 0.0 110.235 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -87.78 43.67 0.9 Allowed 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.998 1.525 . . . . 0.0 110.269 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 179.98 35.83 0.07 OUTLIER Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.806 ' HB2' ' CG2' ' A' ' 54' ' ' VAL . . . -122.36 104.5 9.46 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.214 -1.168 . . . . 0.0 110.107 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.438 ' HB3' ' HB3' ' A' ' 45' ' ' MET . 54.3 mt -93.76 159.04 15.38 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.323 -0.861 . . . . 0.0 110.176 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.479 ' C ' ' HG3' ' A' ' 45' ' ' MET . 1.2 m-20 -115.28 110.42 19.39 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.105 -0.997 . . . . 0.0 110.41 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.579 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 15.9 p90 -72.77 -25.77 61.29 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.379 -0.826 . . . . 0.0 110.271 179.767 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.579 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.7 -36.73 67.5 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.279 -0.888 . . . . 0.0 109.958 -179.7 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.56 -43.36 80.84 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.322 -0.861 . . . . 0.0 109.557 179.416 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.592 ' CG ' ' HB3' ' A' ' 44' ' ' ARG . 1.5 t80 -72.12 -35.29 69.11 Favored 'General case' 0 C--N 1.297 -1.689 0 O-C-N 121.75 -0.593 . . . . 0.0 110.311 179.65 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.566 ' O ' ' CE2' ' A' ' 68' ' ' TYR . 44.3 m -59.67 -49.87 76.07 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.298 -0.876 . . . . 0.0 110.569 -179.606 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.97 -41.24 82.49 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.184 -0.947 . . . . 0.0 110.344 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.64 -39.6 73.96 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.231 -0.918 . . . . 0.0 110.386 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.546 ' CD2' ' HB2' ' B' ' 23' ' ' ALA . 15.3 mt -57.75 -41.12 81.3 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.144 -0.972 . . . . 0.0 110.241 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.628 ' OH ' HG21 ' A' ' 10' ' ' VAL . 2.7 m-85 -84.15 10.15 10.95 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.271 -0.893 . . . . 0.0 110.077 -179.736 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 149.26 -101.58 0.22 Allowed Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 48.6 tt0 -166.85 -54.99 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.228 -1.16 . . . . 0.0 110.204 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.1 m -161.52 159.72 28.23 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.214 -0.929 . . . . 0.0 110.244 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -80.08 133.71 36.13 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.191 -0.943 . . . . 0.0 110.163 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.436 HD22 ' HA ' ' A' ' 73' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.576 0 O-C-N 121.253 -0.905 . . . . 0.0 110.305 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.331 0 N-CA-C 109.524 -1.431 . . . . 0.0 109.524 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.466 ' HB2' ' OE1' ' B' ' 11' ' ' GLU . 0.2 OUTLIER -158.28 37.04 0.24 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.217 -1.167 . . . . 0.0 110.133 179.905 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.405 ' HA ' HG21 ' A' ' 16' ' ' ILE . 0.0 OUTLIER -65.65 -45.63 82.24 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.24 -0.913 . . . . 0.0 110.025 179.849 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.99 -40.84 77.34 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.314 -0.866 . . . . 0.0 109.997 179.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.466 ' OE1' ' HB2' ' B' ' 8' ' ' LYS . 5.2 mt-10 -62.05 -40.92 97.39 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.333 -0.854 . . . . 0.0 110.024 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 12' ' ' ALA . . . . . 0.458 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -65.43 -43.08 91.61 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.415 -0.803 . . . . 0.0 110.0 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.558 ' O ' HG23 ' B' ' 17' ' ' VAL . 90.1 t -58.64 -44.25 89.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.215 -0.928 . . . . 0.0 110.013 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.29 -39.56 90.89 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.307 -0.87 . . . . 0.0 110.179 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 19.7 m -64.66 -44.43 90.42 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.226 -0.921 . . . . 0.0 110.136 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.458 HG23 ' O ' ' B' ' 12' ' ' ALA . 59.8 t -65.18 -42.28 93.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.246 -0.909 . . . . 0.0 110.08 179.898 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.626 HG22 ' HG2' ' A' ' 37' ' ' GLN . 74.4 t -60.66 -44.79 97.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.271 -0.893 . . . . 0.0 110.256 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.71 -46.32 90.16 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.197 -0.94 . . . . 0.0 110.199 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.51 -42.02 92.53 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.27 -0.894 . . . . 0.0 110.232 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.449 HG23 ' O ' ' B' ' 16' ' ' VAL . 57.6 t -66.04 -46.04 89.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.304 -0.873 . . . . 0.0 110.244 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -63.08 -32.58 73.98 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.235 -0.915 . . . . 0.0 110.221 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 4.5 tp60 -56.9 -41.45 78.12 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.268 -0.895 . . . . 0.0 110.11 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.546 ' HB2' ' CD2' ' A' ' 67' ' ' LEU . . . -60.63 -39.06 86.85 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.207 -0.933 . . . . 0.0 109.981 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.72 -33.22 74.67 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.367 -0.833 . . . . 0.0 110.264 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -67.91 -20.8 26.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.277 -0.889 . . . . 0.0 110.05 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 12.0 ttm180 -84.28 26.81 0.73 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.323 -0.861 . . . . 0.0 110.966 -179.639 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -109.77 134.04 20.75 Favored Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.092 -1.005 . . . . 0.0 110.166 179.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -43.71 100.7 0.04 OUTLIER 'Trans proline' 0 C--N 1.306 -1.709 0 O-C-N 123.879 1.463 . . . . 0.0 110.23 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 10.9 ttm180 . . . . . 0 N--CA 1.49 1.572 0 O-C-N 121.277 -0.889 . . . . 0.0 110.269 -179.991 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 121.269 0.557 . . . . 0.0 110.2 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -95.05 94.04 7.73 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.212 -0.93 . . . . 0.0 110.264 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -93.84 -170.96 2.45 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.25 -0.906 . . . . 0.0 110.207 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -117.9 159.6 22.83 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.303 -0.873 . . . . 0.0 110.285 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.493 ' O ' ' N ' ' A' ' 7' ' ' ALA . 0.2 OUTLIER 62.21 154.12 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.165 -0.959 . . . . 0.0 110.321 179.937 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.778 HG22 ' CZ ' ' A' ' 68' ' ' TYR . 1.9 m 66.62 -59.88 0.35 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.284 -0.885 . . . . 0.0 110.258 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.493 ' N ' ' O ' ' A' ' 5' ' ' ASP . . . -67.8 -37.97 82.69 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.289 -0.882 . . . . 0.0 109.43 179.592 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.6 tp10 -59.85 -36.02 75.98 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.418 -0.801 . . . . 0.0 109.681 179.209 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.15 -45.66 93.74 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.327 -0.858 . . . . 0.0 110.046 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.684 HG12 ' CD2' ' A' ' 14' ' ' PHE . 21.7 t -61.88 -43.64 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.097 -1.002 . . . . 0.0 109.649 179.621 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 34.8 mt -57.3 -49.47 79.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.385 -0.822 . . . . 0.0 109.413 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.05 -41.85 93.19 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.293 -0.879 . . . . 0.0 109.063 179.09 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.444 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 5.1 m -65.46 -41.24 93.6 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.48 -0.762 . . . . 0.0 109.153 179.022 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.684 ' CD2' HG12 ' A' ' 10' ' ' VAL . 2.2 m-85 -68.43 -41.26 80.58 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.385 -0.822 . . . . 0.0 109.395 179.257 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.471 ' HD3' ' HA ' ' A' ' 20' ' ' ASP . 1.5 tmm_? -53.58 -43.63 68.7 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.353 -0.842 . . . . 0.0 109.612 179.509 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.633 HD12 ' HB2' ' B' ' 12' ' ' ALA . 54.8 mt -60.14 -44.94 96.28 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.283 -0.886 . . . . 0.0 109.691 179.627 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 13' ' ' SER . 38.5 mt -65.36 -40.15 93.21 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.295 -0.878 . . . . 0.0 109.803 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.561 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -72.35 -4.88 32.58 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.298 -0.876 . . . . 0.0 110.103 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.468 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.3 OUTLIER 68.48 54.17 0.54 Allowed 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.24 -0.912 . . . . 0.0 110.2 -179.922 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.471 ' HA ' ' HD3' ' A' ' 15' ' ' ARG . 2.2 t70 63.02 36.74 12.2 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.204 -0.935 . . . . 0.0 110.313 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.561 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 7.5 mmtt -118.47 144.75 35.86 Favored Pre-proline 0 N--CA 1.49 1.543 0 O-C-N 121.237 -0.914 . . . . 0.0 110.037 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 21' ' ' LYS . 38.4 Cg_exo -68.77 -5.33 15.2 Favored 'Trans proline' 0 C--N 1.304 -1.79 0 O-C-N 124.123 1.591 . . . . 0.0 109.999 179.734 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.544 ' CD1' ' N ' ' A' ' 23' ' ' TYR . 18.0 p90 -141.01 165.11 28.45 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.419 -0.8 . . . . 0.0 110.106 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.859 HD12 ' CD2' ' A' ' 29' ' ' LEU . 0.4 OUTLIER -125.76 149.88 30.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.217 -0.927 . . . . 0.0 109.96 -179.886 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.823 HD22 ' N ' ' A' ' 25' ' ' LEU . 2.9 mm? -90.99 154.64 19.3 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.26 -0.9 . . . . 0.0 110.238 -179.872 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.0 -37.64 78.83 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.3 -0.875 . . . . 0.0 110.112 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -65.89 -35.2 79.98 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.277 -0.889 . . . . 0.0 110.071 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.44 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 1.1 mt-10 -62.59 -43.99 97.43 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.322 -0.862 . . . . 0.0 109.93 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.859 ' CD2' HD12 ' A' ' 24' ' ' ILE . 3.8 mm? -62.55 -34.31 76.69 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.173 -0.955 . . . . 0.0 109.883 179.738 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.77 -39.05 80.43 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.312 -0.868 . . . . 0.0 110.175 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.74 -15.9 27.68 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.267 -0.895 . . . . 0.0 110.298 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.44 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 3.1 mm-40 -100.41 -23.58 14.71 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.109 -0.994 . . . . 0.0 110.383 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.9 HD23 ' HD2' ' A' ' 34' ' ' PRO . 0.3 OUTLIER -134.8 151.4 75.63 Favored Pre-proline 0 N--CA 1.487 1.395 0 O-C-N 121.103 -0.998 . . . . 0.0 110.306 -179.694 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.9 ' HD2' HD23 ' A' ' 33' ' ' LEU . 8.8 Cg_endo -50.5 140.41 35.73 Favored 'Trans proline' 0 C--N 1.304 -1.763 0 O-C-N 124.009 1.531 . . . . 0.0 110.218 179.727 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -43.72 -35.03 6.19 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 124.029 1.542 . . . . 0.0 110.328 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -62.68 -45.63 91.89 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.179 -0.951 . . . . 0.0 110.239 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.743 ' HG2' HG22 ' B' ' 17' ' ' VAL . 1.9 mp0 -69.33 -42.23 75.6 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.179 -0.951 . . . . 0.0 110.297 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.45 -48.42 79.21 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.243 -0.911 . . . . 0.0 110.225 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -57.48 -43.06 83.79 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.31 -0.869 . . . . 0.0 109.867 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -66.13 -44.22 84.85 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.284 -0.885 . . . . 0.0 110.127 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.475 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 5.5 m -59.52 -50.7 72.9 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.3 -0.875 . . . . 0.0 110.494 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 81.2 mt -60.0 -25.21 32.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.269 -0.895 . . . . 0.0 110.339 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.85 -40.37 72.41 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.27 -0.894 . . . . 0.0 109.721 179.495 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.615 ' HB2' ' CD2' ' A' ' 63' ' ' PHE . 11.1 mpt_? -84.46 -69.07 0.67 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.373 -0.829 . . . . 0.0 109.815 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.699 ' HE1' ' HB3' ' A' ' 60' ' ' TYR . 21.5 mtt -32.04 116.78 0.39 Allowed Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.775 -0.578 . . . . 0.0 111.197 179.42 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.692 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 38.8 Cg_exo -87.83 -149.64 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.753 0 O-C-N 124.013 1.533 . . . . 0.0 110.048 179.721 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -89.05 140.03 29.86 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.195 -0.941 . . . . 0.0 110.299 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -69.23 -56.21 8.26 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.233 -0.917 . . . . 0.0 110.257 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 55.81 89.37 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.28 -0.887 . . . . 0.0 110.233 -179.965 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -134.29 -156.62 7.91 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.683 -1.367 . . . . 0.0 109.683 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -84.53 79.87 2.4 Favored 'Trans proline' 0 C--N 1.306 -1.705 0 O-C-N 124.068 1.562 . . . . 0.0 110.378 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.485 ' O ' ' O ' ' A' ' 53' ' ' SER . . . 86.33 38.81 8.14 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.693 -1.363 . . . . 0.0 109.693 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.485 ' O ' ' O ' ' A' ' 52' ' ' GLY . 1.5 p -54.22 -162.55 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.277 0 O-C-N 121.338 -1.095 . . . . 0.0 110.599 -179.715 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.771 HG22 ' HB2' ' A' ' 57' ' ' ALA . 24.0 m -124.92 160.79 52.57 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.255 -0.903 . . . . 0.0 110.185 179.834 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -73.5 69.06 4.32 Favored 'Trans proline' 0 C--N 1.306 -1.663 0 O-C-N 124.031 1.543 . . . . 0.0 110.36 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 148.7 37.14 0.04 OUTLIER Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.734 -1.346 . . . . 0.0 109.734 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.771 ' HB2' HG22 ' A' ' 54' ' ' VAL . . . -113.56 115.01 27.29 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.204 -1.174 . . . . 0.0 110.016 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.854 HD22 ' N ' ' A' ' 58' ' ' LEU . 0.9 OUTLIER -105.6 160.73 14.96 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.28 -0.887 . . . . 0.0 110.217 -179.615 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.514 ' OD1' ' N ' ' A' ' 59' ' ' ASP . 1.5 p-10 -107.46 110.53 22.5 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.097 -1.002 . . . . 0.0 111.081 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.699 ' HB3' ' HE1' ' A' ' 45' ' ' MET . 16.0 p90 -72.77 -23.21 60.79 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.328 -0.858 . . . . 0.0 109.231 178.878 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.576 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.19 -41.92 72.59 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.273 -0.892 . . . . 0.0 108.719 179.436 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.692 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -58.89 -32.19 69.28 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 119.494 -0.882 . . . . 0.0 108.79 178.493 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.634 ' CZ ' HG22 ' B' ' 20' ' ' VAL . 26.2 t80 -59.7 -49.33 78.16 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 121.257 0.551 . . . . 0.0 110.708 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.474 ' OG ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -70.5 -37.25 74.16 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.123 -0.985 . . . . 0.0 110.78 -179.432 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 51.3 p -64.52 -41.78 96.18 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.149 -0.969 . . . . 0.0 110.467 -179.691 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -75.57 -40.69 56.31 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.148 -0.97 . . . . 0.0 110.507 -179.76 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.577 HD13 ' CD1' ' A' ' 63' ' ' PHE . 0.2 OUTLIER -64.02 -43.98 93.95 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.204 -0.935 . . . . 0.0 110.424 -179.713 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.778 ' CZ ' HG22 ' A' ' 6' ' ' THR . 24.5 m-85 -98.89 15.36 25.84 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.23 -0.919 . . . . 0.0 110.287 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -96.5 -170.23 34.46 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.454 -1.458 . . . . 0.0 109.454 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -68.27 -169.09 0.13 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.259 -1.142 . . . . 0.0 110.15 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.4 p -164.5 -177.11 4.67 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.281 -0.887 . . . . 0.0 110.234 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -101.68 135.09 43.8 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.198 -0.939 . . . . 0.0 110.199 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.8 tp . . . . . 0 N--CA 1.492 1.645 0 O-C-N 121.239 -0.913 . . . . 0.0 110.14 -179.947 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.89 -5.71 56.52 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.262 -1.14 . . . . 0.0 110.282 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.444 ' HA ' HG21 ' A' ' 16' ' ' ILE . 10.4 ttpt -62.3 -39.45 93.05 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.251 -0.906 . . . . 0.0 110.239 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.66 -40.04 86.42 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.211 -0.931 . . . . 0.0 110.15 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.31 -39.81 91.87 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.316 -0.865 . . . . 0.0 110.273 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 12' ' ' ALA . . . . . 0.808 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -61.98 -41.87 98.51 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.18 -0.95 . . . . 0.0 109.984 -179.913 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.669 HG13 ' HG ' ' A' ' 33' ' ' LEU . 59.0 t -63.65 -43.11 98.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.264 -0.898 . . . . 0.0 109.721 179.518 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.51 -42.21 95.91 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.317 -0.864 . . . . 0.0 110.005 179.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 22.8 m -64.57 -43.21 94.63 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.314 -0.866 . . . . 0.0 110.018 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.808 HG23 ' O ' ' B' ' 12' ' ' ALA . 30.9 t -63.61 -46.51 94.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.255 -0.903 . . . . 0.0 110.024 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.743 HG22 ' HG2' ' A' ' 37' ' ' GLN . 83.2 t -58.16 -42.32 82.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.245 -0.91 . . . . 0.0 109.944 179.838 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.67 -45.57 93.66 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.231 -0.918 . . . . 0.0 109.917 179.634 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.97 -42.06 90.35 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.301 -0.874 . . . . 0.0 109.957 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.634 HG22 ' CZ ' ' A' ' 63' ' ' PHE . 52.2 t -67.77 -43.2 86.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.278 -0.889 . . . . 0.0 110.045 179.837 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.871 ' O ' HG23 ' B' ' 25' ' ' VAL . 2.0 t70 -64.2 -34.04 77.17 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.283 -0.885 . . . . 0.0 110.123 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 22' ' ' GLN . . . . . 0.439 ' OE1' ' OE1' ' B' ' 27' ' ' GLU . 0.6 OUTLIER -66.9 -36.58 82.6 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.232 -0.917 . . . . 0.0 110.243 179.926 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.539 ' HB2' ' CD2' ' A' ' 67' ' ' LEU . . . -65.38 -42.77 92.32 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.238 -0.913 . . . . 0.0 110.618 -179.701 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 24' ' ' ARG . . . . . 0.461 ' HG2' ' O ' ' B' ' 21' ' ' ASP . 2.1 ptm180 -70.3 -35.84 73.95 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.041 -1.037 . . . . 0.0 110.274 -179.863 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 25' ' ' VAL . . . . . 0.871 HG23 ' O ' ' B' ' 21' ' ' ASP . 71.3 t -54.22 -21.19 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.363 -0.836 . . . . 0.0 110.463 -179.886 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.466 ' CB ' ' O ' ' B' ' 25' ' ' VAL . 0.5 OUTLIER 67.88 70.87 0.33 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.329 -0.857 . . . . 0.0 110.096 -179.899 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 27' ' ' GLU . . . . . 0.439 ' OE1' ' OE1' ' B' ' 22' ' ' GLN . 1.6 pt-20 -75.98 142.39 72.59 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.235 -0.915 . . . . 0.0 110.336 -179.814 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -83.84 137.18 7.49 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 O-C-N 124.086 1.572 . . . . 0.0 110.358 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 2.9 ttt85 . . . . . 0 N--CA 1.491 1.582 0 O-C-N 121.187 -0.946 . . . . 0.0 110.279 179.979 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 ptp . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 121.284 0.564 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -139.67 155.93 47.11 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.246 -0.909 . . . . 0.0 110.27 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 17.4 p30 -150.37 163.98 37.0 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.282 -0.886 . . . . 0.0 110.011 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.47 ' HA ' ' OE1' ' A' ' 8' ' ' GLU . 10.0 t -161.22 175.78 11.95 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.163 -0.96 . . . . 0.0 110.435 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -178.42 -160.51 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.315 -0.866 . . . . 0.0 110.207 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.418 HG22 ' CZ ' ' A' ' 68' ' ' TYR . 4.2 m -76.93 -52.23 9.79 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.289 -0.882 . . . . 0.0 110.092 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -70.04 -46.25 65.42 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.162 -0.961 . . . . 0.0 109.909 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.47 ' OE1' ' HA ' ' A' ' 4' ' ' THR . 1.3 tt0 -54.64 -36.68 64.79 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.383 -0.823 . . . . 0.0 110.051 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.416 ' HG2' HG21 ' B' ' 15' ' ' THR . 40.6 tt0 -61.63 -43.09 99.51 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.255 -0.903 . . . . 0.0 110.236 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 98.2 t -61.79 -42.13 93.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.194 -0.941 . . . . 0.0 109.996 179.829 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.622 HG23 ' HE1' ' A' ' 60' ' ' TYR . 82.7 mt -57.41 -49.88 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.31 -0.869 . . . . 0.0 109.683 179.68 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.54 -37.61 76.04 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 119.504 -0.878 . . . . 0.0 108.796 178.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.475 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 41.7 m -67.66 -39.7 84.54 Favored 'General case' 0 N--CA 1.485 1.324 0 O-C-N 121.456 -0.778 . . . . 0.0 109.206 178.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.517 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 0.7 OUTLIER -68.41 -42.62 78.73 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.346 -0.847 . . . . 0.0 109.534 179.185 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -53.95 -41.57 67.92 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.245 -0.91 . . . . 0.0 108.939 179.077 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.8 mt -62.0 -41.11 89.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.459 -0.775 . . . . 0.0 109.611 179.21 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 13' ' ' SER . 26.7 mt -64.89 -41.94 95.19 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.256 -0.902 . . . . 0.0 109.456 179.455 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.666 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -77.14 -7.31 55.58 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.438 -0.789 . . . . 0.0 110.092 179.761 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.477 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 68.07 67.44 0.34 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.231 -0.918 . . . . 0.0 110.235 -179.908 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.413 ' O ' ' HG2' ' A' ' 21' ' ' LYS . 0.3 OUTLIER 59.85 61.84 1.82 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.246 -0.908 . . . . 0.0 110.3 179.885 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.666 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 6.3 mttt -147.92 142.78 16.93 Favored Pre-proline 0 N--CA 1.489 1.487 0 O-C-N 121.234 -0.916 . . . . 0.0 110.01 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 21' ' ' LYS . 35.2 Cg_exo -74.29 0.92 7.9 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 O-C-N 123.955 1.503 . . . . 0.0 110.081 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.477 ' CD1' ' HB1' ' A' ' 57' ' ' ALA . 45.5 p90 -145.83 164.82 30.73 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.259 -0.901 . . . . 0.0 110.159 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.815 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -131.62 141.91 44.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.162 -0.961 . . . . 0.0 110.2 -179.873 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.815 ' N ' HD13 ' A' ' 24' ' ' ILE . 4.2 mt -81.52 157.7 24.73 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.13 -0.981 . . . . 0.0 110.205 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.73 -41.06 75.8 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.302 -0.874 . . . . 0.0 110.32 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -60.7 -35.41 76.23 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.176 -0.953 . . . . 0.0 110.17 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.455 ' OE1' ' OE2' ' A' ' 32' ' ' GLU . 9.0 mt-10 -64.25 -44.11 92.82 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.348 -0.845 . . . . 0.0 109.925 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.637 HD12 HG13 ' A' ' 42' ' ' ILE . 18.0 mt -60.66 -33.72 73.24 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.203 -0.936 . . . . 0.0 109.609 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.594 HH12 HD13 ' A' ' 42' ' ' ILE . 18.9 mtt85 -67.89 -35.08 77.88 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.388 -0.82 . . . . 0.0 110.309 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.4 ttt180 -95.62 -20.62 18.81 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.164 -0.96 . . . . 0.0 110.82 -179.649 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.456 ' OE1' ' HB3' ' A' ' 17' ' ' LEU . 86.5 mt-10 -96.14 -23.78 16.59 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.05 -1.031 . . . . 0.0 110.466 -179.764 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.521 HD22 ' CB ' ' A' ' 37' ' ' GLN . 6.0 mt -129.44 153.59 80.62 Favored Pre-proline 0 C--N 1.305 -1.348 0 O-C-N 121.233 -0.917 . . . . 0.0 110.078 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.415 ' CD ' HD23 ' A' ' 33' ' ' LEU . 33.1 Cg_exo -56.19 154.46 28.45 Favored 'Trans proline' 0 C--N 1.306 -1.69 0 O-C-N 123.94 1.495 . . . . 0.0 110.264 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -47.68 -38.74 29.66 Favored 'Trans proline' 0 C--N 1.307 -1.652 0 O-C-N 124.048 1.551 . . . . 0.0 110.305 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.73 -46.33 85.87 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.248 -0.908 . . . . 0.0 110.291 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.621 ' HG2' HG22 ' B' ' 17' ' ' VAL . 9.6 mp0 -69.27 -44.42 71.92 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.282 -0.886 . . . . 0.0 110.383 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.904 ' O ' HD12 ' A' ' 42' ' ' ILE . . . -56.26 -48.07 77.29 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.175 -0.953 . . . . 0.0 110.367 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.8 tm0? -64.74 -43.02 94.7 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.226 -0.921 . . . . 0.0 110.191 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -64.93 -46.79 80.17 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.281 -0.887 . . . . 0.0 110.305 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.443 ' SG ' ' O ' ' A' ' 37' ' ' GLN . 62.2 m -65.46 -49.71 68.09 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.157 -0.965 . . . . 0.0 110.452 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.904 HD12 ' O ' ' A' ' 38' ' ' ALA . 6.3 mt -58.22 -24.03 23.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.221 -0.924 . . . . 0.0 110.38 -179.769 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.41 -30.3 33.62 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.156 -0.965 . . . . 0.0 110.367 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.576 ' HG3' ' CE1' ' A' ' 63' ' ' PHE . 2.2 mmt180 -86.27 -58.93 2.44 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.218 -0.927 . . . . 0.0 110.195 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.687 ' SD ' HG22 ' A' ' 24' ' ' ILE . 1.4 ttm -38.29 119.27 1.02 Allowed Pre-proline 0 N--CA 1.492 1.641 0 O-C-N 121.511 -0.743 . . . . 0.0 110.722 179.855 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.446 ' CD ' ' HB3' ' A' ' 62' ' ' ALA . 12.4 Cg_endo -82.1 -163.16 0.2 Allowed 'Trans proline' 0 C--N 1.305 -1.736 0 O-C-N 123.937 1.493 . . . . 0.0 110.22 179.792 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -88.44 127.43 35.51 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.215 -0.928 . . . . 0.0 110.267 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.5 ' CB ' ' O ' ' A' ' 57' ' ' ALA . 5.9 t80 -65.04 116.31 6.31 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.191 -0.943 . . . . 0.0 110.052 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.32 126.74 52.44 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.203 -0.936 . . . . 0.0 110.18 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -155.6 -119.5 0.65 Allowed Glycine 0 N--CA 1.489 2.232 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -95.13 -42.1 0.02 OUTLIER 'Trans proline' 0 C--N 1.304 -1.765 0 O-C-N 124.053 1.554 . . . . 0.0 110.203 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.485 ' O ' ' O ' ' A' ' 53' ' ' SER . . . -170.56 51.9 0.19 Allowed Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.451 -1.46 . . . . 0.0 109.451 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.485 ' O ' ' O ' ' A' ' 52' ' ' GLY . 2.5 m -54.87 -159.82 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.325 0 O-C-N 121.347 -1.09 . . . . 0.0 110.746 -179.656 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.443 ' O ' ' N ' ' A' ' 56' ' ' GLY . 12.1 m -141.44 147.84 48.11 Favored Pre-proline 0 N--CA 1.492 1.633 0 O-C-N 121.225 -0.922 . . . . 0.0 110.158 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -57.88 86.68 0.05 OUTLIER 'Trans proline' 0 C--N 1.305 -1.728 0 O-C-N 124.095 1.577 . . . . 0.0 110.21 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 54' ' ' VAL . . . 164.73 -36.52 0.28 Allowed Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.5 ' O ' ' CB ' ' A' ' 48' ' ' TYR . . . -78.82 96.62 5.68 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.206 -1.173 . . . . 0.0 110.207 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.487 ' CB ' ' HG2' ' A' ' 45' ' ' MET . 13.2 mt -92.71 155.76 17.49 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.186 -0.946 . . . . 0.0 110.17 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.472 ' C ' ' HG3' ' A' ' 45' ' ' MET . 4.4 m-20 -103.32 111.7 24.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.2 -0.938 . . . . 0.0 110.13 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.622 ' HE1' HG23 ' A' ' 11' ' ' ILE . 23.7 p90 -72.63 -22.35 60.96 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.389 -0.82 . . . . 0.0 110.157 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.488 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.01 -34.18 65.58 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.182 -0.949 . . . . 0.0 110.021 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.446 ' HB3' ' CD ' ' A' ' 46' ' ' PRO . . . -68.23 -36.49 79.58 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.234 -0.916 . . . . 0.0 109.827 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.606 ' CE1' ' HB3' ' A' ' 67' ' ' LEU . 3.5 t80 -72.1 -35.42 69.2 Favored 'General case' 0 C--N 1.297 -1.683 0 O-C-N 121.676 -0.64 . . . . 0.0 110.455 179.806 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.5 m -56.51 -49.76 73.78 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.258 -0.901 . . . . 0.0 110.567 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.5 m -66.15 -35.6 80.92 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.247 -0.908 . . . . 0.0 110.471 -179.655 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.13 -39.36 63.36 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.299 -0.875 . . . . 0.0 110.841 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.732 HD12 ' C ' ' A' ' 67' ' ' LEU . 0.3 OUTLIER -72.55 -41.22 66.02 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.099 -1.001 . . . . 0.0 110.413 -179.499 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.627 ' CD2' HD11 ' A' ' 67' ' ' LEU . 1.8 m-85 -98.46 4.99 48.41 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.38 -0.825 . . . . 0.0 110.206 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -90.41 161.71 28.91 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 64.5 tt0 -118.12 103.36 9.8 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.238 -1.154 . . . . 0.0 110.197 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.6 t -141.07 69.13 1.34 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.298 -0.876 . . . . 0.0 110.304 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -80.35 138.71 36.73 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.293 -0.88 . . . . 0.0 110.22 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.489 ' O ' HD23 ' A' ' 73' ' ' LEU . 6.3 tt . . . . . 0 N--CA 1.491 1.597 0 O-C-N 121.288 -0.883 . . . . 0.0 110.2 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.259 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 5.6 ptpp? -125.02 -4.57 7.48 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.288 -1.125 . . . . 0.0 110.093 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.544 ' O ' HG23 ' B' ' 13' ' ' VAL . 6.2 ttmt -62.63 -45.67 91.77 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.277 -0.89 . . . . 0.0 109.983 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.52 -37.87 79.47 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.219 -0.926 . . . . 0.0 109.906 179.721 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -63.34 -43.08 98.77 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.238 -0.914 . . . . 0.0 110.014 179.731 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 12' ' ' ALA . . . . . 0.465 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -63.65 -37.56 87.81 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.299 -0.875 . . . . 0.0 110.088 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.591 ' O ' HG23 ' B' ' 17' ' ' VAL . 87.9 t -60.63 -43.27 94.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.269 -0.894 . . . . 0.0 110.018 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.07 -39.07 84.77 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.298 -0.876 . . . . 0.0 110.158 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 15' ' ' THR . . . . . 0.416 HG21 ' HG2' ' A' ' 9' ' ' GLN . 53.0 m -65.52 -49.01 70.53 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.182 -0.949 . . . . 0.0 110.118 179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.607 ' O ' HG23 ' B' ' 20' ' ' VAL . 36.9 t -63.53 -40.73 90.15 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.319 -0.863 . . . . 0.0 110.21 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.621 HG22 ' HG2' ' A' ' 37' ' ' GLN . 71.6 t -61.94 -47.26 94.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.224 -0.922 . . . . 0.0 110.271 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.44 -41.1 96.75 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.161 -0.962 . . . . 0.0 110.425 -179.754 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.78 -45.6 81.82 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.18 -0.95 . . . . 0.0 110.371 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.607 HG23 ' O ' ' B' ' 16' ' ' VAL . 58.4 t -67.83 -45.91 83.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.178 -0.951 . . . . 0.0 110.39 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -56.88 -31.78 65.19 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.253 -0.904 . . . . 0.0 110.271 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 22' ' ' GLN . . . . . 0.962 ' O ' HG12 ' B' ' 25' ' ' VAL . 1.5 tt0 -56.79 -49.88 74.0 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.268 -0.895 . . . . 0.0 110.572 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.94 -34.87 73.84 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.226 -0.921 . . . . 0.0 110.545 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 2.5 tpt180 -70.34 -34.25 72.43 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.164 -0.96 . . . . 0.0 110.489 -179.654 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 25' ' ' VAL . . . . . 0.962 HG12 ' O ' ' B' ' 22' ' ' GLN . 1.8 p -63.24 -21.47 28.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.164 -0.96 . . . . 0.0 110.279 -179.703 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.86 38.9 3.5 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.319 -0.863 . . . . 0.0 110.479 -179.838 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 27' ' ' GLU . . . . . 0.418 ' HA ' ' HD3' ' B' ' 28' ' ' PRO . 0.4 OUTLIER -112.05 150.83 43.01 Favored Pre-proline 0 N--CA 1.491 1.585 0 O-C-N 121.198 -0.939 . . . . 0.0 110.208 179.846 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 28' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' B' ' 27' ' ' GLU . 31.3 Cg_exo -81.52 170.6 14.33 Favored 'Trans proline' 0 C--N 1.306 -1.684 0 O-C-N 123.928 1.488 . . . . 0.0 110.361 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 O-C-N 121.32 -0.863 . . . . 0.0 110.157 -179.96 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.4 mtm . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.197 0.523 . . . . 0.0 110.271 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -94.23 143.13 26.65 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.253 -0.904 . . . . 0.0 110.172 -179.956 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -76.34 -63.93 1.22 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.316 -0.865 . . . . 0.0 110.102 179.913 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.2 p -146.29 80.35 1.56 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.216 -0.928 . . . . 0.0 110.154 179.974 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 53.21 -166.41 0.07 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.229 -0.919 . . . . 0.0 110.103 -179.936 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.824 HG21 ' OH ' ' A' ' 68' ' ' TYR . 2.0 m -105.03 -28.45 11.04 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.136 -0.977 . . . . 0.0 110.107 179.89 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.88 -44.99 83.71 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.237 -0.914 . . . . 0.0 109.628 179.626 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.14 -36.01 67.78 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.467 -0.771 . . . . 0.0 109.959 179.532 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -61.11 -44.17 97.76 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.296 -0.878 . . . . 0.0 110.273 -179.642 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.473 ' HB ' ' HB3' ' A' ' 64' ' ' SER . 22.8 t -58.62 -46.36 90.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.151 -0.968 . . . . 0.0 109.964 179.842 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 21.5 mt -65.18 -49.73 77.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.303 -0.873 . . . . 0.0 109.699 179.789 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.14 -40.84 91.2 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.268 -0.895 . . . . 0.0 109.177 179.274 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.471 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 68.1 m -67.02 -41.15 87.11 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.394 -0.816 . . . . 0.0 109.277 179.134 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.537 ' HB3' ' CD2' ' A' ' 60' ' ' TYR . 1.7 m-85 -68.2 -43.01 79.03 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.386 -0.821 . . . . 0.0 109.57 179.426 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.1 ttp180 -53.24 -41.19 65.2 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.217 -0.927 . . . . 0.0 109.124 179.222 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.5 mt -59.8 -44.86 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.446 -0.784 . . . . 0.0 109.504 179.151 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 13' ' ' SER . 18.4 mt -65.05 -41.68 94.94 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.287 -0.883 . . . . 0.0 109.701 179.508 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.629 ' HB1' ' O ' ' A' ' 23' ' ' TYR . . . -73.29 -1.41 17.82 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.307 -0.871 . . . . 0.0 110.074 179.778 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.489 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 1.4 t 68.28 64.92 0.34 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.198 -0.939 . . . . 0.0 110.267 -179.998 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 50.26 58.2 5.75 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.397 -0.814 . . . . 0.0 110.293 179.953 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.577 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 29.8 mttt -140.7 143.01 30.64 Favored Pre-proline 0 N--CA 1.49 1.56 0 O-C-N 121.303 -0.873 . . . . 0.0 110.085 179.852 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_endo -65.62 -7.6 16.81 Favored 'Trans proline' 0 C--N 1.305 -1.722 0 O-C-N 123.931 1.49 . . . . 0.0 110.122 179.83 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.629 ' O ' ' HB1' ' A' ' 18' ' ' ALA . 23.3 p90 -138.99 166.4 24.59 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.214 -0.929 . . . . 0.0 110.495 -179.927 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.727 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -136.32 144.48 32.85 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.374 -0.829 . . . . 0.0 109.87 -179.967 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.727 ' N ' HD13 ' A' ' 24' ' ' ILE . 4.0 mt -79.87 150.4 30.64 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.188 -0.945 . . . . 0.0 110.075 -179.825 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.581 ' HB2' HD11 ' A' ' 58' ' ' LEU . . . -67.17 -45.61 76.46 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.297 -0.877 . . . . 0.0 110.327 -179.875 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.456 ' CG ' ' N ' ' A' ' 28' ' ' GLU . 22.9 pt-20 -59.27 -37.54 77.88 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.138 -0.976 . . . . 0.0 109.747 179.883 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.456 ' N ' ' CG ' ' A' ' 27' ' ' GLU . 6.2 tt0 -66.75 -34.66 78.32 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.237 -0.914 . . . . 0.0 108.876 179.076 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.556 HD11 ' HA ' ' A' ' 38' ' ' ALA . 2.6 tp -66.67 -39.92 88.37 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 108.706 -0.849 . . . . 0.0 108.706 178.803 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.23 -34.43 78.09 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.561 -0.712 . . . . 0.0 109.544 179.065 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.7 tpt180 -84.46 -39.3 19.1 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.484 -0.76 . . . . 0.0 110.876 -179.792 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -76.15 -23.5 54.79 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.217 -0.927 . . . . 0.0 110.973 -179.084 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.684 HD11 HG11 ' B' ' 16' ' ' VAL . 4.2 mt -127.87 156.59 75.69 Favored Pre-proline 0 N--CA 1.488 1.458 0 O-C-N 121.07 -1.019 . . . . 0.0 110.228 -179.837 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.606 ' CD ' HD23 ' A' ' 33' ' ' LEU . 22.9 Cg_exo -60.01 142.49 98.55 Favored 'Trans proline' 0 C--N 1.304 -1.774 0 O-C-N 124.011 1.532 . . . . 0.0 110.184 179.979 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -41.68 -38.87 4.59 Favored 'Trans proline' 0 C--N 1.304 -1.773 0 O-C-N 124.065 1.561 . . . . 0.0 110.225 179.996 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -63.12 -43.28 98.87 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.337 -0.852 . . . . 0.0 110.242 179.956 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.794 ' HG3' HG22 ' B' ' 17' ' ' VAL . 82.3 mm-40 -69.21 -41.99 76.34 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.188 -0.945 . . . . 0.0 109.981 179.966 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.556 ' HA ' HD11 ' A' ' 29' ' ' LEU . . . -63.67 -48.22 78.08 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.294 -0.879 . . . . 0.0 110.089 179.969 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -54.95 -48.6 72.96 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.251 -0.906 . . . . 0.0 109.926 179.932 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -64.01 -47.86 78.61 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.311 -0.868 . . . . 0.0 109.854 179.771 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.509 ' O ' ' HG2' ' A' ' 45' ' ' MET . 75.9 m -65.43 -49.57 68.69 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.341 -0.849 . . . . 0.0 110.381 179.929 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.474 HG12 ' O ' ' A' ' 38' ' ' ALA . 9.0 mm -41.54 -33.43 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.317 -0.865 . . . . 0.0 110.241 -179.893 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.44 -37.67 19.52 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.29 -0.881 . . . . 0.0 110.263 179.948 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.521 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 0.9 OUTLIER -65.79 -75.66 0.09 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.284 -0.885 . . . . 0.0 110.243 -179.878 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.549 ' CE ' ' HB3' ' A' ' 60' ' ' TYR . 6.3 ptp -53.02 108.58 1.14 Allowed Pre-proline 0 N--CA 1.488 1.462 0 O-C-N 121.22 -0.925 . . . . 0.0 110.175 179.952 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.506 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 17.3 Cg_exo -68.95 -147.17 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.756 0 O-C-N 123.995 1.524 . . . . 0.0 110.326 -179.865 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -83.3 152.07 25.29 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.24 -0.912 . . . . 0.0 110.237 179.989 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.511 ' CD1' ' C ' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -68.65 173.67 4.93 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.265 -0.897 . . . . 0.0 110.353 179.997 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.7 p -169.02 44.97 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.302 -0.874 . . . . 0.0 110.216 179.946 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -105.56 166.79 14.4 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.465 -1.454 . . . . 0.0 109.465 179.936 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -86.48 127.84 2.88 Favored 'Trans proline' 0 C--N 1.304 -1.769 0 O-C-N 124.069 1.562 . . . . 0.0 110.338 179.994 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.474 ' O ' ' O ' ' A' ' 53' ' ' SER . . . 96.9 -19.45 54.71 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 179.967 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.474 ' O ' ' O ' ' A' ' 52' ' ' GLY . 6.0 m -53.63 -163.93 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.291 -1.123 . . . . 0.0 110.718 -179.666 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.491 ' O ' ' CE2' ' A' ' 48' ' ' TYR . 13.4 m -148.26 166.75 14.85 Favored Pre-proline 0 N--CA 1.493 1.675 0 O-C-N 121.368 -0.833 . . . . 0.0 110.132 179.838 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -72.7 121.72 7.62 Favored 'Trans proline' 0 C--N 1.304 -1.779 0 O-C-N 124.065 1.561 . . . . 0.0 110.335 -179.891 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 119.22 -7.73 12.57 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 179.888 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.413 ' HB1' ' HB2' ' A' ' 23' ' ' TYR . . . -88.98 157.44 18.38 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.146 -1.208 . . . . 0.0 110.334 -179.978 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.581 HD11 ' HB2' ' A' ' 26' ' ' ALA . 91.7 mt -127.71 160.29 32.12 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.294 -0.879 . . . . 0.0 110.024 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -111.75 111.93 23.26 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.149 -0.969 . . . . 0.0 110.517 -179.775 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.549 ' HB3' ' CE ' ' A' ' 45' ' ' MET . 14.5 p90 -81.66 -19.82 40.87 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.318 -0.864 . . . . 0.0 109.647 179.415 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.422 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.03 -36.65 68.24 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.249 -0.907 . . . . 0.0 109.793 179.883 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.506 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -63.94 -34.95 79.14 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.224 -0.923 . . . . 0.0 109.763 179.593 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.953 ' CZ ' HD11 ' A' ' 67' ' ' LEU . 4.6 t80 -71.78 -32.74 67.96 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.567 -0.708 . . . . 0.0 110.114 179.628 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.473 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.9 OUTLIER -71.79 -49.29 40.02 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.348 -0.845 . . . . 0.0 110.297 -179.876 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 66.2 m -63.75 -42.34 97.86 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.251 -0.905 . . . . 0.0 110.301 -179.887 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.499 ' HA ' ' O ' ' A' ' 69' ' ' GLY . . . -70.52 -28.75 65.18 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.188 -0.945 . . . . 0.0 110.27 -179.87 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.953 HD11 ' CZ ' ' A' ' 63' ' ' PHE . 8.4 mt -61.44 -42.41 98.71 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.205 -0.935 . . . . 0.0 110.365 -179.935 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.824 ' OH ' HG21 ' A' ' 6' ' ' THR . 20.1 m-85 -98.39 4.43 48.51 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.208 -0.932 . . . . 0.0 110.223 179.987 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.499 ' O ' ' HA ' ' A' ' 66' ' ' ALA . . . -151.46 134.08 4.49 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 -179.962 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.439 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 11.8 pt-20 -118.41 145.38 45.24 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.323 -1.104 . . . . 0.0 110.177 -179.993 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 71.0 p -167.36 -164.7 0.62 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.235 -0.916 . . . . 0.0 110.16 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 19.7 p-10 -104.08 116.02 31.48 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.331 -0.856 . . . . 0.0 110.175 179.964 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.3 tp . . . . . 0 N--CA 1.491 1.617 0 O-C-N 121.281 -0.887 . . . . 0.0 110.218 -179.991 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.235 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 3.1 tmtm? -103.6 -65.59 1.0 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.228 -1.16 . . . . 0.0 110.132 -179.906 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.402 ' O ' HG23 ' B' ' 13' ' ' VAL . 0.7 OUTLIER -61.79 -44.69 96.37 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.18 -0.95 . . . . 0.0 110.147 179.974 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.01 -38.8 68.35 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.219 -0.926 . . . . 0.0 109.949 179.871 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -65.48 -39.93 92.51 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.286 -0.884 . . . . 0.0 110.017 179.806 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.28 -37.5 85.75 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.208 -0.933 . . . . 0.0 109.991 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.402 HG23 ' O ' ' B' ' 9' ' ' LYS . 51.9 t -65.0 -40.44 89.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.208 -0.933 . . . . 0.0 109.8 179.658 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.63 -35.59 76.57 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.326 -0.858 . . . . 0.0 110.058 179.843 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 41.2 m -68.1 -43.6 78.12 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.291 -0.88 . . . . 0.0 110.238 -179.981 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.684 HG11 HD11 ' A' ' 33' ' ' LEU . 92.1 t -66.6 -42.48 89.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.273 -0.892 . . . . 0.0 110.134 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.794 HG22 ' HG3' ' A' ' 37' ' ' GLN . 70.1 t -63.38 -47.54 91.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.406 -0.809 . . . . 0.0 110.313 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.31 -40.76 95.36 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.307 -0.871 . . . . 0.0 110.198 -179.976 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.67 -37.97 88.0 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.286 -0.884 . . . . 0.0 110.236 179.977 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.526 HG23 ' O ' ' B' ' 16' ' ' VAL . 54.5 t -67.92 -43.86 85.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.199 -0.938 . . . . 0.0 110.273 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.44 ' O ' HG23 ' B' ' 25' ' ' VAL . 38.4 t0 -62.1 -35.57 79.1 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.308 -0.87 . . . . 0.0 110.366 -179.965 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -60.05 -50.08 75.12 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.222 -0.924 . . . . 0.0 110.297 -179.978 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.43 ' HB2' ' CD2' ' A' ' 67' ' ' LEU . . . -63.76 -35.07 79.39 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.278 -0.889 . . . . 0.0 110.107 179.994 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.22 -41.53 73.48 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.247 -0.908 . . . . 0.0 110.182 179.833 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 25' ' ' VAL . . . . . 0.598 HG12 ' HB2' ' B' ' 27' ' ' GLU . 65.8 t -78.34 -21.73 13.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 121.242 -0.911 . . . . 0.0 110.245 -179.979 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 48.87 35.73 7.07 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.406 -0.809 . . . . 0.0 110.456 179.773 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 27' ' ' GLU . . . . . 0.598 ' HB2' HG12 ' B' ' 25' ' ' VAL . 5.4 tt0 -111.95 140.84 23.85 Favored Pre-proline 0 N--CA 1.492 1.674 0 O-C-N 121.096 -1.003 . . . . 0.0 110.237 179.906 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 28' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' B' ' 27' ' ' GLU . 38.4 Cg_exo -86.43 -67.47 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.694 0 O-C-N 124.006 1.529 . . . . 0.0 110.36 179.914 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.176 -0.952 . . . . 0.0 110.276 -179.962 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 121.197 0.522 . . . . 0.0 110.233 . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -140.26 102.87 4.46 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.296 -0.877 . . . . 0.0 110.186 -179.963 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.407 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 7.5 t0 -122.74 27.88 7.56 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.261 -0.899 . . . . 0.0 110.222 179.99 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.2 p -91.41 79.69 5.56 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.242 -0.911 . . . . 0.0 110.257 -179.871 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -133.28 177.96 7.27 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.233 -0.917 . . . . 0.0 110.225 179.875 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.78 -66.53 1.04 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.224 -0.923 . . . . 0.0 110.191 -179.885 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.68 -47.78 77.17 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.186 -0.946 . . . . 0.0 109.867 179.909 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.65 -36.15 64.26 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.425 -0.797 . . . . 0.0 109.981 179.586 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.407 ' NE2' ' O ' ' A' ' 3' ' ' ASP . 0.0 OUTLIER -61.45 -44.68 96.68 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.364 -0.835 . . . . 0.0 110.37 -179.711 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.48 HG21 HD21 ' A' ' 67' ' ' LEU . 88.6 t -57.99 -41.38 80.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.261 -0.9 . . . . 0.0 110.012 179.996 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 59.5 mt -63.65 -49.83 80.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.359 -0.838 . . . . 0.0 109.651 179.653 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.25 -42.45 91.15 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.284 -0.885 . . . . 0.0 109.033 179.22 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.471 ' HA ' HD12 ' A' ' 16' ' ' ILE . 0.1 OUTLIER -64.09 -39.43 94.05 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.379 -0.826 . . . . 0.0 109.302 179.033 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.623 ' CB ' ' CD1' ' A' ' 60' ' ' TYR . 3.1 m-85 -68.15 -42.17 80.51 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.308 -0.87 . . . . 0.0 109.51 179.282 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -55.85 -41.18 73.94 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.166 -0.959 . . . . 0.0 109.429 179.209 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.637 ' CD1' ' HB2' ' B' ' 12' ' ' ALA . 96.8 mt -60.27 -44.84 96.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.388 -0.82 . . . . 0.0 109.728 179.408 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 13' ' ' SER . 61.1 mt -64.98 -41.89 95.04 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.315 -0.866 . . . . 0.0 109.548 179.561 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.566 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -71.06 -15.27 62.53 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.357 -0.839 . . . . 0.0 110.089 179.625 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.478 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 68.05 72.25 0.31 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.291 -0.881 . . . . 0.0 110.339 -179.985 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.463 ' HB2' ' O ' ' A' ' 19' ' ' SER . 2.7 m-20 56.62 61.9 2.49 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.347 -0.845 . . . . 0.0 110.367 179.857 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.566 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 35.1 mttp -153.5 142.1 14.3 Favored Pre-proline 0 N--CA 1.489 1.49 0 O-C-N 121.274 -0.891 . . . . 0.0 110.093 179.878 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.402 ' HG2' ' HG2' ' A' ' 51' ' ' PRO . 12.0 Cg_endo -76.59 3.9 6.02 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 O-C-N 124.092 1.575 . . . . 0.0 110.188 179.912 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.416 ' CD1' ' C ' ' A' ' 23' ' ' TYR . 20.6 p90 -145.9 156.52 43.59 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.185 -0.947 . . . . 0.0 110.026 179.999 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.827 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -125.67 142.74 41.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.169 -0.957 . . . . 0.0 109.735 179.997 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.827 ' N ' HD13 ' A' ' 24' ' ' ILE . 6.0 mp -80.14 145.81 32.15 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.132 -0.98 . . . . 0.0 109.919 -179.729 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.469 ' O ' ' HG ' ' A' ' 29' ' ' LEU . . . -58.68 -44.91 90.36 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.324 -0.86 . . . . 0.0 110.366 -179.628 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.77 -34.18 77.74 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.216 -0.928 . . . . 0.0 110.369 180.0 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.619 ' HB3' HD11 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -64.08 -51.08 65.74 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.12 -0.988 . . . . 0.0 110.288 -179.698 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.861 HD21 ' CG1' ' A' ' 42' ' ' ILE . 1.0 OUTLIER -67.27 -33.54 75.51 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.141 -0.974 . . . . 0.0 109.579 179.402 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.802 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -61.23 -35.0 76.04 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.524 -0.735 . . . . 0.0 110.347 -179.965 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.2 ttt180 -94.03 -17.83 22.48 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.221 -0.925 . . . . 0.0 110.262 -179.949 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -90.09 -21.62 22.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.273 -0.892 . . . . 0.0 110.246 179.972 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.702 HD11 HG11 ' B' ' 16' ' ' VAL . 11.2 mt -117.59 154.27 50.69 Favored Pre-proline 0 N--CA 1.487 1.395 0 O-C-N 121.261 -0.899 . . . . 0.0 110.249 -179.698 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.468 ' HD2' ' HB2' ' A' ' 37' ' ' GLN . 39.7 Cg_exo -59.24 153.87 50.17 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 O-C-N 123.875 1.461 . . . . 0.0 110.134 179.788 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -43.89 -44.1 11.95 Favored 'Trans proline' 0 C--N 1.305 -1.72 0 O-C-N 124.088 1.573 . . . . 0.0 110.542 -179.857 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.424 ' O ' ' HB2' ' A' ' 40' ' ' TYR . 0.3 OUTLIER -65.53 -46.91 77.76 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.273 -0.892 . . . . 0.0 110.393 -179.835 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.612 ' HG2' HG22 ' B' ' 17' ' ' VAL . 3.8 mp0 -69.69 -41.82 74.94 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.202 -0.936 . . . . 0.0 110.377 -179.935 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.802 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -59.21 -48.38 81.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.183 -0.948 . . . . 0.0 110.374 -179.811 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 -66.23 -43.48 86.49 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.25 -0.906 . . . . 0.0 110.37 -179.894 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.424 ' HB2' ' O ' ' A' ' 36' ' ' ASP . 1.2 t80 -62.31 -47.08 85.88 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.31 -0.869 . . . . 0.0 110.548 -179.76 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.455 ' O ' ' SD ' ' A' ' 45' ' ' MET . 71.9 m -62.43 -51.17 68.59 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.284 -0.885 . . . . 0.0 110.508 -179.668 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.861 ' CG1' HD21 ' A' ' 29' ' ' LEU . 53.3 mt -58.84 -19.08 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.244 -0.91 . . . . 0.0 110.332 -179.96 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 4.9 tttm -85.22 -19.98 30.84 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.323 -0.861 . . . . 0.0 110.529 -179.717 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.601 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 12.6 mmt85 -100.35 -72.82 0.66 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.176 -0.953 . . . . 0.0 110.759 -179.56 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.531 ' N ' ' HB2' ' A' ' 63' ' ' PHE . 1.4 ptm -45.25 127.47 5.85 Favored Pre-proline 0 N--CA 1.487 1.412 0 O-C-N 121.14 -0.975 . . . . 0.0 110.265 -179.698 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.706 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 9.4 Cg_endo -52.51 -170.33 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.738 0 O-C-N 124.084 1.571 . . . . 0.0 110.3 -179.94 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.509 ' O ' ' HB2' ' A' ' 48' ' ' TYR . . . -108.22 37.88 2.36 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.253 -0.904 . . . . 0.0 110.473 -179.713 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.509 ' HB2' ' O ' ' A' ' 47' ' ' ALA . 88.1 t80 179.3 174.68 0.74 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.295 -0.878 . . . . 0.0 110.175 179.771 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.507 ' HB3' ' HD2' ' A' ' 51' ' ' PRO . 0.1 OUTLIER -137.51 -56.47 0.69 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.244 -0.91 . . . . 0.0 110.333 -179.962 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.506 ' N ' ' CD ' ' A' ' 51' ' ' PRO . . . 164.39 -52.59 0.28 Allowed Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.805 -1.318 . . . . 0.0 109.805 -179.997 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.507 ' HD2' ' HB3' ' A' ' 49' ' ' SER . 33.1 Cg_exo -46.96 173.28 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.732 0 O-C-N 123.947 1.498 . . . . 0.0 110.387 -179.948 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.563 ' O ' HG13 ' A' ' 54' ' ' VAL . . . -49.23 102.75 0.06 OUTLIER Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.711 -1.356 . . . . 0.0 109.711 -179.832 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.461 ' C ' ' O ' ' A' ' 52' ' ' GLY . 0.0 OUTLIER -37.83 139.5 0.31 Allowed 'General case' 0 C--N 1.308 -1.221 0 O-C-N 121.517 -0.99 . . . . 0.0 110.771 -179.754 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.641 HG22 ' HB2' ' A' ' 57' ' ' ALA . 34.5 m -128.28 161.16 58.17 Favored Pre-proline 0 C--N 1.294 -1.808 0 O-C-N 121.697 -0.627 . . . . 0.0 110.248 -179.894 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.405 ' HD2' ' HB ' ' A' ' 54' ' ' VAL . 37.4 Cg_exo -45.18 96.68 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.74 0 O-C-N 124.05 1.553 . . . . 0.0 110.328 179.977 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.435 ' N ' ' O ' ' A' ' 54' ' ' VAL . . . 77.1 78.55 0.74 Allowed Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.611 -1.396 . . . . 0.0 109.611 179.85 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.641 ' HB2' HG22 ' A' ' 54' ' ' VAL . . . -117.21 121.6 41.68 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.275 -1.132 . . . . 0.0 110.213 179.876 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.5 HD12 ' N ' ' A' ' 58' ' ' LEU . 2.5 mp -129.03 143.66 50.94 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.223 -0.923 . . . . 0.0 110.089 179.592 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.543 ' OD1' ' HB3' ' A' ' 61' ' ' ALA . 7.7 t0 -94.69 111.29 23.06 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.18 -0.95 . . . . 0.0 110.244 179.755 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.623 ' CD1' ' CB ' ' A' ' 14' ' ' PHE . 21.7 p90 -76.87 -25.29 52.92 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.189 -0.944 . . . . 0.0 108.882 179.118 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.543 ' HB3' ' OD1' ' A' ' 59' ' ' ASP . . . -56.42 -45.35 80.76 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.519 -0.738 . . . . 0.0 109.449 179.33 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.706 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -57.16 -36.15 70.4 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.346 -0.846 . . . . 0.0 109.643 179.549 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.601 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 1.6 t80 -71.8 -37.86 70.32 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.647 -0.658 . . . . 0.0 110.004 179.581 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.4 p -56.03 -49.73 72.89 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.313 -0.867 . . . . 0.0 110.234 -179.897 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.1 m -62.27 -37.3 84.95 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.165 -0.96 . . . . 0.0 110.064 179.892 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.89 -39.05 64.17 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.234 -0.916 . . . . 0.0 110.115 179.753 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.701 HD12 ' C ' ' A' ' 67' ' ' LEU . 0.1 OUTLIER -60.32 -44.86 95.08 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.247 -0.908 . . . . 0.0 109.593 179.893 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.557 ' N ' ' HG ' ' A' ' 67' ' ' LEU . 4.5 m-85 -95.5 5.12 52.37 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.569 -0.707 . . . . 0.0 110.239 179.985 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 85.19 137.35 4.01 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.641 -1.384 . . . . 0.0 109.641 179.927 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -96.27 -49.13 5.34 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.263 -1.139 . . . . 0.0 110.172 179.998 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 58.7 m -163.25 -85.04 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.199 -0.938 . . . . 0.0 110.12 179.905 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.489 ' N ' ' OD1' ' A' ' 72' ' ' ASP . 38.1 p-10 -96.57 103.15 15.04 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.246 -0.908 . . . . 0.0 110.103 179.874 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.8 HD22 ' C ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.667 0 O-C-N 121.264 -0.897 . . . . 0.0 110.447 -179.859 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.244 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 24.6 ttmt -97.48 6.35 48.29 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.298 -1.119 . . . . 0.0 110.153 -179.955 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.413 ' HA ' HG21 ' A' ' 16' ' ' ILE . 8.7 ttpt -62.37 -48.44 79.78 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.274 -0.891 . . . . 0.0 110.174 -179.935 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.74 -40.22 72.21 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.196 -0.94 . . . . 0.0 109.986 179.915 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.35 -41.43 98.85 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.215 -0.928 . . . . 0.0 109.974 179.855 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 12' ' ' ALA . . . . . 0.637 ' HB2' ' CD1' ' A' ' 16' ' ' ILE . . . -62.86 -42.83 99.9 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.276 -0.89 . . . . 0.0 110.057 179.909 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.665 ' O ' HG23 ' B' ' 17' ' ' VAL . 79.0 t -57.53 -43.06 82.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.261 -0.899 . . . . 0.0 110.057 179.829 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.94 -37.55 85.13 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.338 -0.851 . . . . 0.0 109.97 179.849 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 15' ' ' THR . . . . . 0.402 ' HB ' ' OG ' ' A' ' 13' ' ' SER . 11.8 m -64.61 -44.26 91.13 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.296 -0.878 . . . . 0.0 109.879 179.91 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.702 HG11 HD11 ' A' ' 33' ' ' LEU . 73.5 t -65.71 -45.54 91.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.294 -0.879 . . . . 0.0 110.043 179.935 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.665 HG23 ' O ' ' B' ' 13' ' ' VAL . 59.5 t -58.42 -45.84 89.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.255 -0.903 . . . . 0.0 110.116 179.914 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.36 -43.79 93.45 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.297 -0.877 . . . . 0.0 110.256 179.993 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.44 -45.86 82.18 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.279 -0.888 . . . . 0.0 110.2 -179.95 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.427 HG23 ' O ' ' B' ' 16' ' ' VAL . 54.8 t -60.22 -41.17 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.259 -0.9 . . . . 0.0 110.056 179.826 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.646 ' O ' HG23 ' B' ' 25' ' ' VAL . 13.1 t70 -64.79 -33.01 74.98 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.364 -0.835 . . . . 0.0 110.143 179.994 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.36 -49.98 75.71 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.206 -0.934 . . . . 0.0 110.027 179.881 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.42 -40.42 97.13 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.253 -0.905 . . . . 0.0 109.993 179.805 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 2.4 ttp85 -61.05 -32.6 72.23 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.37 -0.831 . . . . 0.0 110.316 -179.966 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 25' ' ' VAL . . . . . 0.646 HG23 ' O ' ' B' ' 21' ' ' ASP . 70.6 t -71.06 -21.12 21.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.195 -0.941 . . . . 0.0 110.44 -179.734 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.23 44.41 1.32 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.297 -0.877 . . . . 0.0 110.515 -179.666 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 27' ' ' GLU . . . . . 0.519 ' O ' ' N ' ' B' ' 29' ' ' ARG . 3.9 tt0 -111.18 124.23 33.27 Favored Pre-proline 0 N--CA 1.493 1.69 0 O-C-N 121.135 -0.978 . . . . 0.0 110.083 179.766 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 28' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' B' ' 27' ' ' GLU . 21.1 Cg_exo -63.77 69.12 0.19 Allowed 'Trans proline' 0 C--N 1.307 -1.647 0 O-C-N 123.967 1.509 . . . . 0.0 110.326 -179.912 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 29' ' ' ARG . . . . . 0.519 ' N ' ' O ' ' B' ' 27' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.186 -0.946 . . . . 0.0 110.204 179.889 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.432 ' O ' ' HB3' ' A' ' 2' ' ' ALA . 2.7 mtt . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.21 0.529 . . . . 0.0 110.219 . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.463 ' O ' ' O ' ' A' ' 3' ' ' ASP . . . 56.84 -105.63 0.28 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.273 -0.892 . . . . 0.0 110.261 -179.982 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.463 ' O ' ' O ' ' A' ' 2' ' ' ALA . 15.8 t0 59.2 122.02 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.945 -1.097 . . . . 0.0 110.362 179.929 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 9.9 t -143.24 143.46 31.75 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.166 -0.959 . . . . 0.0 110.22 179.946 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.505 ' O ' ' N ' ' A' ' 7' ' ' ALA . 4.5 t0 -169.44 48.36 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.156 -0.965 . . . . 0.0 110.173 -179.955 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.601 HG22 ' CZ ' ' A' ' 68' ' ' TYR . 7.4 m 63.19 -71.57 0.05 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.328 -0.857 . . . . 0.0 110.248 -179.939 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.505 ' N ' ' O ' ' A' ' 5' ' ' ASP . . . -68.41 -36.2 78.75 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.158 -0.964 . . . . 0.0 109.561 179.702 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.593 ' HA ' HD12 ' A' ' 11' ' ' ILE . 0.5 OUTLIER -70.69 -36.49 73.32 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.401 -0.812 . . . . 0.0 109.812 179.474 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.57 -42.62 99.11 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.33 -0.856 . . . . 0.0 110.081 179.9 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.527 HG12 ' CD2' ' A' ' 14' ' ' PHE . 96.0 t -60.61 -46.44 95.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.224 -0.922 . . . . 0.0 109.829 179.643 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.593 HD12 ' HA ' ' A' ' 8' ' ' GLU . 56.8 mt -54.73 -45.78 73.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.328 -0.858 . . . . 0.0 109.393 179.471 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.72 -41.07 81.03 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.22 -0.925 . . . . 0.0 108.635 178.859 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.4 m -68.21 -37.95 81.42 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 178.718 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.577 ' HB3' ' CD1' ' A' ' 60' ' ' TYR . 1.9 m-85 -68.39 -41.95 79.77 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.452 -0.78 . . . . 0.0 109.387 179.033 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -54.15 -46.42 72.27 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.407 -0.808 . . . . 0.0 109.393 179.355 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 53.2 mt -58.13 -43.69 85.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.389 -0.819 . . . . 0.0 109.501 179.336 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.481 HD11 HG22 ' B' ' 13' ' ' VAL . 2.5 mp -65.0 -40.13 94.49 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.397 -0.814 . . . . 0.0 109.748 179.485 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.669 ' HB2' ' HB ' ' A' ' 24' ' ' ILE . . . -77.19 -1.35 29.02 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.374 -0.829 . . . . 0.0 110.246 179.739 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.483 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 0.3 OUTLIER 68.71 63.87 0.32 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.226 -0.922 . . . . 0.0 110.308 179.965 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 51.68 59.02 4.87 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.19 -0.944 . . . . 0.0 110.141 179.937 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 19' ' ' SER . 9.0 mttt -145.46 142.92 18.75 Favored Pre-proline 0 N--CA 1.49 1.525 0 O-C-N 121.248 -0.908 . . . . 0.0 110.071 179.985 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -69.63 -4.84 14.76 Favored 'Trans proline' 0 C--N 1.305 -1.723 0 O-C-N 123.973 1.512 . . . . 0.0 109.907 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.434 ' CD1' ' C ' ' A' ' 23' ' ' TYR . 19.6 p90 -144.77 161.9 38.09 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.349 -0.844 . . . . 0.0 109.884 179.866 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.669 ' HB ' ' HB2' ' A' ' 18' ' ' ALA . 11.3 tt -139.32 153.14 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.137 -0.977 . . . . 0.0 110.311 -179.823 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.2 mp -89.24 156.24 18.89 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.309 -0.87 . . . . 0.0 109.964 179.798 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.38 -42.23 92.92 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.172 -0.955 . . . . 0.0 110.256 -179.825 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -56.45 -40.48 74.87 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.28 -0.887 . . . . 0.0 110.152 179.931 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 1.9 mt-10 -68.32 -41.12 81.31 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.212 -0.93 . . . . 0.0 108.771 179.215 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.702 HD23 HG13 ' A' ' 42' ' ' ILE . 3.3 tp -66.83 -38.84 87.19 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 179.012 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.5 ttm180 -66.96 -34.58 78.08 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.559 -0.713 . . . . 0.0 110.587 -179.923 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.08 -20.26 22.24 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.21 -0.931 . . . . 0.0 111.04 -179.391 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.461 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 86.2 mt-10 -94.87 -19.26 20.44 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.012 -1.055 . . . . 0.0 110.814 -179.447 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.617 HD12 ' CD1' ' A' ' 29' ' ' LEU . 5.7 mt -120.92 162.06 37.03 Favored Pre-proline 0 N--CA 1.489 1.498 0 O-C-N 121.079 -1.013 . . . . 0.0 110.303 -179.857 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.492 ' CD ' HD23 ' A' ' 33' ' ' LEU . 32.5 Cg_exo -67.76 148.43 77.27 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 124.032 1.543 . . . . 0.0 110.246 179.914 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.402 ' C ' ' O ' ' A' ' 34' ' ' PRO . 16.6 Cg_exo -41.78 -40.59 5.73 Favored 'Trans proline' 0 C--N 1.303 -1.864 0 O-C-N 124.116 1.588 . . . . 0.0 110.496 -179.823 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -63.58 -47.25 82.27 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.223 -0.923 . . . . 0.0 110.37 -179.705 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.636 ' HG2' HG22 ' B' ' 17' ' ' VAL . 14.5 mp0 -69.58 -40.85 76.47 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.192 -0.943 . . . . 0.0 110.267 179.957 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.865 ' O ' HD12 ' A' ' 42' ' ' ILE . . . -58.88 -47.84 83.51 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.303 -0.873 . . . . 0.0 110.299 -179.921 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 48.7 tp60 -61.63 -48.83 79.12 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.309 -0.869 . . . . 0.0 110.378 -179.906 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.19 -42.22 89.15 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.235 -0.916 . . . . 0.0 110.228 179.991 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 13.7 m -63.65 -48.24 78.03 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.305 -0.872 . . . . 0.0 110.15 179.885 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.865 HD12 ' O ' ' A' ' 38' ' ' ALA . 1.2 mt -61.23 -21.24 24.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.274 -0.891 . . . . 0.0 110.071 -179.993 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -81.56 -39.79 24.08 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.15 -0.969 . . . . 0.0 110.144 179.794 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.599 ' HB2' ' CD2' ' A' ' 63' ' ' PHE . 40.4 mmt-85 -77.11 -66.09 0.87 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.273 -0.892 . . . . 0.0 109.97 179.805 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.634 ' HE3' ' CB ' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -29.91 114.92 0.31 Allowed Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.9 -0.5 . . . . 0.0 111.471 179.648 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.801 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 18.5 Cg_endo -94.18 -158.65 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.743 0 O-C-N 124.003 1.528 . . . . 0.0 109.932 179.649 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.81 124.63 32.52 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.197 -0.94 . . . . 0.0 110.189 179.863 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -68.48 132.71 47.45 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.34 -0.85 . . . . 0.0 110.224 -179.848 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.489 ' HB3' ' O ' ' A' ' 52' ' ' GLY . 0.6 OUTLIER 59.2 157.88 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.368 -0.833 . . . . 0.0 110.482 179.972 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -84.05 -73.49 1.26 Allowed Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -99.19 27.08 0.16 Allowed 'Trans proline' 0 C--N 1.305 -1.73 0 O-C-N 124.037 1.546 . . . . 0.0 110.199 -179.96 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.686 ' O ' ' CB ' ' A' ' 53' ' ' SER . . . -140.26 147.26 18.96 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -179.993 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.686 ' CB ' ' O ' ' A' ' 52' ' ' GLY . 30.1 t 130.91 -166.56 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.385 0 C-N-CA 124.003 0.921 . . . . 0.0 109.518 179.832 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.478 HG23 ' HB2' ' A' ' 57' ' ' ALA . 13.4 m -135.19 156.07 78.41 Favored Pre-proline 0 N--CA 1.491 1.596 0 O-C-N 121.295 -0.878 . . . . 0.0 110.198 179.87 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -60.46 100.54 0.15 Allowed 'Trans proline' 0 C--N 1.306 -1.705 0 O-C-N 123.94 1.495 . . . . 0.0 110.281 -179.986 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 123.61 8.98 6.06 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.714 -1.354 . . . . 0.0 109.714 179.903 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.756 ' C ' HD22 ' A' ' 58' ' ' LEU . . . -104.64 119.18 38.4 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.204 -1.174 . . . . 0.0 110.143 -179.969 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.789 HD22 ' N ' ' A' ' 58' ' ' LEU . 3.1 mm? -113.66 160.49 18.55 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.361 -0.837 . . . . 0.0 110.021 179.962 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.886 ' OD1' ' HB3' ' A' ' 61' ' ' ALA . 6.9 t70 -109.38 110.23 21.31 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.993 -1.067 . . . . 0.0 111.008 -179.915 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.634 ' CB ' ' HE3' ' A' ' 45' ' ' MET . 26.4 p90 -73.1 -23.61 60.53 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 178.192 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.886 ' HB3' ' OD1' ' A' ' 59' ' ' ASP . . . -56.29 -40.68 74.67 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.702 -0.624 . . . . 0.0 109.71 179.667 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.801 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -56.4 -32.17 64.57 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.241 -0.912 . . . . 0.0 109.619 179.532 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.599 ' CD2' ' HB2' ' A' ' 44' ' ' ARG . 1.7 t80 -65.78 -47.6 74.63 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.6 -0.688 . . . . 0.0 110.559 179.976 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.0 t -55.81 -47.53 77.0 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.168 -0.958 . . . . 0.0 110.759 -179.288 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.32 -39.19 92.13 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.14 -0.975 . . . . 0.0 110.521 -179.721 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.26 -30.53 57.89 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.149 -0.969 . . . . 0.0 110.556 -179.656 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.815 HD13 ' HB2' ' B' ' 23' ' ' ALA . 0.6 OUTLIER -78.59 -45.2 22.24 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.119 -0.988 . . . . 0.0 109.603 -179.955 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.601 ' CZ ' HG22 ' A' ' 6' ' ' THR . 17.1 m-85 -96.37 9.7 40.41 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.535 -0.728 . . . . 0.0 110.316 179.961 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -94.48 -147.65 22.72 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.916 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.403 ' O ' ' O ' ' A' ' 71' ' ' SER . 10.5 pt-20 -129.33 -168.47 1.94 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.26 -1.141 . . . . 0.0 110.155 -179.951 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.403 ' O ' ' O ' ' A' ' 70' ' ' GLU . 0.2 OUTLIER 61.03 149.65 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.239 -0.913 . . . . 0.0 110.264 179.986 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -104.55 125.02 50.31 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.231 -0.918 . . . . 0.0 110.262 179.946 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 51.0 mt . . . . . 0 N--CA 1.492 1.629 0 O-C-N 121.278 -0.889 . . . . 0.0 110.188 -179.931 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' B' B ' 7' ' ' GLY . . . . . 0.5 ' O ' ' N ' ' B' ' 9' ' ' LYS . . . . . . . . 0 N--CA 1.49 2.285 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.468 ' CB ' ' O ' ' B' ' 7' ' ' GLY . 0.7 OUTLIER 66.85 -59.68 0.37 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.208 -1.172 . . . . 0.0 110.161 -179.92 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.728 ' O ' HG23 ' B' ' 13' ' ' VAL . 2.4 ttmt -57.84 -50.04 74.62 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.2 -0.938 . . . . 0.0 109.926 179.863 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.0 -38.36 67.79 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.184 -0.948 . . . . 0.0 109.706 179.66 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -67.79 -41.03 83.82 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.407 -0.808 . . . . 0.0 109.874 179.684 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.53 -37.67 88.36 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.315 -0.865 . . . . 0.0 109.902 179.718 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.728 HG23 ' O ' ' B' ' 9' ' ' LYS . 46.5 t -61.1 -41.51 89.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.266 -0.896 . . . . 0.0 109.998 179.732 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.95 -42.94 99.97 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.264 -0.897 . . . . 0.0 110.022 179.778 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 90.6 m -61.29 -43.2 99.26 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.22 -0.925 . . . . 0.0 110.159 179.88 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.663 ' O ' HG23 ' B' ' 20' ' ' VAL . 98.2 t -64.81 -41.27 91.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.177 -0.952 . . . . 0.0 110.053 179.86 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.664 HG23 ' O ' ' B' ' 13' ' ' VAL . 86.5 t -59.87 -46.31 93.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.295 -0.878 . . . . 0.0 110.271 -179.964 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.17 -39.63 94.41 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.247 -0.908 . . . . 0.0 110.27 -179.948 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.42 -41.49 96.58 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.257 -0.902 . . . . 0.0 110.399 -179.855 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.663 HG23 ' O ' ' B' ' 16' ' ' VAL . 61.4 t -67.01 -41.67 87.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.225 -0.922 . . . . 0.0 110.367 -179.807 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.642 ' O ' HG23 ' B' ' 25' ' ' VAL . 0.4 OUTLIER -60.86 -40.14 91.8 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.269 -0.894 . . . . 0.0 110.303 -179.964 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.21 -49.03 72.99 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.251 -0.905 . . . . 0.0 110.287 -179.977 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.815 ' HB2' HD13 ' A' ' 67' ' ' LEU . . . -63.02 -37.44 87.18 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.277 -0.889 . . . . 0.0 110.233 179.997 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 9.9 ttp180 -68.42 -45.16 73.32 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.271 -0.893 . . . . 0.0 110.05 179.925 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 25' ' ' VAL . . . . . 0.642 HG23 ' O ' ' B' ' 21' ' ' ASP . 20.3 t -73.16 -20.83 18.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.223 -0.923 . . . . 0.0 110.239 179.996 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.4 ' C ' ' O ' ' B' ' 25' ' ' VAL . 1.5 mtt180 43.84 48.05 6.91 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.277 -0.889 . . . . 0.0 110.375 179.662 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 27' ' ' GLU . . . . . 0.494 ' CG ' ' O ' ' B' ' 27' ' ' GLU . 4.9 pt-20 -100.55 121.33 53.42 Favored Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.157 -0.964 . . . . 0.0 110.241 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -65.2 80.28 0.21 Allowed 'Trans proline' 0 C--N 1.305 -1.755 0 O-C-N 123.986 1.519 . . . . 0.0 110.071 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 14.9 mtt85 . . . . . 0 N--CA 1.49 1.574 0 O-C-N 121.159 -0.963 . . . . 0.0 110.232 -179.828 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 ttt . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 121.193 0.52 . . . . 0.0 110.292 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 53.49 -179.51 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.213 -0.929 . . . . 0.0 110.277 179.999 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.637 ' O ' HG22 ' A' ' 4' ' ' THR . 33.4 t70 -68.74 -65.15 0.74 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.245 -0.909 . . . . 0.0 110.066 179.924 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.637 HG22 ' O ' ' A' ' 3' ' ' ASP . 14.7 t 37.97 -152.83 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.627 -0.671 . . . . 0.0 110.602 179.886 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.401 ' N ' HG23 ' A' ' 4' ' ' THR . 4.3 m-20 -97.96 112.22 24.24 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.241 -0.912 . . . . 0.0 110.294 -179.981 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -87.62 -39.69 14.84 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.182 -0.949 . . . . 0.0 110.134 179.878 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -66.16 -46.82 76.09 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.262 -0.899 . . . . 0.0 109.725 179.826 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.571 ' HA ' HD12 ' A' ' 11' ' ' ILE . 23.4 tt0 -54.52 -36.78 64.6 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.358 -0.839 . . . . 0.0 109.82 179.633 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -62.02 -48.39 80.49 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.29 -0.881 . . . . 0.0 109.91 179.92 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.531 HG12 ' HD2' ' A' ' 14' ' ' PHE . 77.7 t -58.92 -43.25 88.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.251 -0.906 . . . . 0.0 109.773 179.657 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.571 HD12 ' HA ' ' A' ' 8' ' ' GLU . 45.0 mt -62.0 -47.07 94.92 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.305 -0.872 . . . . 0.0 109.545 179.433 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.56 -42.13 82.41 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.324 -0.86 . . . . 0.0 108.944 179.175 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.473 ' O ' HD13 ' A' ' 17' ' ' LEU . 0.8 OUTLIER -68.43 -40.39 81.19 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.416 -0.802 . . . . 0.0 109.277 179.004 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.558 ' HB3' ' CD1' ' A' ' 60' ' ' TYR . 1.7 m-85 -65.26 -42.94 92.73 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.242 -0.911 . . . . 0.0 109.587 179.396 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 35.8 ttm-85 -55.96 -47.08 78.27 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.302 -0.873 . . . . 0.0 109.579 179.388 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.1 mt -60.73 -41.14 87.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.398 -0.814 . . . . 0.0 109.649 179.403 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.531 HD23 ' OE2' ' A' ' 32' ' ' GLU . 5.5 mp -64.86 -40.5 95.24 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.419 -0.8 . . . . 0.0 109.781 179.602 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.585 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -73.65 -4.89 37.04 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.405 -0.809 . . . . 0.0 110.103 179.842 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.458 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.1 OUTLIER 67.46 59.42 0.5 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.298 -0.876 . . . . 0.0 110.158 -179.948 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.423 ' CB ' ' O ' ' A' ' 19' ' ' SER . 0.2 OUTLIER 63.96 64.66 0.74 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.276 -0.89 . . . . 0.0 110.295 179.939 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.585 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 73.4 mttt -153.02 143.6 15.67 Favored Pre-proline 0 N--CA 1.489 1.491 0 O-C-N 121.212 -0.93 . . . . 0.0 110.093 -179.979 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -75.69 2.0 7.44 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 O-C-N 123.957 1.504 . . . . 0.0 110.011 179.539 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.549 ' CD1' ' N ' ' A' ' 23' ' ' TYR . 14.7 p90 -142.48 169.7 17.09 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.326 -0.858 . . . . 0.0 109.952 179.949 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.823 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -137.27 141.63 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.104 -0.998 . . . . 0.0 110.165 -179.897 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.823 ' N ' HD13 ' A' ' 24' ' ' ILE . 1.4 mp -81.54 153.6 26.69 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.21 -0.931 . . . . 0.0 110.127 -179.925 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.478 ' O ' ' HG ' ' A' ' 29' ' ' LEU . . . -68.27 -38.53 81.82 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.366 -0.834 . . . . 0.0 110.403 -179.775 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -69.25 -34.2 74.43 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.252 -0.905 . . . . 0.0 109.937 179.852 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.498 ' OE2' ' HA ' ' A' ' 18' ' ' ALA . 14.5 tt0 -65.5 -50.97 63.29 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.23 -0.919 . . . . 0.0 109.951 -179.98 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.733 HD12 ' C ' ' A' ' 29' ' ' LEU . 1.2 pp -67.3 -33.74 75.91 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.187 -0.945 . . . . 0.0 109.716 179.378 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.636 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 10.3 mtt-85 -63.73 -34.1 77.13 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.427 -0.796 . . . . 0.0 110.381 179.974 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.14 -16.33 29.78 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.205 -0.934 . . . . 0.0 111.255 -179.174 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.562 ' CG ' ' HA ' ' A' ' 29' ' ' LEU . 0.8 OUTLIER -99.51 -23.77 14.99 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.807 -1.183 . . . . 0.0 110.726 -179.667 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.652 HD22 ' HB3' ' A' ' 37' ' ' GLN . 4.3 mt -108.89 139.86 21.31 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.229 -0.919 . . . . 0.0 110.44 -179.994 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.492 ' HD2' HD23 ' A' ' 33' ' ' LEU . 37.5 Cg_exo -44.36 139.47 6.61 Favored 'Trans proline' 0 C--N 1.306 -1.693 0 O-C-N 123.962 1.506 . . . . 0.0 109.87 179.676 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.438 ' C ' ' O ' ' A' ' 34' ' ' PRO . 24.9 Cg_exo -39.92 -39.01 2.13 Favored 'Trans proline' 0 C--N 1.306 -1.693 0 O-C-N 124.027 1.541 . . . . 0.0 110.574 -179.563 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.16 -45.98 79.03 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.244 -0.91 . . . . 0.0 110.805 -179.891 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.652 ' HB3' HD22 ' A' ' 33' ' ' LEU . 98.3 mm-40 -69.64 -44.34 70.8 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.032 -1.043 . . . . 0.0 110.413 -179.664 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.636 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -58.16 -49.24 77.71 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.315 -0.866 . . . . 0.0 110.56 -179.553 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -58.97 -40.85 86.0 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.152 -0.967 . . . . 0.0 110.412 -179.887 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.29 -47.97 71.91 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.254 -0.904 . . . . 0.0 110.356 -179.88 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.573 ' HA ' ' CE1' ' A' ' 63' ' ' PHE . 48.1 m -63.02 -48.33 79.23 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.236 -0.915 . . . . 0.0 110.371 -179.863 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.644 ' CD1' HD21 ' A' ' 29' ' ' LEU . 12.4 mm -47.1 -19.3 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.303 -0.873 . . . . 0.0 111.225 -179.854 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.28 -24.12 30.04 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.969 -1.082 . . . . 0.0 111.527 -179.072 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.664 ' NH1' HD21 ' A' ' 67' ' ' LEU . 36.7 mtt180 -95.79 -69.91 0.73 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 120.862 -1.149 . . . . 0.0 110.862 -179.419 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.567 ' C ' ' O ' ' A' ' 44' ' ' ARG . 2.1 mtp -14.99 84.13 0.03 OUTLIER Pre-proline 0 N--CA 1.507 2.399 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -179.477 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.743 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 35.4 Cg_exo -57.22 168.29 2.82 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 O-C-N 124.053 1.554 . . . . 0.0 110.28 -179.923 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.436 ' O ' ' C ' ' A' ' 48' ' ' TYR . . . -56.79 120.47 7.92 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.197 -0.939 . . . . 0.0 110.113 179.974 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.548 ' CG ' ' N ' ' A' ' 49' ' ' SER . 16.9 p90 -41.67 -40.16 1.87 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.367 -0.833 . . . . 0.0 110.452 -179.931 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.548 ' N ' ' CG ' ' A' ' 48' ' ' TYR . 0.3 OUTLIER 170.94 -170.15 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.221 -0.924 . . . . 0.0 110.111 -179.907 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -106.97 -54.4 0.67 Allowed Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.347 -1.501 . . . . 0.0 109.347 179.891 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -114.19 45.87 0.01 OUTLIER 'Trans proline' 0 C--N 1.307 -1.652 0 O-C-N 123.934 1.491 . . . . 0.0 110.301 179.768 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.49 ' O ' ' O ' ' A' ' 53' ' ' SER . . . -120.7 -108.37 2.14 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -179.857 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.518 ' HB3' ' CD2' ' A' ' 48' ' ' TYR . 0.7 OUTLIER -55.99 -153.33 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.314 0 O-C-N 121.388 -1.066 . . . . 0.0 110.805 -179.577 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 18.9 m -106.06 150.36 39.21 Favored Pre-proline 0 N--CA 1.49 1.526 0 O-C-N 121.196 -0.94 . . . . 0.0 110.182 179.917 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -49.86 112.03 0.63 Allowed 'Trans proline' 0 C--N 1.305 -1.755 0 O-C-N 124.037 1.546 . . . . 0.0 110.325 -179.991 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 129.44 -26.75 4.31 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 179.895 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.73 144.58 56.25 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.2 -1.176 . . . . 0.0 110.274 -179.996 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 79.1 mt -121.06 157.44 30.04 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.195 -0.941 . . . . 0.0 109.962 179.813 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.45 ' CG ' ' HA ' ' A' ' 48' ' ' TYR . 1.2 m-20 -104.54 112.07 25.0 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.209 -0.932 . . . . 0.0 110.527 -179.911 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.558 ' CD1' ' HB3' ' A' ' 14' ' ' PHE . 23.2 p90 -81.19 -19.43 43.33 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.298 -0.876 . . . . 0.0 109.353 179.483 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.427 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.86 -40.83 73.46 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.326 -0.859 . . . . 0.0 109.264 179.575 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.743 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -58.36 -32.31 68.45 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.328 -0.858 . . . . 0.0 108.981 179.083 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.887 ' O ' HD12 ' A' ' 67' ' ' LEU . 6.1 t80 -58.65 -45.45 89.3 Favored 'General case' 0 C--N 1.3 -1.558 0 CA-C-O 121.278 0.561 . . . . 0.0 110.219 179.607 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 81.2 p -72.44 -45.02 61.5 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.191 -0.943 . . . . 0.0 110.554 -179.78 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 47.2 t -68.42 -41.04 80.97 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.255 -0.903 . . . . 0.0 110.576 -179.642 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.25 -35.44 71.42 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.209 -0.932 . . . . 0.0 110.594 -179.683 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.887 HD12 ' O ' ' A' ' 63' ' ' PHE . 11.2 mt -74.94 -41.14 60.21 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.172 -0.955 . . . . 0.0 110.556 -179.705 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -97.39 7.39 46.63 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.154 -0.966 . . . . 0.0 110.307 -179.783 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -74.19 -23.88 74.83 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 179.905 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -59.66 -33.34 71.41 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.303 -1.116 . . . . 0.0 110.227 -179.994 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.4 m -108.86 125.92 52.51 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.217 -0.927 . . . . 0.0 110.108 179.978 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -80.62 125.02 29.48 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.255 -0.903 . . . . 0.0 110.162 -179.982 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.622 0 O-C-N 121.306 -0.871 . . . . 0.0 110.144 179.973 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 7' ' ' GLY . . . . . 0.522 ' O ' ' N ' ' B' ' 9' ' ' LYS . . . . . . . . 0 N--CA 1.49 2.291 0 N-CA-C 109.589 -1.405 . . . . 0.0 109.589 . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.05 -74.39 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.267 -1.137 . . . . 0.0 110.279 179.938 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.522 ' N ' ' O ' ' B' ' 7' ' ' GLY . 0.0 OUTLIER -60.36 -44.05 95.95 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.302 -0.873 . . . . 0.0 110.241 -179.997 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.16 -35.95 74.42 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.195 -0.94 . . . . 0.0 110.067 179.993 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -65.42 -40.62 93.56 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.268 -0.895 . . . . 0.0 109.91 179.855 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 12' ' ' ALA . . . . . 0.418 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -64.17 -44.32 92.42 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.292 -0.88 . . . . 0.0 110.234 179.96 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.609 ' O ' HG23 ' B' ' 17' ' ' VAL . 47.5 t -62.25 -46.25 96.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.229 -0.919 . . . . 0.0 110.042 -179.914 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.49 -35.42 72.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.281 -0.887 . . . . 0.0 110.038 179.905 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 8.8 m -66.2 -42.87 88.22 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.267 -0.895 . . . . 0.0 109.97 179.737 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.761 ' O ' HG23 ' B' ' 20' ' ' VAL . 53.3 t -67.16 -43.3 88.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.21 -0.931 . . . . 0.0 110.103 179.907 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.609 HG23 ' O ' ' B' ' 13' ' ' VAL . 59.2 t -61.4 -44.92 99.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.354 -0.841 . . . . 0.0 110.315 -179.905 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.14 -43.54 94.92 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.222 -0.924 . . . . 0.0 110.213 179.865 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.37 -40.59 96.14 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.28 -0.887 . . . . 0.0 110.213 -179.898 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.761 HG23 ' O ' ' B' ' 16' ' ' VAL . 65.6 t -67.49 -42.52 87.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.153 -0.967 . . . . 0.0 110.101 179.993 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.529 ' O ' HG23 ' B' ' 25' ' ' VAL . 4.3 t0 -63.17 -40.13 96.65 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.274 -0.891 . . . . 0.0 110.132 179.919 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -54.21 -49.96 68.2 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.288 -0.883 . . . . 0.0 109.846 179.908 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.479 ' HB2' HD22 ' A' ' 67' ' ' LEU . . . -58.27 -42.41 86.47 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.192 -0.942 . . . . 0.0 109.795 179.632 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 5.0 ttp180 -60.54 -47.81 84.53 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.303 -0.873 . . . . 0.0 109.99 179.837 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 25' ' ' VAL . . . . . 0.529 HG23 ' O ' ' B' ' 21' ' ' ASP . 57.7 t -57.52 -20.91 14.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.248 -0.907 . . . . 0.0 110.022 179.822 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 55.99 38.06 29.54 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.524 -0.735 . . . . 0.0 110.332 179.944 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 27' ' ' GLU . . . . . 0.461 ' HA ' ' HD3' ' B' ' 28' ' ' PRO . 0.5 OUTLIER -92.19 136.64 25.55 Favored Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.287 -0.883 . . . . 0.0 110.279 -179.969 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 28' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' B' ' 27' ' ' GLU . 23.8 Cg_exo -87.49 63.63 3.92 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 O-C-N 124.039 1.547 . . . . 0.0 110.702 -179.874 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.708 0 O-C-N 121.08 -1.012 . . . . 0.0 110.239 179.722 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 mpt? . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.347 0.594 . . . . 0.0 110.264 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -83.33 -43.0 16.45 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.201 -0.937 . . . . 0.0 110.243 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -164.35 119.92 1.52 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.349 -0.845 . . . . 0.0 110.119 179.9 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.1 p -105.56 150.12 25.65 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.238 -0.914 . . . . 0.0 110.375 -179.953 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.0 p30 -166.98 172.66 10.0 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.264 -0.897 . . . . 0.0 110.093 -179.989 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.1 m -111.32 -32.05 6.86 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.197 -0.939 . . . . 0.0 110.271 -179.936 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.582 ' HA ' ' CZ ' ' A' ' 68' ' ' TYR . . . -65.22 -46.55 80.17 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.193 -0.942 . . . . 0.0 109.948 179.925 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.78 -36.54 69.98 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.28 -0.888 . . . . 0.0 109.831 179.485 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.57 -43.36 99.01 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.341 -0.849 . . . . 0.0 110.181 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.868 HG21 ' OH ' ' A' ' 68' ' ' TYR . 65.6 t -59.07 -44.87 92.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.09 -1.006 . . . . 0.0 109.777 179.732 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 44.4 mt -57.1 -49.72 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.404 -0.81 . . . . 0.0 109.465 179.574 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.78 -39.24 84.23 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.309 -0.869 . . . . 0.0 108.829 178.901 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.504 ' HB3' HG23 ' B' ' 16' ' ' VAL . 70.8 m -65.41 -40.54 93.52 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.465 -0.772 . . . . 0.0 109.099 178.898 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -66.82 -43.88 82.65 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.343 -0.848 . . . . 0.0 109.366 179.102 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -53.35 -41.21 65.58 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.353 -0.842 . . . . 0.0 109.153 179.049 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.526 HD12 ' HB2' ' B' ' 12' ' ' ALA . 49.3 mt -59.18 -45.09 93.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.426 -0.796 . . . . 0.0 109.687 179.326 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 13' ' ' SER . 15.4 mt -65.09 -41.83 94.63 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.185 -0.947 . . . . 0.0 109.41 179.386 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.5 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -71.12 -7.27 45.44 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.527 -0.733 . . . . 0.0 110.123 179.826 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.486 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 1.5 t 68.38 64.3 0.34 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.24 -0.912 . . . . 0.0 110.199 -179.971 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 58.2 66.35 1.12 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.257 -0.902 . . . . 0.0 110.312 179.969 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.5 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 64.5 mttt -153.15 143.22 15.31 Favored Pre-proline 0 N--CA 1.49 1.537 0 O-C-N 121.248 -0.908 . . . . 0.0 110.023 179.992 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -75.28 2.17 7.06 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 O-C-N 123.983 1.517 . . . . 0.0 110.156 179.703 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.431 ' CZ ' ' HD3' ' A' ' 21' ' ' LYS . 23.7 p90 -141.66 160.65 39.72 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.202 -0.936 . . . . 0.0 110.075 179.951 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.855 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -130.31 140.79 47.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.228 -0.92 . . . . 0.0 109.937 179.916 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.855 ' N ' HD13 ' A' ' 24' ' ' ILE . 1.1 mt -81.85 148.32 28.89 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.223 -0.923 . . . . 0.0 110.45 -179.733 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.77 -44.84 95.14 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.373 -0.829 . . . . 0.0 109.953 179.818 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -56.52 -36.28 69.02 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.276 -0.89 . . . . 0.0 109.869 179.744 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.517 ' O ' ' N ' ' A' ' 32' ' ' GLU . 0.6 OUTLIER -62.73 -42.22 99.56 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.416 -0.803 . . . . 0.0 109.681 179.742 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.743 HD13 ' HB3' ' A' ' 41' ' ' CYS . 17.5 mt -58.32 -34.2 70.33 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.272 -0.892 . . . . 0.0 109.532 179.634 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 9.6 mtm-85 -66.92 -38.68 86.65 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.343 -0.848 . . . . 0.0 109.828 179.597 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.76 -12.16 24.06 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.297 -0.877 . . . . 0.0 110.665 -179.754 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.517 ' N ' ' O ' ' A' ' 28' ' ' GLU . 11.3 mm-40 -96.76 -23.55 16.36 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.095 -1.003 . . . . 0.0 110.451 -179.819 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.598 ' CD2' HG22 ' B' ' 17' ' ' VAL . 1.4 mt -136.75 157.03 75.72 Favored Pre-proline 0 C--N 1.306 -1.317 0 O-C-N 121.166 -0.959 . . . . 0.0 110.102 -179.769 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.548 ' HD2' HD23 ' A' ' 33' ' ' LEU . 32.7 Cg_exo -46.25 171.21 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.735 0 O-C-N 123.861 1.453 . . . . 0.0 110.075 179.777 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_endo -64.77 -41.92 16.96 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 O-C-N 123.921 1.485 . . . . 0.0 110.305 -179.89 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.95 -40.89 91.73 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.34 -0.85 . . . . 0.0 110.548 -179.795 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.51 ' HG2' HG22 ' B' ' 17' ' ' VAL . 12.9 mp0 -69.33 -37.94 77.95 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.142 -0.974 . . . . 0.0 110.394 -179.739 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.79 -45.96 90.69 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.264 -0.898 . . . . 0.0 110.33 -179.94 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.463 ' O ' ' HB2' ' A' ' 43' ' ' LYS . 14.1 tt0 -66.1 -43.76 86.32 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.142 -0.974 . . . . 0.0 110.51 -179.873 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.8 -42.2 95.2 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.26 -0.9 . . . . 0.0 110.401 -179.766 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.743 ' HB3' HD13 ' A' ' 29' ' ' LEU . 31.1 m -63.09 -46.89 85.28 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.298 -0.876 . . . . 0.0 110.578 -179.666 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.644 ' CG1' HD12 ' A' ' 29' ' ' LEU . 74.5 mt -72.98 -13.72 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.126 -0.984 . . . . 0.0 110.519 -179.644 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 39' ' ' GLN . 0.1 OUTLIER -76.29 -21.19 56.56 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.163 -0.961 . . . . 0.0 110.461 -179.707 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.606 ' HB3' ' CG ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -113.0 -48.99 2.95 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.123 -0.986 . . . . 0.0 110.344 -180.0 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.523 ' HE1' ' CB ' ' A' ' 60' ' ' TYR . 2.0 ttm -34.62 96.77 0.11 Allowed Pre-proline 0 N--CA 1.494 1.764 0 O-C-N 121.695 -0.628 . . . . 0.0 111.071 -179.975 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.471 ' HD2' ' O ' ' A' ' 59' ' ' ASP . 27.1 Cg_exo -59.08 -153.79 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.716 0 O-C-N 123.995 1.524 . . . . 0.0 110.026 179.765 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.43 ' O ' ' C ' ' A' ' 48' ' ' TYR . . . -98.32 127.43 44.26 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.27 -0.894 . . . . 0.0 110.371 -179.972 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.657 ' CD2' ' CB ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -42.07 145.82 0.33 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.268 -0.895 . . . . 0.0 110.149 179.879 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 94.3 p -115.52 9.02 15.32 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.154 -0.967 . . . . 0.0 110.43 -179.75 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -99.41 139.31 14.37 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 179.939 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -79.09 154.76 25.6 Favored 'Trans proline' 0 C--N 1.306 -1.681 0 O-C-N 123.899 1.473 . . . . 0.0 110.222 179.904 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.488 ' O ' ' O ' ' A' ' 53' ' ' SER . . . 98.34 -28.67 13.73 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.441 -1.464 . . . . 0.0 109.441 -179.787 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.657 ' CB ' ' CD2' ' A' ' 48' ' ' TYR . 0.3 OUTLIER -55.02 -157.11 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.266 0 O-C-N 121.492 -1.005 . . . . 0.0 110.902 -179.756 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.489 ' CG2' ' HB2' ' A' ' 57' ' ' ALA . 10.8 m -117.37 179.93 0.74 Allowed Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.285 -0.884 . . . . 0.0 110.02 179.649 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -82.56 11.26 3.26 Favored 'Trans proline' 0 C--N 1.305 -1.713 0 O-C-N 123.989 1.52 . . . . 0.0 110.261 179.749 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -142.85 40.84 1.22 Allowed Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 179.897 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.649 ' C ' HD22 ' A' ' 58' ' ' LEU . . . -111.09 133.86 53.14 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.328 -1.101 . . . . 0.0 110.217 -179.931 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.813 HD22 ' N ' ' A' ' 58' ' ' LEU . 2.3 mm? -116.2 160.19 20.75 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.305 -0.872 . . . . 0.0 109.936 179.996 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.486 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.6 OUTLIER -106.8 110.41 22.58 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.041 -1.037 . . . . 0.0 110.445 -179.98 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.624 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 17.2 p90 -75.91 -26.31 56.86 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.259 -0.9 . . . . 0.0 109.966 179.601 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.624 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.15 -39.59 72.54 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.327 -0.858 . . . . 0.0 110.023 -179.806 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.463 ' CB ' ' HG2' ' A' ' 46' ' ' PRO . . . -65.56 -39.55 91.81 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.177 -0.952 . . . . 0.0 109.831 179.667 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.606 ' CG ' ' HB3' ' A' ' 44' ' ' ARG . 2.0 t80 -71.9 -35.05 69.59 Favored 'General case' 0 C--N 1.298 -1.647 0 O-C-N 121.572 -0.705 . . . . 0.0 110.137 179.68 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.579 ' O ' ' CD2' ' A' ' 68' ' ' TYR . 17.4 m -56.19 -49.9 72.73 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.343 -0.848 . . . . 0.0 110.554 -179.692 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.5 p -55.65 -44.42 77.16 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.211 -0.931 . . . . 0.0 110.461 -179.754 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.16 -39.08 74.54 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.149 -0.97 . . . . 0.0 110.481 -179.802 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.513 ' CD2' ' HB2' ' B' ' 23' ' ' ALA . 18.3 mt -60.25 -38.52 83.72 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.188 -0.945 . . . . 0.0 110.292 -179.894 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.868 ' OH ' HG21 ' A' ' 10' ' ' VAL . 10.3 m-85 -86.48 -22.44 26.44 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.315 -0.866 . . . . 0.0 110.215 -179.641 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 108.02 -43.5 1.69 Allowed Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.964 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -171.95 95.63 0.16 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.264 -1.139 . . . . 0.0 110.28 -179.995 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.71 -67.92 0.37 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.286 -0.884 . . . . 0.0 110.137 179.993 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -70.6 103.54 2.55 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.248 -0.908 . . . . 0.0 110.134 179.941 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.641 0 O-C-N 121.298 -0.876 . . . . 0.0 110.191 -179.91 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.258 0 N-CA-C 109.541 -1.424 . . . . 0.0 109.541 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 11.4 ptpt -173.36 33.35 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.255 -1.144 . . . . 0.0 110.192 179.993 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 15.8 ttmt -58.55 -41.87 86.6 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.221 -0.925 . . . . 0.0 110.161 -179.969 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.16 -35.74 77.94 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.235 -0.916 . . . . 0.0 110.011 179.927 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.86 -42.62 94.72 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.343 -0.848 . . . . 0.0 110.128 179.998 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 12' ' ' ALA . . . . . 0.526 ' HB2' HD12 ' A' ' 16' ' ' ILE . . . -63.17 -35.78 81.44 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.141 -0.974 . . . . 0.0 110.018 179.83 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.633 ' O ' HG23 ' B' ' 17' ' ' VAL . 72.8 t -61.61 -42.34 93.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.28 -0.887 . . . . 0.0 110.075 179.892 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.51 -44.26 93.16 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.309 -0.87 . . . . 0.0 110.234 179.955 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 37.0 m -64.57 -49.12 72.43 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.301 -0.875 . . . . 0.0 110.33 -180.0 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.571 HG11 HD11 ' A' ' 33' ' ' LEU . 86.2 t -60.99 -43.98 97.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.183 -0.948 . . . . 0.0 110.298 -179.966 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.633 HG23 ' O ' ' B' ' 13' ' ' VAL . 90.2 t -63.18 -47.17 93.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.327 -0.858 . . . . 0.0 110.2 -179.886 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.54 -43.25 75.65 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.25 -0.906 . . . . 0.0 110.165 -179.975 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.5 -44.09 83.53 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.309 -0.869 . . . . 0.0 110.161 179.989 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.41 HG23 ' O ' ' B' ' 16' ' ' VAL . 75.1 t -66.07 -44.96 91.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.226 -0.921 . . . . 0.0 110.192 179.956 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.746 ' O ' HG23 ' B' ' 25' ' ' VAL . 5.4 t0 -57.16 -34.81 68.81 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.276 -0.89 . . . . 0.0 110.24 -179.96 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.9 tm0? -61.18 -49.83 75.62 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.2 -0.938 . . . . 0.0 110.162 -179.914 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.513 ' HB2' ' CD2' ' A' ' 67' ' ' LEU . . . -60.81 -35.4 76.4 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.291 -0.881 . . . . 0.0 110.353 -179.922 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 21.5 ttp85 -70.59 -32.22 69.5 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.15 -0.968 . . . . 0.0 110.487 179.979 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 25' ' ' VAL . . . . . 0.746 HG23 ' O ' ' B' ' 21' ' ' ASP . 63.8 t -54.89 -24.01 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.175 -0.953 . . . . 0.0 110.536 -179.589 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.503 ' HG2' ' O ' ' B' ' 23' ' ' ALA . 9.1 ptm180 -102.67 19.54 18.93 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.341 -0.85 . . . . 0.0 110.037 179.913 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -106.98 145.16 30.54 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.268 -0.895 . . . . 0.0 110.027 179.89 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -86.89 92.66 0.53 Allowed 'Trans proline' 0 C--N 1.305 -1.735 0 O-C-N 123.906 1.477 . . . . 0.0 110.274 179.921 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.567 0 O-C-N 121.255 -0.903 . . . . 0.0 110.207 -179.94 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 121.215 0.531 . . . . 0.0 110.264 . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -165.12 -149.83 0.12 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.22 -0.925 . . . . 0.0 110.109 179.995 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.416 ' O ' ' OG1' ' A' ' 4' ' ' THR . 2.0 p-10 -165.03 124.9 1.87 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.227 -0.921 . . . . 0.0 110.229 179.944 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.416 ' OG1' ' O ' ' A' ' 3' ' ' ASP . 40.7 p 43.48 74.0 0.13 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.226 -0.921 . . . . 0.0 110.05 -179.997 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.509 ' O ' ' N ' ' A' ' 7' ' ' ALA . 1.5 m-20 -123.91 -72.42 0.68 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.245 -0.909 . . . . 0.0 110.278 -179.967 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.928 HG22 ' CE2' ' A' ' 68' ' ' TYR . 3.3 m 66.02 -63.36 0.23 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.283 -0.885 . . . . 0.0 110.196 -179.958 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.509 ' N ' ' O ' ' A' ' 5' ' ' ASP . . . -66.94 -45.53 77.53 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.22 -0.925 . . . . 0.0 109.823 179.774 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.524 ' HA ' HD12 ' A' ' 11' ' ' ILE . 1.9 tt0 -57.02 -36.65 70.69 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.32 -0.863 . . . . 0.0 109.883 179.694 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -61.38 -47.37 86.15 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.333 -0.854 . . . . 0.0 110.185 -179.853 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 41.6 t -58.26 -41.3 80.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.164 -0.96 . . . . 0.0 109.871 179.755 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.676 HG23 ' HE1' ' A' ' 60' ' ' TYR . 29.8 mt -63.33 -47.92 89.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.354 -0.841 . . . . 0.0 109.487 179.547 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.43 -39.01 75.32 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.334 -0.853 . . . . 0.0 108.722 179.018 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.57 ' HB3' HG23 ' B' ' 16' ' ' VAL . 10.6 m -66.91 -40.34 87.65 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 178.71 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.571 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 6.6 m-85 -68.28 -41.23 81.33 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.464 -0.772 . . . . 0.0 109.525 179.219 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -53.1 -44.26 67.49 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.348 -0.845 . . . . 0.0 109.456 179.363 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.608 HD13 ' HB2' ' B' ' 12' ' ' ALA . 48.3 mt -59.74 -43.6 91.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.479 -0.763 . . . . 0.0 109.882 179.467 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 13' ' ' SER . 48.3 mt -65.12 -41.75 94.57 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.289 -0.882 . . . . 0.0 109.949 179.792 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.601 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -83.75 13.97 4.32 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.456 -0.778 . . . . 0.0 110.337 -179.879 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 57.73 70.58 0.64 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.245 -0.91 . . . . 0.0 110.465 179.932 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.8 t70 44.99 54.96 6.51 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.332 -0.855 . . . . 0.0 110.514 179.777 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.552 ' HD2' ' CZ ' ' A' ' 23' ' ' TYR . 7.1 mttm -133.55 141.83 41.71 Favored Pre-proline 0 N--CA 1.491 1.575 0 O-C-N 121.143 -0.973 . . . . 0.0 109.901 179.89 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -68.13 -4.4 12.55 Favored 'Trans proline' 0 C--N 1.305 -1.729 0 O-C-N 124.02 1.537 . . . . 0.0 110.388 179.973 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.587 ' HB3' ' CE1' ' A' ' 48' ' ' TYR . 51.8 p90 -139.18 157.41 45.98 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.213 -0.93 . . . . 0.0 110.306 -179.913 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.794 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -132.91 138.25 52.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.286 -0.884 . . . . 0.0 109.467 179.581 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.794 ' N ' HD13 ' A' ' 24' ' ' ILE . 1.0 OUTLIER -82.15 139.48 34.32 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.13 -0.981 . . . . 0.0 110.369 -179.48 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.451 ' O ' HD11 ' A' ' 42' ' ' ILE . . . -54.99 -35.22 64.11 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.39 -0.819 . . . . 0.0 110.175 179.945 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 87.6 mt-10 -61.12 -38.56 86.77 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.224 -0.922 . . . . 0.0 109.991 179.9 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.554 ' HB3' HD11 ' A' ' 24' ' ' ILE . 8.4 mt-10 -65.87 -40.48 91.69 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.329 -0.857 . . . . 0.0 109.565 179.627 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.517 HD12 HG12 ' A' ' 42' ' ' ILE . 63.6 mt -59.24 -34.03 71.72 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.433 -0.792 . . . . 0.0 109.476 179.446 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 27.8 mtp180 -68.48 -34.56 76.14 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.388 -0.82 . . . . 0.0 110.047 179.754 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.22 -31.48 13.47 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.3 -0.875 . . . . 0.0 110.499 -179.665 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -83.48 -23.36 32.23 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.074 -1.017 . . . . 0.0 110.431 -179.773 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.914 HD23 ' HD2' ' A' ' 34' ' ' PRO . 1.5 mt -129.85 147.84 67.1 Favored Pre-proline 0 N--CA 1.488 1.461 0 O-C-N 121.082 -1.011 . . . . 0.0 110.329 -179.749 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.914 ' HD2' HD23 ' A' ' 33' ' ' LEU . 1.0 OUTLIER -46.45 167.11 0.07 OUTLIER 'Trans proline' 0 C--N 1.305 -1.76 0 O-C-N 124.021 1.537 . . . . 0.0 110.095 179.665 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -62.44 -36.02 68.57 Favored 'Trans proline' 0 C--N 1.304 -1.794 0 O-C-N 124.03 1.542 . . . . 0.0 110.484 -179.768 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.521 ' OD1' ' N ' ' A' ' 37' ' ' GLN . 1.7 p30 -65.61 -46.4 79.46 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.25 -0.906 . . . . 0.0 110.462 -179.78 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.908 ' NE2' HG13 ' B' ' 17' ' ' VAL . 0.3 OUTLIER -69.45 -40.17 77.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.121 -0.987 . . . . 0.0 110.153 -179.962 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.418 ' O ' HG13 ' A' ' 42' ' ' ILE . . . -58.64 -48.14 82.02 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.289 -0.882 . . . . 0.0 110.185 179.917 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 66.7 tp60 -62.91 -47.52 82.9 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.266 -0.896 . . . . 0.0 110.14 179.888 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -66.21 -46.56 76.84 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.339 -0.851 . . . . 0.0 110.045 179.962 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 89.6 m -64.92 -45.97 83.61 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.356 -0.84 . . . . 0.0 110.332 -179.998 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.517 HG12 HD12 ' A' ' 29' ' ' LEU . 66.2 mt -68.73 -12.46 15.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.245 -0.909 . . . . 0.0 110.424 -179.853 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 19.7 tttm -83.12 -40.23 20.05 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.209 -0.932 . . . . 0.0 110.487 -179.783 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.511 ' O ' ' C ' ' A' ' 45' ' ' MET . 3.2 mtp85 -85.27 -61.61 1.73 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.204 -0.935 . . . . 0.0 110.55 -179.656 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.689 ' HE1' ' HB3' ' A' ' 60' ' ' TYR . 5.8 ttm -28.0 103.32 0.16 Allowed Pre-proline 0 N--CA 1.497 1.919 0 O-C-N 121.84 -0.537 . . . . 0.0 111.598 -179.886 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.545 ' O ' HD12 ' A' ' 58' ' ' LEU . 11.4 Cg_endo -57.03 -160.58 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.713 0 O-C-N 124.058 1.557 . . . . 0.0 110.028 179.691 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.458 ' O ' ' O ' ' A' ' 48' ' ' TYR . . . -98.35 49.52 0.99 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.13 -0.981 . . . . 0.0 110.371 -179.924 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.587 ' CE1' ' HB3' ' A' ' 23' ' ' TYR . 24.9 t80 49.63 177.58 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.25 -0.906 . . . . 0.0 110.369 179.86 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -128.76 178.46 6.34 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.185 -0.947 . . . . 0.0 110.141 -179.974 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 112.05 -170.05 13.42 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 -179.952 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -72.93 -86.5 0.0 OUTLIER 'Trans proline' 0 C--N 1.307 -1.648 0 O-C-N 123.968 1.51 . . . . 0.0 110.261 179.937 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.488 ' O ' ' O ' ' A' ' 53' ' ' SER . . . -125.85 82.69 0.35 Allowed Glycine 0 N--CA 1.49 2.261 0 N-CA-C 109.519 -1.433 . . . . 0.0 109.519 -179.945 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.488 ' O ' ' O ' ' A' ' 52' ' ' GLY . 0.9 OUTLIER -55.61 -156.86 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.29 0 O-C-N 121.361 -1.082 . . . . 0.0 110.702 -179.596 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 1.088 HG22 ' HB2' ' A' ' 57' ' ' ALA . 14.6 m -76.73 -160.09 0.02 OUTLIER Pre-proline 0 N--CA 1.492 1.651 0 O-C-N 121.23 -0.919 . . . . 0.0 110.244 179.996 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.516 ' CD ' ' HB ' ' A' ' 54' ' ' VAL . 24.4 Cg_exo -99.3 52.39 0.06 OUTLIER 'Trans proline' 0 C--N 1.306 -1.67 0 O-C-N 123.898 1.473 . . . . 0.0 110.403 -179.882 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.427 ' O ' HD12 ' A' ' 25' ' ' LEU . . . 141.26 46.83 0.05 OUTLIER Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.941 -1.264 . . . . 0.0 109.941 179.831 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 1.088 ' HB2' HG22 ' A' ' 54' ' ' VAL . . . -100.01 124.14 45.03 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.144 -1.21 . . . . 0.0 110.032 179.694 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.851 HD22 ' N ' ' A' ' 58' ' ' LEU . 1.6 mm? -110.41 154.51 23.47 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.25 -0.906 . . . . 0.0 110.129 -179.846 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.491 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.4 OUTLIER -106.27 110.64 22.94 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.166 -0.959 . . . . 0.0 110.354 179.837 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.689 ' HB3' ' HE1' ' A' ' 45' ' ' MET . 17.4 p90 -72.56 -18.02 61.66 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.242 -0.911 . . . . 0.0 109.164 179.223 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.434 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.79 -35.47 66.33 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.451 -0.781 . . . . 0.0 109.104 179.571 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.493 ' HB3' ' CD ' ' A' ' 46' ' ' PRO . . . -60.15 -32.68 71.26 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.368 -0.832 . . . . 0.0 109.174 179.185 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.671 ' HE2' HG22 ' B' ' 20' ' ' VAL . 2.6 t80 -63.14 -48.79 76.96 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.785 -0.572 . . . . 0.0 110.203 179.756 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.453 ' O ' ' HB2' ' A' ' 68' ' ' TYR . 41.3 p -63.92 -45.74 87.91 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.216 -0.928 . . . . 0.0 110.401 -179.862 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.495 ' O ' ' CA ' ' A' ' 69' ' ' GLY . 54.0 m -67.06 -39.25 86.86 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.236 -0.915 . . . . 0.0 110.285 -179.897 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.19 -43.86 69.89 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.231 -0.918 . . . . 0.0 110.35 -179.851 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.896 ' CD2' ' HB2' ' B' ' 23' ' ' ALA . 22.5 mt -73.6 -44.6 56.73 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.175 -0.953 . . . . 0.0 110.357 -179.868 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.928 ' CE2' HG22 ' A' ' 6' ' ' THR . 11.7 m-85 -99.44 15.4 26.53 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.222 -0.924 . . . . 0.0 110.286 -179.935 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.495 ' CA ' ' O ' ' A' ' 65' ' ' SER . . . -46.13 112.21 0.79 Allowed Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -179.834 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -119.2 -16.89 9.02 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.309 -1.113 . . . . 0.0 110.181 179.902 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 178.9 107.41 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.247 -0.908 . . . . 0.0 110.22 179.966 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -73.54 136.83 44.09 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.176 -0.952 . . . . 0.0 110.255 179.961 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 O-C-N 121.33 -0.857 . . . . 0.0 110.213 179.967 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.257 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 14.3 ptmt -114.18 36.25 3.81 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.207 -1.172 . . . . 0.0 110.226 -179.965 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.486 ' HA ' HG21 ' A' ' 16' ' ' ILE . 7.3 ttpt -65.2 -45.74 83.55 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.174 -0.954 . . . . 0.0 110.228 -179.879 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.45 -41.94 73.57 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.284 -0.885 . . . . 0.0 110.099 179.859 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -61.07 -41.28 96.34 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.231 -0.918 . . . . 0.0 110.115 179.872 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 12' ' ' ALA . . . . . 0.608 ' HB2' HD13 ' A' ' 16' ' ' ILE . . . -62.97 -36.43 83.45 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.309 -0.869 . . . . 0.0 110.142 179.94 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.646 ' O ' HG23 ' B' ' 17' ' ' VAL . 55.0 t -65.96 -45.12 91.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.255 -0.903 . . . . 0.0 110.163 179.758 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.04 -39.69 79.06 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.262 -0.899 . . . . 0.0 110.207 179.973 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 15.9 m -70.04 -40.79 74.95 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.317 -0.864 . . . . 0.0 110.21 179.916 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.57 HG23 ' HB3' ' A' ' 13' ' ' SER . 92.4 t -67.08 -45.47 86.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.265 -0.897 . . . . 0.0 110.247 179.986 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.908 HG13 ' NE2' ' A' ' 37' ' ' GLN . 55.0 t -62.77 -44.33 99.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.199 -0.938 . . . . 0.0 110.098 179.935 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.06 -39.19 77.85 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.311 -0.868 . . . . 0.0 110.236 -179.988 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.25 -40.77 86.29 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.194 -0.941 . . . . 0.0 110.221 -179.905 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.671 HG22 ' HE2' ' A' ' 63' ' ' PHE . 91.0 t -66.05 -41.04 88.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.293 -0.879 . . . . 0.0 110.355 -179.982 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 48.6 t0 -61.6 -31.86 71.95 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.245 -0.909 . . . . 0.0 110.247 -179.883 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -39.43 94.19 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.249 -0.907 . . . . 0.0 110.175 -179.9 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.896 ' HB2' ' CD2' ' A' ' 67' ' ' LEU . . . -65.91 -38.35 88.48 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.188 -0.945 . . . . 0.0 110.334 -179.851 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.72 -39.53 81.09 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.174 -0.954 . . . . 0.0 110.398 -179.867 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 56.3 t -62.86 -21.57 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.155 -0.966 . . . . 0.0 110.376 -179.818 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.54 30.79 6.35 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.287 -0.883 . . . . 0.0 110.262 -179.961 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 61.6 tt0 -77.63 106.09 3.38 Favored Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.17 -0.957 . . . . 0.0 110.142 179.894 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -59.93 132.19 43.54 Favored 'Trans proline' 0 C--N 1.305 -1.748 0 O-C-N 124.054 1.555 . . . . 0.0 110.314 -179.769 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 5.1 ttt-85 . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.232 -0.917 . . . . 0.0 110.253 179.893 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ttt . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 121.249 0.547 . . . . 0.0 110.143 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.935 ' HB3' HD11 ' A' ' 11' ' ' ILE . . . -130.1 -143.25 0.25 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.283 -0.886 . . . . 0.0 110.123 179.97 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -90.76 -166.27 1.54 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.291 -0.881 . . . . 0.0 110.25 179.961 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.522 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 7.5 t -100.11 -144.23 0.33 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.169 -0.957 . . . . 0.0 110.198 179.944 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.44 ' CB ' ' O ' ' A' ' 4' ' ' THR . 1.7 t0 66.6 -168.72 0.2 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.277 -0.889 . . . . 0.0 110.196 179.905 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -50.1 -24.11 2.52 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.28 -0.887 . . . . 0.0 110.27 179.933 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.437 ' O ' HG13 ' A' ' 11' ' ' ILE . . . -62.01 -45.26 94.36 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.224 -0.923 . . . . 0.0 109.453 179.754 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.522 ' HB2' ' HA ' ' A' ' 4' ' ' THR . 1.3 tm-20 -56.06 -36.59 68.23 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.437 -0.789 . . . . 0.0 109.682 179.333 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -61.96 -48.41 80.53 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.354 -0.841 . . . . 0.0 110.04 179.866 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 44.0 t -59.44 -46.42 92.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.339 -0.851 . . . . 0.0 109.673 179.695 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.935 HD11 ' HB3' ' A' ' 2' ' ' ALA . 44.7 mt -57.49 -48.49 82.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.293 -0.879 . . . . 0.0 109.431 179.536 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.76 -43.36 85.4 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.223 -0.923 . . . . 0.0 108.811 178.979 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.586 ' O ' ' HB1' ' B' ' 12' ' ' ALA . 6.7 p -63.07 -39.19 93.98 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 178.6 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -68.57 -41.21 80.02 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.512 -0.742 . . . . 0.0 109.576 179.112 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.638 ' NH2' ' CE2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -54.47 -42.61 70.88 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.276 -0.89 . . . . 0.0 109.62 179.486 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.86 HD12 ' HB2' ' B' ' 12' ' ' ALA . 38.0 mt -57.64 -45.05 86.5 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 O-C-N 121.155 -0.965 . . . . 0.0 108.72 179.032 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.464 HD13 ' HA ' ' A' ' 17' ' ' LEU . 4.1 mm? -65.97 -41.7 90.82 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.449 -0.782 . . . . 0.0 109.717 178.905 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.461 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -72.15 -11.96 60.97 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.475 -0.766 . . . . 0.0 110.091 -179.958 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.461 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 1.7 t 66.32 64.59 0.51 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.339 -0.851 . . . . 0.0 110.249 -179.987 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 51.45 62.36 2.75 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.213 -0.93 . . . . 0.0 110.377 179.902 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.525 ' O ' ' NE ' ' A' ' 15' ' ' ARG . 14.9 mttt -141.76 140.77 20.58 Favored Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.316 -0.865 . . . . 0.0 109.881 179.847 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.584 ' O ' ' CD1' ' A' ' 23' ' ' TYR . 18.5 Cg_endo -62.24 -10.65 19.09 Favored 'Trans proline' 0 C--N 1.303 -1.835 0 O-C-N 123.926 1.488 . . . . 0.0 110.178 179.938 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.584 ' CD1' ' O ' ' A' ' 22' ' ' PRO . 32.0 m-85 -143.06 -173.5 3.93 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.265 -0.897 . . . . 0.0 110.255 -179.974 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.7 tt -143.66 139.37 25.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.376 -0.828 . . . . 0.0 109.993 179.863 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.8 mt -80.17 143.35 33.91 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.276 -0.89 . . . . 0.0 109.95 -179.932 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.657 ' HB2' HD11 ' A' ' 58' ' ' LEU . . . -62.52 -36.49 82.75 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.38 -0.825 . . . . 0.0 110.606 -179.534 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -65.48 -36.44 83.88 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.134 -0.979 . . . . 0.0 110.128 -179.892 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.471 ' O ' ' CG ' ' A' ' 32' ' ' GLU . 28.8 mt-10 -69.1 -51.11 41.97 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.12 -0.988 . . . . 0.0 110.131 -179.876 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.738 HD12 ' C ' ' A' ' 29' ' ' LEU . 2.4 pp -67.62 -33.21 74.53 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.254 -0.904 . . . . 0.0 109.779 179.387 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 1.083 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 10.8 tpt180 -64.71 -34.84 79.26 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.261 -0.9 . . . . 0.0 110.526 -179.846 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.4 ttp85 -93.98 -9.05 38.21 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.218 -0.926 . . . . 0.0 110.63 -179.576 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.471 ' CG ' ' O ' ' A' ' 28' ' ' GLU . 8.0 mm-40 -100.13 -23.44 14.85 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.11 -0.994 . . . . 0.0 111.171 -179.313 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.638 HD22 ' HB3' ' A' ' 37' ' ' GLN . 0.3 OUTLIER -110.87 150.43 41.82 Favored Pre-proline 0 N--CA 1.489 1.486 0 O-C-N 120.907 -1.121 . . . . 0.0 110.3 -179.753 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.433 ' HG2' ' HB2' ' A' ' 37' ' ' GLN . 6.3 Cg_exo -47.36 144.44 9.73 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 O-C-N 124.031 1.542 . . . . 0.0 109.879 179.783 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.432 ' C ' ' O ' ' A' ' 34' ' ' PRO . 35.3 Cg_endo -38.1 -47.79 2.25 Favored 'Trans proline' 0 C--N 1.304 -1.78 0 O-C-N 124.192 1.628 . . . . 0.0 110.569 -179.72 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.409 ' OD1' ' HG2' ' A' ' 35' ' ' PRO . 2.4 m-20 -66.31 -47.02 74.9 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.24 -0.912 . . . . 0.0 111.185 -179.563 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.638 ' HB3' HD22 ' A' ' 33' ' ' LEU . 0.9 OUTLIER -69.82 -44.43 70.0 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.062 -1.024 . . . . 0.0 110.575 -179.42 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 1.083 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -59.16 -44.46 92.11 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.28 -0.888 . . . . 0.0 110.624 -179.534 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -66.09 -43.43 87.31 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.099 -1.001 . . . . 0.0 110.712 -179.643 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -61.31 -43.74 98.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.161 -0.962 . . . . 0.0 110.5 -179.805 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.457 ' O ' ' SD ' ' A' ' 45' ' ' MET . 79.1 m -58.09 -42.41 85.54 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.165 -0.959 . . . . 0.0 110.477 -179.771 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.644 HG13 HD11 ' A' ' 29' ' ' LEU . 36.4 mt -65.49 -21.82 29.88 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.14 -0.975 . . . . 0.0 110.362 -179.854 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.66 -34.5 23.02 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.18 -0.95 . . . . 0.0 110.817 -179.569 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.52 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 2.0 mmp_? -74.72 -69.45 0.46 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.107 -0.996 . . . . 0.0 110.589 -179.521 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.763 ' HE2' ' HB3' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -36.28 118.14 0.69 Allowed Pre-proline 0 N--CA 1.488 1.467 0 O-C-N 121.53 -0.731 . . . . 0.0 111.412 -179.756 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.689 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 9.3 Cg_endo -70.21 -154.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.304 -1.771 0 O-C-N 124.197 1.63 . . . . 0.0 109.342 179.117 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.413 ' O ' ' C ' ' A' ' 48' ' ' TYR . . . -96.93 113.7 25.26 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.082 -1.011 . . . . 0.0 110.331 179.864 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.56 ' CD1' ' O ' ' A' ' 57' ' ' ALA . 12.9 p90 -41.88 144.77 0.39 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.407 -0.808 . . . . 0.0 110.288 -179.997 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -151.73 24.79 0.67 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.294 -0.879 . . . . 0.0 110.192 -179.872 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -106.98 -165.86 22.28 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.445 -1.462 . . . . 0.0 109.445 -179.992 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -72.87 165.31 33.14 Favored 'Trans proline' 0 C--N 1.305 -1.718 0 O-C-N 123.923 1.486 . . . . 0.0 110.261 -179.996 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.517 ' O ' HG13 ' A' ' 54' ' ' VAL . . . 79.01 7.01 88.7 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -179.986 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.451 ' C ' ' O ' ' A' ' 52' ' ' GLY . 0.0 OUTLIER -36.22 139.91 0.15 Allowed 'General case' 0 C--N 1.308 -1.238 0 O-C-N 121.612 -0.934 . . . . 0.0 110.905 -179.71 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 1.056 HG23 ' HB2' ' A' ' 57' ' ' ALA . 1.5 m -142.83 -169.46 0.22 Allowed Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.686 -0.634 . . . . 0.0 109.961 179.595 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.465 ' HD2' ' HB ' ' A' ' 54' ' ' VAL . 11.7 Cg_endo -93.67 115.35 0.26 Allowed 'Trans proline' 0 C--N 1.305 -1.757 0 O-C-N 123.948 1.499 . . . . 0.0 110.832 -179.515 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.87 33.6 26.66 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 110.059 -1.216 . . . . 0.0 110.059 179.458 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 1.056 ' HB2' HG23 ' A' ' 54' ' ' VAL . . . -91.21 137.95 31.97 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.091 -1.24 . . . . 0.0 110.479 -179.988 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.657 HD11 ' HB2' ' A' ' 26' ' ' ALA . 62.3 mt -124.88 159.75 30.41 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.298 -0.876 . . . . 0.0 109.613 179.499 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.454 ' C ' ' HG2' ' A' ' 45' ' ' MET . 3.7 m-20 -106.18 110.76 23.11 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.005 -1.06 . . . . 0.0 111.234 -179.52 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.773 ' HE1' HG23 ' A' ' 11' ' ' ILE . 39.7 p90 -81.49 -29.77 33.55 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.425 -0.797 . . . . 0.0 110.08 179.307 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.528 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.5 -36.65 66.92 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.283 -0.886 . . . . 0.0 109.522 -179.943 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.689 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -68.16 -35.81 78.65 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.344 -0.848 . . . . 0.0 109.862 179.539 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.52 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 2.6 t80 -72.05 -31.44 66.14 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.576 -0.703 . . . . 0.0 110.303 179.66 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 20.1 m -71.43 -48.5 49.2 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.285 -0.884 . . . . 0.0 110.409 -179.704 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.43 -43.28 97.89 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.199 -0.938 . . . . 0.0 110.37 -179.779 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -61.83 -40.78 96.48 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.196 -0.94 . . . . 0.0 110.404 -179.789 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.86 -40.03 75.39 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.152 -0.968 . . . . 0.0 110.346 -179.804 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -91.73 -24.58 19.41 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.127 -0.983 . . . . 0.0 110.263 -179.995 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.439 ' O ' ' HB3' ' A' ' 70' ' ' GLU . . . 112.97 -70.22 0.22 Allowed Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 179.888 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.439 ' HB3' ' O ' ' A' ' 69' ' ' GLY . 1.1 tp10 62.98 21.62 13.0 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.269 -1.136 . . . . 0.0 110.236 -179.981 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.4 ' O ' HD23 ' A' ' 73' ' ' LEU . 10.9 p -128.0 -76.4 0.57 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.273 -0.892 . . . . 0.0 110.253 -179.985 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.91 122.2 31.24 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.156 -0.965 . . . . 0.0 110.192 179.981 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.4 HD23 ' O ' ' A' ' 71' ' ' SER . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.655 0 O-C-N 121.178 -0.952 . . . . 0.0 110.154 179.959 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.24 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -109.76 -57.47 2.18 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.254 -1.145 . . . . 0.0 110.264 -179.936 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.448 ' CE ' ' OE1' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -59.96 -51.14 70.96 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.217 -0.927 . . . . 0.0 110.153 179.942 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.8 -35.54 68.85 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.216 -0.927 . . . . 0.0 110.059 179.935 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -62.84 -42.55 99.78 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.216 -0.928 . . . . 0.0 110.207 179.932 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 12' ' ' ALA . . . . . 0.86 ' HB2' HD12 ' A' ' 16' ' ' ILE . . . -67.04 -40.96 87.28 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.294 -0.879 . . . . 0.0 110.073 179.916 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.518 ' O ' HG23 ' B' ' 17' ' ' VAL . 75.1 t -61.24 -44.62 98.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.204 -0.935 . . . . 0.0 109.952 179.895 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.52 -44.33 89.5 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.19 -0.943 . . . . 0.0 110.053 179.809 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 54.3 m -63.55 -43.25 97.63 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.241 -0.912 . . . . 0.0 110.085 179.858 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.424 HG23 ' O ' ' B' ' 12' ' ' ALA . 76.7 t -64.22 -41.99 94.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.298 -0.876 . . . . 0.0 110.054 179.864 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.518 HG23 ' O ' ' B' ' 13' ' ' VAL . 77.6 t -61.04 -44.33 98.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.272 -0.892 . . . . 0.0 110.071 179.84 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.8 -45.97 92.33 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.162 -0.961 . . . . 0.0 110.034 179.939 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.32 -45.44 87.91 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.201 -0.937 . . . . 0.0 110.087 179.826 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 66.5 t -68.04 -40.52 83.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.231 -0.918 . . . . 0.0 110.191 179.937 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.53 ' O ' HG23 ' B' ' 25' ' ' VAL . 41.6 t0 -61.87 -31.5 71.78 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.345 -0.847 . . . . 0.0 110.133 179.934 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -55.82 -50.93 69.19 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.26 -0.9 . . . . 0.0 110.078 -179.995 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.87 -39.66 90.01 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.199 -0.938 . . . . 0.0 110.091 179.785 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 10.6 ttp180 -67.44 -33.67 75.62 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.406 -0.809 . . . . 0.0 110.128 179.857 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 25' ' ' VAL . . . . . 0.53 HG23 ' O ' ' B' ' 21' ' ' ASP . 25.2 t -59.43 -20.39 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.294 -0.879 . . . . 0.0 110.104 -179.908 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.582 ' NH1' ' HB3' ' B' ' 26' ' ' ARG . 6.9 mtp-105 -82.54 15.3 2.61 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.337 -0.852 . . . . 0.0 110.517 -179.905 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 27' ' ' GLU . . . . . 0.561 ' O ' ' C ' ' B' ' 28' ' ' PRO . 0.0 OUTLIER -106.3 107.13 59.33 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.369 -0.832 . . . . 0.0 109.383 179.484 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' B' B ' 28' ' ' PRO . . . . . 0.561 ' C ' ' O ' ' B' ' 27' ' ' GLU . 82.7 Cg_exo -0.68 71.6 0.0 OUTLIER 'Trans proline' 0 N--CA 1.501 1.917 0 O-C-N 124.917 2.009 . . . . 0.0 112.328 -179.369 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 29' ' ' ARG . . . . . 0.52 ' N ' ' O ' ' B' ' 27' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 O-C-N 121.208 -0.932 . . . . 0.0 110.266 -179.531 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 mtt . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.201 0.524 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -159.22 178.73 9.69 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.289 -0.882 . . . . 0.0 110.356 -179.994 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -171.21 82.35 0.08 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.349 -0.845 . . . . 0.0 109.937 179.973 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 7.6 t -125.83 14.79 8.03 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.329 -0.857 . . . . 0.0 110.526 -179.761 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -140.51 108.72 5.78 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.151 -0.968 . . . . 0.0 110.526 -179.857 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 27.8 m -111.38 -44.59 3.51 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.27 -0.894 . . . . 0.0 109.989 179.75 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.8 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -66.52 -45.78 78.39 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.282 -0.886 . . . . 0.0 109.793 179.644 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -54.69 -36.48 64.7 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.358 -0.838 . . . . 0.0 109.758 179.552 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -61.56 -40.08 93.44 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.34 -0.85 . . . . 0.0 110.047 179.995 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 88.3 t -58.2 -52.35 59.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.178 -0.951 . . . . 0.0 109.935 179.698 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 59.0 mt -55.47 -49.49 72.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.254 -0.904 . . . . 0.0 109.49 179.612 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.83 -40.38 79.91 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.315 -0.866 . . . . 0.0 108.876 179.119 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.401 ' O ' HD23 ' A' ' 17' ' ' LEU . 2.0 p -66.8 -37.78 85.2 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.418 -0.801 . . . . 0.0 109.122 178.941 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.495 ' CE1' ' HE1' ' A' ' 45' ' ' MET . 3.3 m-85 -68.27 -43.66 77.28 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.317 -0.864 . . . . 0.0 109.706 179.363 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.401 ' HD3' ' OH ' ' A' ' 60' ' ' TYR . 0.7 OUTLIER -53.35 -47.99 68.92 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.327 -0.858 . . . . 0.0 109.389 179.515 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.613 HG21 ' HA ' ' B' ' 9' ' ' LYS . 71.3 mt -59.09 -42.36 86.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.403 -0.811 . . . . 0.0 109.607 179.281 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.631 HD12 ' HB3' ' A' ' 32' ' ' GLU . 2.6 mm? -64.79 -39.13 93.09 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.414 -0.804 . . . . 0.0 109.982 179.727 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.746 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -82.95 10.58 7.59 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.319 -0.863 . . . . 0.0 110.249 -179.974 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 61.46 56.35 2.61 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.311 -0.868 . . . . 0.0 110.239 -179.948 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.6 t0 56.85 59.31 3.56 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.225 -0.922 . . . . 0.0 110.225 179.925 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' A' ' 18' ' ' ALA . 18.8 mttm -140.62 144.34 35.96 Favored Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.25 -0.906 . . . . 0.0 110.173 -179.975 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 21' ' ' LYS . 26.6 Cg_exo -75.03 1.06 8.17 Favored 'Trans proline' 0 C--N 1.304 -1.792 0 O-C-N 124.091 1.574 . . . . 0.0 109.998 179.562 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.455 ' CD1' ' O ' ' A' ' 23' ' ' TYR . 8.4 p90 -141.69 150.42 41.85 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.219 -0.925 . . . . 0.0 110.179 179.963 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.746 HG12 ' HB2' ' A' ' 18' ' ' ALA . 0.4 OUTLIER -121.38 144.09 31.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.188 -0.945 . . . . 0.0 110.002 -179.973 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.581 ' H ' HD13 ' A' ' 24' ' ' ILE . 4.4 mm? -85.73 145.24 27.35 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.22 -0.925 . . . . 0.0 110.302 -179.894 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.63 -45.43 94.11 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.279 -0.888 . . . . 0.0 110.181 179.894 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -61.42 -35.72 78.35 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.22 -0.925 . . . . 0.0 109.85 179.889 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -62.4 -47.2 85.17 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.264 -0.897 . . . . 0.0 109.075 179.329 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.584 HD11 HG21 ' A' ' 24' ' ' ILE . 41.8 mt -58.75 -33.46 70.29 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.424 -0.798 . . . . 0.0 109.229 178.971 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.495 ' HA ' ' CB ' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -65.73 -34.68 78.76 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.359 -0.838 . . . . 0.0 110.236 179.999 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -96.68 -31.93 12.44 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.086 -1.009 . . . . 0.0 110.832 -179.745 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.631 ' HB3' HD12 ' A' ' 17' ' ' LEU . 0.4 OUTLIER -76.02 -23.33 55.18 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.058 -1.026 . . . . 0.0 110.587 -179.726 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.683 HD23 ' HD2' ' A' ' 34' ' ' PRO . 0.2 OUTLIER -133.05 158.44 75.81 Favored Pre-proline 0 C--N 1.305 -1.334 0 O-C-N 121.096 -1.003 . . . . 0.0 110.403 -179.627 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.683 ' HD2' HD23 ' A' ' 33' ' ' LEU . 6.3 Cg_exo -50.58 134.02 39.12 Favored 'Trans proline' 0 C--N 1.305 -1.739 0 O-C-N 124.053 1.554 . . . . 0.0 110.056 179.769 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.42 ' C ' ' O ' ' A' ' 34' ' ' PRO . 33.9 Cg_endo -39.24 -35.23 0.66 Allowed 'Trans proline' 0 C--N 1.306 -1.701 0 O-C-N 124.133 1.596 . . . . 0.0 110.723 -179.636 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -65.31 -44.67 87.12 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.164 -0.96 . . . . 0.0 110.585 -179.73 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.517 ' CG ' ' HG2' ' A' ' 34' ' ' PRO . 28.6 mm100 -69.33 -38.11 78.03 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.157 -0.965 . . . . 0.0 110.549 -179.66 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.495 ' CB ' ' HA ' ' A' ' 30' ' ' ARG . . . -56.38 -42.55 78.06 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.212 -0.93 . . . . 0.0 110.549 -179.902 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 40.0 tt0 -64.27 -45.01 89.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.116 -0.99 . . . . 0.0 110.383 -179.759 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.09 -48.33 71.32 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.141 -0.974 . . . . 0.0 110.401 -179.86 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.456 ' O ' ' HG3' ' A' ' 45' ' ' MET . 54.8 m -65.75 -43.59 88.5 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.328 -0.857 . . . . 0.0 110.518 -179.846 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.454 ' CG1' ' O ' ' A' ' 38' ' ' ALA . 61.1 mt -60.26 -22.9 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.236 -0.915 . . . . 0.0 110.782 -179.56 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.96 -31.21 23.7 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.119 -0.988 . . . . 0.0 110.834 -179.509 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.561 ' HG3' ' CE1' ' A' ' 63' ' ' PHE . 0.2 OUTLIER -76.3 -65.15 0.96 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.224 -0.922 . . . . 0.0 110.589 -179.704 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.601 ' CE ' ' CB ' ' A' ' 60' ' ' TYR . 12.0 mtt -39.44 111.12 0.66 Allowed Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.379 -0.825 . . . . 0.0 110.863 -179.737 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.485 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 6.7 Cg_endo -67.2 -155.68 0.03 OUTLIER 'Trans proline' 0 C--N 1.304 -1.775 0 O-C-N 124.018 1.536 . . . . 0.0 109.865 179.497 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -94.51 121.7 36.34 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.109 -0.994 . . . . 0.0 110.263 179.913 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -50.79 -58.78 5.11 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.375 -0.828 . . . . 0.0 110.337 -179.987 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 58.03 162.1 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.183 -0.948 . . . . 0.0 110.236 -179.957 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 164.99 -129.11 1.9 Allowed Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.962 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -92.3 2.48 3.93 Favored 'Trans proline' 0 C--N 1.305 -1.729 0 O-C-N 124.019 1.536 . . . . 0.0 110.276 179.944 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.476 ' O ' ' O ' ' A' ' 53' ' ' SER . . . 151.96 41.8 0.02 OUTLIER Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.942 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.476 ' O ' ' O ' ' A' ' 52' ' ' GLY . 12.7 p -54.39 -161.75 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.289 0 O-C-N 121.403 -1.057 . . . . 0.0 110.642 -179.633 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.42 ' HA ' ' HD3' ' A' ' 55' ' ' PRO . 30.1 m -134.22 154.29 79.94 Favored Pre-proline 0 N--CA 1.492 1.657 0 O-C-N 121.267 -0.896 . . . . 0.0 110.2 179.893 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 54' ' ' VAL . 21.3 Cg_exo -67.47 87.79 0.34 Allowed 'Trans proline' 0 C--N 1.305 -1.721 0 O-C-N 124.076 1.566 . . . . 0.0 110.34 -179.966 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 157.92 -27.95 0.46 Allowed Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.43 -1.468 . . . . 0.0 109.43 -179.936 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.78 107.45 4.59 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.374 -1.074 . . . . 0.0 110.151 179.974 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.535 ' HB3' ' CB ' ' A' ' 45' ' ' MET . 80.3 mt -104.11 155.72 18.47 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.211 -0.931 . . . . 0.0 110.266 179.974 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -98.97 111.14 23.62 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.249 -0.907 . . . . 0.0 110.546 -179.852 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.601 ' CB ' ' CE ' ' A' ' 45' ' ' MET . 31.7 p90 -76.22 -28.79 57.33 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.276 -0.89 . . . . 0.0 110.268 179.708 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.571 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.06 -41.41 75.02 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.233 -0.917 . . . . 0.0 110.135 -179.67 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.485 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -65.61 -35.56 81.17 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.238 -0.913 . . . . 0.0 109.791 179.823 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.566 ' O ' ' CD1' ' A' ' 63' ' ' PHE . 1.5 t80 -72.28 -36.34 68.95 Favored 'General case' 0 C--N 1.298 -1.659 0 O-C-N 121.607 -0.683 . . . . 0.0 110.242 179.807 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.567 ' O ' ' CE2' ' A' ' 68' ' ' TYR . 2.7 p -63.67 -49.85 71.59 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.211 -0.93 . . . . 0.0 110.455 -179.683 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.613 ' HA ' ' CD2' ' A' ' 68' ' ' TYR . 43.3 m -60.11 -47.56 85.39 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.168 -0.957 . . . . 0.0 110.264 -179.869 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -55.98 -36.68 68.15 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.189 -0.944 . . . . 0.0 110.204 -179.971 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.882 HD21 ' O ' ' B' ' 19' ' ' ALA . 0.2 OUTLIER -54.73 -32.54 59.84 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.288 -0.882 . . . . 0.0 110.232 -179.952 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.8 ' CE2' ' HB1' ' A' ' 7' ' ' ALA . 1.5 m-85 -84.98 -31.78 23.36 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.238 -0.914 . . . . 0.0 110.205 -179.692 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -81.57 171.41 52.83 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.769 -1.332 . . . . 0.0 109.769 -179.81 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -115.34 6.54 14.9 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.233 -1.157 . . . . 0.0 110.218 179.928 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.7 m -157.87 110.42 2.38 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.238 -0.914 . . . . 0.0 110.193 -179.961 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -92.3 139.31 30.73 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.21 -0.932 . . . . 0.0 110.254 -179.927 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.622 0 O-C-N 121.296 -0.877 . . . . 0.0 110.194 179.922 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.322 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 1.8 pttt -94.1 50.52 1.41 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.229 -1.159 . . . . 0.0 110.185 -179.976 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.613 ' HA ' HG21 ' A' ' 16' ' ' ILE . 0.4 OUTLIER -63.26 -48.88 76.3 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.249 -0.907 . . . . 0.0 110.172 -179.99 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.34 -39.42 69.99 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.198 -0.939 . . . . 0.0 110.009 179.91 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -63.45 -39.78 95.39 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.314 -0.867 . . . . 0.0 110.14 179.836 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.28 -42.39 99.3 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.181 -0.949 . . . . 0.0 109.95 -179.985 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.456 HG13 ' HG ' ' A' ' 33' ' ' LEU . 98.4 t -59.6 -40.4 82.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.164 -0.96 . . . . 0.0 109.712 179.5 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.41 -36.84 76.61 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.279 -0.888 . . . . 0.0 109.898 179.746 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 25.0 m -67.62 -42.77 81.85 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.275 -0.89 . . . . 0.0 110.14 179.914 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.807 ' O ' HG23 ' B' ' 20' ' ' VAL . 94.0 t -64.52 -40.42 88.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.299 -0.876 . . . . 0.0 110.28 179.968 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 67.8 t -63.07 -50.19 80.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.295 -0.878 . . . . 0.0 110.51 -179.684 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.33 -39.89 94.81 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.2 -0.938 . . . . 0.0 110.716 -179.598 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.882 ' O ' HD21 ' A' ' 67' ' ' LEU . . . -67.28 -41.57 85.26 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.187 -0.946 . . . . 0.0 110.613 -179.509 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.807 HG23 ' O ' ' B' ' 16' ' ' VAL . 63.7 t -67.45 -39.0 81.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.23 -0.919 . . . . 0.0 110.681 -179.526 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.02 -33.01 75.03 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.234 -0.916 . . . . 0.0 110.495 -179.744 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -56.3 -45.52 80.2 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.261 -0.899 . . . . 0.0 110.459 -179.702 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.87 -38.4 88.7 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.196 -0.94 . . . . 0.0 110.422 -179.768 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 8.4 ttt-85 -67.09 -47.93 69.74 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.193 -0.942 . . . . 0.0 110.21 -179.867 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 89.7 t -64.23 -21.14 28.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.312 -0.868 . . . . 0.0 110.292 -179.867 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 25.2 ttt85 -87.78 -87.55 0.15 Allowed 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.311 -0.868 . . . . 0.0 110.165 179.962 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -100.72 134.65 20.41 Favored Pre-proline 0 C--N 1.29 -2.021 0 O-C-N 121.695 -0.628 . . . . 0.0 110.224 179.995 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -89.79 93.03 0.31 Allowed 'Trans proline' 0 C--N 1.306 -1.677 0 O-C-N 124.036 1.545 . . . . 0.0 110.408 179.975 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.156 -0.965 . . . . 0.0 110.185 179.845 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 tpp . . . . . 0 N--CA 1.49 1.573 0 CA-C-O 121.205 0.526 . . . . 0.0 110.275 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -129.71 -168.01 1.89 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.211 -0.93 . . . . 0.0 110.299 -179.935 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -147.78 -61.43 0.26 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.256 -0.902 . . . . 0.0 110.245 179.896 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.4 t -155.89 -174.41 4.95 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.23 -0.919 . . . . 0.0 110.298 179.988 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.49 ' O ' ' N ' ' A' ' 7' ' ' ALA . 8.8 p-10 -60.51 178.53 0.21 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.294 -0.878 . . . . 0.0 110.299 -179.993 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.46 ' CB ' ' O ' ' A' ' 5' ' ' ASP . 1.8 m 67.07 -58.46 0.41 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.28 -0.888 . . . . 0.0 110.128 -179.813 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.49 ' N ' ' O ' ' A' ' 5' ' ' ASP . . . -66.59 -44.51 81.98 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.279 -0.888 . . . . 0.0 109.703 179.627 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -55.74 -36.92 67.8 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.314 -0.866 . . . . 0.0 109.702 179.618 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.406 ' O ' ' OG ' ' A' ' 13' ' ' SER . 2.9 tt0 -62.12 -48.33 80.64 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.261 -0.899 . . . . 0.0 110.08 179.957 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.51 HG12 ' HD2' ' A' ' 14' ' ' PHE . 73.1 t -59.86 -46.83 93.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.159 -0.963 . . . . 0.0 109.89 179.864 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.75 HG23 ' HE1' ' A' ' 60' ' ' TYR . 79.0 mt -56.92 -48.34 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.366 -0.834 . . . . 0.0 109.607 179.586 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.425 ' O ' HG13 ' A' ' 16' ' ' ILE . . . -57.49 -39.55 76.7 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.316 -0.865 . . . . 0.0 109.095 179.172 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.501 ' HA ' ' HB1' ' B' ' 12' ' ' ALA . 1.1 m -68.79 -39.06 80.33 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.481 -0.762 . . . . 0.0 109.124 178.955 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.536 ' CG ' ' HB2' ' A' ' 60' ' ' TYR . 4.9 m-85 -68.55 -45.24 72.68 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.43 -0.794 . . . . 0.0 109.793 179.425 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.3 ttt-85 -53.02 -41.09 64.36 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.299 -0.876 . . . . 0.0 109.495 179.496 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.621 HD12 ' HB2' ' B' ' 12' ' ' ALA . 42.0 mt -63.47 -43.79 98.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.272 -0.892 . . . . 0.0 109.985 179.723 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.471 HD22 ' HB3' ' A' ' 32' ' ' GLU . 75.8 mt -62.98 -41.71 99.63 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.109 -0.995 . . . . 0.0 109.691 179.561 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.709 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -75.77 1.14 15.6 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.342 -0.849 . . . . 0.0 110.132 179.757 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.463 ' O ' ' CB ' ' A' ' 20' ' ' ASP . 0.1 OUTLIER 66.69 55.16 0.79 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.177 -0.952 . . . . 0.0 110.099 -179.897 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.463 ' CB ' ' O ' ' A' ' 19' ' ' SER . 13.6 t0 65.82 65.02 0.54 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.241 -0.912 . . . . 0.0 110.14 -179.97 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.625 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 26.8 mttt -148.79 143.76 17.52 Favored Pre-proline 0 N--CA 1.49 1.537 0 O-C-N 121.255 -0.903 . . . . 0.0 110.145 -179.968 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.546 ' O ' ' CD1' ' A' ' 23' ' ' TYR . 11.3 Cg_endo -73.32 -0.73 9.6 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 O-C-N 124.083 1.57 . . . . 0.0 110.068 179.495 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.546 ' CD1' ' O ' ' A' ' 22' ' ' PRO . 25.9 m-85 -139.98 158.85 43.41 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.247 -0.908 . . . . 0.0 109.842 179.863 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.77 HD13 ' H ' ' A' ' 25' ' ' LEU . 0.4 OUTLIER -124.39 150.77 29.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.115 -0.991 . . . . 0.0 109.942 179.984 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.77 ' H ' HD13 ' A' ' 24' ' ' ILE . 15.6 mt -92.74 145.61 24.28 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.067 -1.021 . . . . 0.0 110.26 -179.842 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.45 -45.39 80.84 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.221 -0.924 . . . . 0.0 110.278 -179.862 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -61.14 -35.7 77.79 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.208 -0.932 . . . . 0.0 109.917 179.871 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.557 ' HB3' HD11 ' A' ' 24' ' ' ILE . 21.9 mm-40 -60.15 -45.2 93.86 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.344 -0.847 . . . . 0.0 109.796 179.795 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.406 HD13 ' CB ' ' A' ' 41' ' ' CYS . 26.2 mt -63.15 -34.27 77.26 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.359 -0.838 . . . . 0.0 109.827 179.68 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.537 ' HA ' ' HB2' ' A' ' 38' ' ' ALA . 24.3 mtt-85 -68.88 -38.26 79.58 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.356 -0.84 . . . . 0.0 110.219 -179.927 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.5 -26.24 18.04 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.291 -0.881 . . . . 0.0 110.831 -179.568 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.471 ' HB3' HD22 ' A' ' 17' ' ' LEU . 75.4 mm-40 -89.88 -23.74 21.56 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.098 -1.001 . . . . 0.0 110.658 -179.69 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.773 HD21 HG23 ' B' ' 17' ' ' VAL . 1.3 mt -128.73 155.85 78.53 Favored Pre-proline 0 N--CA 1.488 1.451 0 O-C-N 121.19 -0.944 . . . . 0.0 110.056 -179.797 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.769 ' HD2' HD23 ' A' ' 33' ' ' LEU . 47.9 Cg_exo -52.56 144.4 41.86 Favored 'Trans proline' 0 C--N 1.304 -1.793 0 O-C-N 124.009 1.531 . . . . 0.0 110.302 179.972 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -41.87 -45.13 6.92 Favored 'Trans proline' 0 C--N 1.305 -1.744 0 O-C-N 124.003 1.528 . . . . 0.0 110.589 -179.842 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -58.36 -43.66 88.49 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.196 -0.94 . . . . 0.0 110.434 -179.771 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.688 ' HG3' HG22 ' B' ' 17' ' ' VAL . 75.3 mm-40 -68.97 -40.75 78.65 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.213 -0.929 . . . . 0.0 110.16 -179.959 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.537 ' HB2' ' HA ' ' A' ' 30' ' ' ARG . . . -56.54 -47.13 80.08 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.299 -0.876 . . . . 0.0 110.39 -179.956 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.2 tp60 -65.85 -46.72 77.43 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.159 -0.963 . . . . 0.0 110.252 -179.858 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -64.04 -48.01 77.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.28 -0.887 . . . . 0.0 110.209 -179.96 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.413 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 77.5 m -65.13 -47.7 76.19 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.219 -0.926 . . . . 0.0 110.159 -179.946 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 54.5 mt -58.34 -23.49 22.34 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.255 -0.903 . . . . 0.0 110.234 179.935 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.48 -41.31 16.7 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.242 -0.912 . . . . 0.0 110.33 -179.809 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.63 ' CB ' ' CD2' ' A' ' 63' ' ' PHE . 1.0 OUTLIER -64.11 -73.93 0.11 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.109 -0.994 . . . . 0.0 109.975 -179.916 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.594 ' CG ' ' HA ' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -38.47 117.21 0.96 Allowed Pre-proline 0 N--CA 1.488 1.427 0 O-C-N 121.382 -0.824 . . . . 0.0 111.473 179.847 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.424 ' HD2' ' HA ' ' A' ' 45' ' ' MET . 7.7 Cg_endo -72.39 -154.47 0.04 OUTLIER 'Trans proline' 0 C--N 1.302 -1.871 0 O-C-N 123.829 1.436 . . . . 0.0 108.51 178.33 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.435 ' O ' ' C ' ' A' ' 48' ' ' TYR . . . -100.43 115.6 30.43 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.77 -1.206 . . . . 0.0 110.176 179.653 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.487 ' CE1' ' CZ ' ' A' ' 23' ' ' TYR . 3.7 t80 -39.65 -60.02 1.04 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.565 -0.709 . . . . 0.0 110.295 -179.946 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 61.91 160.31 0.07 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.191 -0.943 . . . . 0.0 110.07 -179.875 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 148.07 -159.02 27.9 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 179.996 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -71.06 83.57 0.93 Allowed 'Trans proline' 0 C--N 1.305 -1.721 0 O-C-N 123.97 1.511 . . . . 0.0 110.207 179.93 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.498 ' O ' ' O ' ' A' ' 53' ' ' SER . . . 109.84 -89.47 0.55 Allowed Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.918 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.498 ' O ' ' O ' ' A' ' 52' ' ' GLY . 0.7 OUTLIER 49.78 169.63 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.287 0 O-C-N 121.579 -0.953 . . . . 0.0 111.17 179.38 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 28.8 m -145.73 154.93 52.46 Favored Pre-proline 0 C--N 1.299 -1.601 0 O-C-N 121.32 -0.863 . . . . 0.0 110.262 -179.636 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -63.92 84.67 0.14 Allowed 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 124.01 1.532 . . . . 0.0 110.305 179.877 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.463 ' O ' HD23 ' A' ' 58' ' ' LEU . . . 169.44 -37.21 0.19 Allowed Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 -179.987 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -77.31 110.99 12.5 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.189 -1.183 . . . . 0.0 110.207 -179.886 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.59 HD11 HG22 ' A' ' 24' ' ' ILE . 0.6 OUTLIER -114.89 160.87 19.0 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.318 -0.864 . . . . 0.0 110.131 179.874 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -99.47 115.86 30.27 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.306 -0.871 . . . . 0.0 111.45 -179.17 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.75 ' HE1' HG23 ' A' ' 11' ' ' ILE . 9.1 p90 -78.43 -21.66 48.87 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.429 -0.794 . . . . 0.0 110.145 179.114 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.564 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.85 -33.11 64.23 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.212 -0.93 . . . . 0.0 109.753 179.973 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.434 ' O ' ' CB ' ' A' ' 66' ' ' ALA . . . -65.2 -32.36 74.0 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.284 -0.885 . . . . 0.0 109.486 179.451 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.63 ' CD2' ' CB ' ' A' ' 44' ' ' ARG . 5.9 t80 -65.89 -41.94 90.92 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.742 -0.599 . . . . 0.0 110.223 179.884 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 70.1 p -68.52 -49.58 58.54 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.269 -0.895 . . . . 0.0 110.37 -179.854 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.9 m -68.51 -35.5 77.58 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.273 -0.892 . . . . 0.0 110.381 -179.881 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.434 ' CB ' ' O ' ' A' ' 62' ' ' ALA . . . -67.08 -44.01 81.14 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.241 -0.912 . . . . 0.0 110.386 -179.838 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.549 ' CD1' ' HB2' ' B' ' 23' ' ' ALA . 3.6 mm? -68.39 -41.93 79.81 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.179 -0.951 . . . . 0.0 110.633 -179.745 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -98.98 15.37 25.95 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.068 -1.02 . . . . 0.0 110.56 -179.759 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -55.27 123.2 29.07 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.346 -1.501 . . . . 0.0 109.346 179.879 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -159.23 105.94 1.74 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.23 -1.159 . . . . 0.0 110.342 -179.966 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 66.8 m 43.75 48.01 6.7 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.268 -0.895 . . . . 0.0 110.34 179.977 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -65.85 132.22 48.16 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.168 -0.958 . . . . 0.0 110.183 179.89 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.611 0 O-C-N 121.222 -0.923 . . . . 0.0 110.243 -179.953 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 7' ' ' GLY . . . . . 0.5 ' O ' ' N ' ' B' ' 9' ' ' LYS . . . . . . . . 0 N--CA 1.489 2.194 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 . . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.442 ' CB ' ' O ' ' B' ' 7' ' ' GLY . 4.0 tptp 66.29 -63.95 0.23 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.29 -1.123 . . . . 0.0 110.16 179.966 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.704 ' O ' HG23 ' B' ' 13' ' ' VAL . 7.7 ttmt -66.87 -37.51 84.56 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.251 -0.906 . . . . 0.0 110.184 179.993 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.65 -37.24 80.85 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.249 -0.907 . . . . 0.0 110.09 179.855 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -66.02 -41.77 90.52 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.295 -0.878 . . . . 0.0 109.97 179.895 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 12' ' ' ALA . . . . . 0.621 ' HB2' HD12 ' A' ' 16' ' ' ILE . . . -65.59 -40.03 92.24 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.402 -0.811 . . . . 0.0 109.958 179.752 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.704 HG23 ' O ' ' B' ' 9' ' ' LYS . 57.5 t -59.72 -44.83 94.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.352 -0.843 . . . . 0.0 110.077 179.751 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.62 -39.23 93.14 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.147 -0.971 . . . . 0.0 109.946 179.875 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.71 -47.61 80.41 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.357 -0.839 . . . . 0.0 110.07 179.864 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.681 ' O ' HG23 ' B' ' 20' ' ' VAL . 58.8 t -63.65 -45.51 97.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.285 -0.884 . . . . 0.0 110.028 179.884 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.773 HG23 HD21 ' A' ' 33' ' ' LEU . 24.2 t -60.74 -50.87 78.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.3 -0.875 . . . . 0.0 110.003 179.891 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.96 -40.91 67.24 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.271 -0.893 . . . . 0.0 110.091 179.815 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.79 -45.54 78.09 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.266 -0.896 . . . . 0.0 110.023 179.853 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.681 HG23 ' O ' ' B' ' 16' ' ' VAL . 42.5 t -67.21 -43.1 88.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.287 -0.883 . . . . 0.0 110.049 179.855 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.606 ' O ' HG23 ' B' ' 25' ' ' VAL . 35.7 t70 -57.3 -37.38 72.35 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.278 -0.888 . . . . 0.0 110.053 179.966 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -49.03 76.89 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.29 -0.881 . . . . 0.0 110.143 -179.987 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.549 ' HB2' ' CD1' ' A' ' 67' ' ' LEU . . . -59.04 -36.06 74.38 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.221 -0.924 . . . . 0.0 110.11 -179.927 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.66 -37.57 87.82 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.319 -0.863 . . . . 0.0 110.08 179.849 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 25' ' ' VAL . . . . . 0.606 HG23 ' O ' ' B' ' 21' ' ' ASP . 25.2 t -60.04 -21.41 21.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.253 -0.904 . . . . 0.0 110.034 179.897 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 55.52 56.69 6.01 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.389 -0.819 . . . . 0.0 110.379 179.79 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 27' ' ' GLU . . . . . 0.402 ' HA ' ' HD3' ' B' ' 28' ' ' PRO . 0.5 OUTLIER -77.54 151.0 80.06 Favored Pre-proline 0 N--CA 1.489 1.484 0 O-C-N 121.202 -0.937 . . . . 0.0 110.118 179.901 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' B' B ' 28' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' B' ' 27' ' ' GLU . 35.9 Cg_exo -71.54 148.86 54.68 Favored 'Trans proline' 0 C--N 1.306 -1.673 0 O-C-N 123.911 1.48 . . . . 0.0 110.287 -179.965 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 28.8 ttp85 . . . . . 0 N--CA 1.492 1.641 0 O-C-N 121.245 -0.91 . . . . 0.0 110.204 179.934 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 121.145 0.498 . . . . 0.0 110.206 . . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -172.08 73.56 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.254 -0.904 . . . . 0.0 110.38 179.948 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.424 ' O ' ' O ' ' A' ' 4' ' ' THR . 30.1 t70 -160.86 66.53 0.31 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.216 -0.928 . . . . 0.0 110.309 179.775 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.424 ' O ' ' O ' ' A' ' 3' ' ' ASP . 0.2 OUTLIER 58.29 111.15 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.198 -0.939 . . . . 0.0 110.123 -179.982 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.444 ' HB3' ' HB3' ' A' ' 8' ' ' GLU . 32.6 t0 -148.45 162.25 39.98 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.285 -0.884 . . . . 0.0 110.266 -179.935 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.512 ' CG2' ' CZ ' ' A' ' 68' ' ' TYR . 2.5 m -98.63 -41.91 7.5 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.303 -0.873 . . . . 0.0 110.304 -179.937 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.38 -47.4 76.5 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.239 -0.913 . . . . 0.0 109.867 179.896 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.444 ' HB3' ' HB3' ' A' ' 5' ' ' ASP . 37.8 tt0 -56.02 -35.54 66.95 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.402 -0.811 . . . . 0.0 109.993 179.626 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 16.7 tp60 -60.62 -38.94 86.4 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.191 -0.943 . . . . 0.0 109.841 -179.931 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.891 HG12 ' CD2' ' A' ' 14' ' ' PHE . 53.9 t -61.16 -41.03 87.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.162 -0.961 . . . . 0.0 109.192 179.242 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.469 HG23 ' HE1' ' A' ' 60' ' ' TYR . 11.9 mm -55.26 -49.78 69.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.351 -0.843 . . . . 0.0 109.615 179.452 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.83 -43.61 94.48 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.362 -0.836 . . . . 0.0 109.324 179.331 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.41 ' CB ' HG23 ' B' ' 16' ' ' VAL . 2.7 m -66.69 -40.56 88.57 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.383 -0.823 . . . . 0.0 109.314 179.215 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.891 ' CD2' HG12 ' A' ' 10' ' ' VAL . 1.2 m-85 -68.38 -40.92 81.24 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.333 -0.855 . . . . 0.0 109.587 179.323 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.08 -50.19 64.9 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.362 -0.836 . . . . 0.0 109.561 179.538 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 68.1 mt -60.06 -40.88 84.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.295 -0.878 . . . . 0.0 109.711 179.424 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.743 HD11 HG22 ' B' ' 13' ' ' VAL . 0.6 OUTLIER -65.06 -36.2 83.6 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.396 -0.815 . . . . 0.0 109.894 179.684 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.659 ' HB2' ' HB ' ' A' ' 24' ' ' ILE . . . -89.67 8.22 32.66 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.344 -0.847 . . . . 0.0 110.172 -179.912 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.474 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.4 OUTLIER 67.75 55.66 0.59 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.196 -0.94 . . . . 0.0 110.254 179.991 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.425 ' N ' ' OD1' ' A' ' 20' ' ' ASP . 5.8 m-20 52.28 56.67 7.39 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.285 -0.884 . . . . 0.0 110.397 179.733 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' A' ' 19' ' ' SER . 68.2 mttt -138.52 140.39 27.76 Favored Pre-proline 0 N--CA 1.49 1.551 0 O-C-N 121.19 -0.944 . . . . 0.0 109.951 179.777 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.61 -11.76 18.48 Favored 'Trans proline' 0 C--N 1.305 -1.749 0 O-C-N 124.051 1.553 . . . . 0.0 110.11 179.901 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.57 ' O ' ' HB1' ' A' ' 18' ' ' ALA . 47.8 p90 -135.46 171.25 14.71 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.264 -0.897 . . . . 0.0 110.05 179.805 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.659 ' HB ' ' HB2' ' A' ' 18' ' ' ALA . 8.9 tt -146.72 158.01 10.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.231 -0.918 . . . . 0.0 110.241 -179.917 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.5 mp -91.25 145.14 24.91 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.226 -0.921 . . . . 0.0 110.197 -179.939 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.538 ' HA ' ' CD2' ' A' ' 29' ' ' LEU . . . -59.7 -39.52 84.86 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.303 -0.873 . . . . 0.0 110.328 -179.955 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.73 -35.88 81.14 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.183 -0.948 . . . . 0.0 109.921 179.742 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -69.61 -51.17 37.52 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.338 -0.851 . . . . 0.0 109.554 179.65 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.745 HD12 ' C ' ' A' ' 29' ' ' LEU . 1.7 pp -67.75 -33.53 75.04 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.31 -0.869 . . . . 0.0 109.595 179.192 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.629 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -62.89 -34.47 77.48 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.352 -0.842 . . . . 0.0 110.132 179.79 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -83.68 -31.38 26.16 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.252 -0.905 . . . . 0.0 110.173 179.93 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -76.4 -23.6 54.03 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.266 -0.896 . . . . 0.0 110.287 -179.944 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.784 HD22 ' HB3' ' A' ' 37' ' ' GLN . 1.4 mt -112.92 151.3 43.96 Favored Pre-proline 0 C--N 1.305 -1.357 0 O-C-N 121.197 -0.939 . . . . 0.0 110.061 -179.929 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.462 ' CB ' ' HD2' ' A' ' 35' ' ' PRO . 35.2 Cg_exo -55.0 172.28 0.39 Allowed 'Trans proline' 0 C--N 1.304 -1.815 0 O-C-N 124.033 1.544 . . . . 0.0 110.232 179.946 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.462 ' HD2' ' CB ' ' A' ' 34' ' ' PRO . 30.8 Cg_endo -59.02 -45.8 26.14 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 123.952 1.501 . . . . 0.0 110.311 -179.83 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -66.3 -43.02 87.45 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.323 -0.861 . . . . 0.0 110.77 -179.807 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.784 ' HB3' HD22 ' A' ' 33' ' ' LEU . 4.1 mp0 -69.63 -42.64 74.05 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.156 -0.965 . . . . 0.0 110.381 -179.616 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.629 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -57.26 -48.66 78.29 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.297 -0.877 . . . . 0.0 110.36 -179.726 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 14.2 tm0? -66.82 -43.32 84.06 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.261 -0.899 . . . . 0.0 110.777 -179.78 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -64.91 -42.32 94.82 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.104 -0.997 . . . . 0.0 110.503 -179.521 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.492 ' O ' ' HG2' ' A' ' 45' ' ' MET . 73.6 m -65.22 -51.32 61.68 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.111 -0.993 . . . . 0.0 110.709 -179.687 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.533 HG13 HD11 ' A' ' 29' ' ' LEU . 50.6 mt -53.72 -23.6 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.181 -0.95 . . . . 0.0 110.757 -179.588 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.36 -19.14 31.89 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.117 -0.989 . . . . 0.0 110.649 -179.65 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.608 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 18.4 mmt180 -89.56 -69.99 0.69 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.228 -0.92 . . . . 0.0 110.834 -179.495 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.517 ' CB ' ' O ' ' A' ' 59' ' ' ASP . 9.4 ptp -46.89 110.02 1.18 Allowed Pre-proline 0 N--CA 1.488 1.464 0 O-C-N 121.136 -0.978 . . . . 0.0 110.639 -179.408 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.833 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 9.6 Cg_endo -63.37 -157.64 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.622 0 O-C-N 124.132 1.596 . . . . 0.0 110.184 179.882 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.45 ' O ' ' C ' ' A' ' 48' ' ' TYR . . . -75.57 128.77 35.99 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.22 -0.925 . . . . 0.0 110.369 -179.794 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.565 ' CE2' ' HB2' ' A' ' 53' ' ' SER . 28.7 p90 -39.24 -39.93 0.69 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.536 -0.727 . . . . 0.0 110.502 179.858 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.52 ' N ' ' CG ' ' A' ' 48' ' ' TYR . 0.1 OUTLIER 60.47 93.1 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.205 -0.935 . . . . 0.0 110.204 -179.943 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -165.26 179.1 39.95 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 -179.919 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -87.66 -66.76 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.759 0 O-C-N 124.096 1.577 . . . . 0.0 110.195 179.954 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.481 ' O ' ' O ' ' A' ' 53' ' ' SER . . . -81.88 61.92 4.6 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 179.896 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.565 ' HB2' ' CE2' ' A' ' 48' ' ' TYR . 38.8 t -54.5 -159.93 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.387 -1.067 . . . . 0.0 111.011 -179.53 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.815 ' CG2' ' HB2' ' A' ' 57' ' ' ALA . 15.7 m -155.64 169.47 10.32 Favored Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.424 -0.798 . . . . 0.0 109.795 179.836 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.466 ' HD2' ' HB ' ' A' ' 54' ' ' VAL . 2.7 Cg_endo -52.22 87.94 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.754 0 O-C-N 123.946 1.498 . . . . 0.0 110.224 179.861 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.519 ' N ' ' O ' ' A' ' 54' ' ' VAL . . . 73.54 94.11 0.11 Allowed Glycine 0 N--CA 1.492 2.382 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 -179.975 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.815 ' HB2' ' CG2' ' A' ' 54' ' ' VAL . . . -121.12 140.75 51.55 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.276 -1.131 . . . . 0.0 110.575 -179.973 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.501 HD11 ' HB2' ' A' ' 26' ' ' ALA . 2.3 mt -129.88 160.39 33.67 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.374 -0.829 . . . . 0.0 109.81 179.582 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.517 ' O ' ' CB ' ' A' ' 45' ' ' MET . 1.3 t70 -110.39 110.76 21.66 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.063 -1.023 . . . . 0.0 110.673 -179.789 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.574 ' HB2' ' CD2' ' A' ' 14' ' ' PHE . 40.6 p90 -75.86 -24.24 55.73 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.211 -0.931 . . . . 0.0 109.33 179.231 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.429 ' HB3' ' OD2' ' A' ' 59' ' ' ASP . . . -62.54 -44.4 96.45 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.469 -0.769 . . . . 0.0 109.617 179.67 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.833 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -61.56 -32.81 72.91 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.254 -0.904 . . . . 0.0 109.917 179.682 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.642 ' HZ ' HG22 ' B' ' 20' ' ' VAL . 1.2 t80 -71.4 -39.78 70.94 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.52 -0.737 . . . . 0.0 110.241 179.881 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.476 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 3.6 t -61.05 -50.1 74.7 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.264 -0.898 . . . . 0.0 110.609 -179.69 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.43 -35.3 77.41 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.216 -0.928 . . . . 0.0 110.447 -179.783 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.0 -46.3 68.35 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.208 -0.933 . . . . 0.0 110.786 -179.542 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.761 HD11 ' CD2' ' A' ' 68' ' ' TYR . 2.5 pp -70.84 -33.01 70.21 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.097 -1.002 . . . . 0.0 110.752 -179.477 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.761 ' CD2' HD11 ' A' ' 67' ' ' LEU . 0.4 OUTLIER -99.55 7.73 45.07 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.26 -0.9 . . . . 0.0 110.391 179.975 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -116.75 133.36 10.64 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 -179.995 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -106.74 175.35 5.53 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.268 -1.136 . . . . 0.0 110.19 179.998 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -82.96 -33.74 26.61 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.269 -0.895 . . . . 0.0 110.162 179.994 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -98.38 119.72 37.56 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.229 -0.919 . . . . 0.0 110.2 -179.926 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.579 0 O-C-N 121.16 -0.963 . . . . 0.0 110.124 179.938 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.251 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -164.64 40.23 0.08 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.242 -1.152 . . . . 0.0 110.139 179.901 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.749 ' O ' HG23 ' B' ' 13' ' ' VAL . 1.5 tttp -62.26 -48.84 78.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.244 -0.91 . . . . 0.0 110.089 179.892 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.67 -45.55 77.71 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.329 -0.857 . . . . 0.0 110.213 179.881 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -63.45 -41.13 98.65 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.317 -0.864 . . . . 0.0 110.068 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.25 -33.7 76.07 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.309 -0.869 . . . . 0.0 110.167 -179.965 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.749 HG23 ' O ' ' B' ' 9' ' ' LYS . 58.6 t -64.36 -41.96 93.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.278 -0.889 . . . . 0.0 110.093 -179.973 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.04 -35.65 79.23 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.228 -0.92 . . . . 0.0 110.415 -179.974 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 28.7 m -62.31 -44.01 97.5 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.175 -0.953 . . . . 0.0 110.522 -179.862 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.41 HG23 ' CB ' ' A' ' 13' ' ' SER . 84.2 t -68.74 -42.54 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.201 -0.937 . . . . 0.0 110.578 -179.728 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.546 HG23 ' O ' ' B' ' 13' ' ' VAL . 89.9 t -58.28 -44.83 88.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.098 -1.001 . . . . 0.0 110.503 -179.86 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.91 -38.49 91.27 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.316 -0.865 . . . . 0.0 110.285 -179.823 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.99 -46.06 82.99 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.169 -0.957 . . . . 0.0 110.39 -179.935 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.642 HG22 ' HZ ' ' A' ' 63' ' ' PHE . 76.1 t -65.45 -42.33 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.239 -0.913 . . . . 0.0 110.309 -179.86 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -58.48 -41.62 85.68 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.25 -0.906 . . . . 0.0 110.202 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 22' ' ' GLN . . . . . 0.87 ' O ' HG12 ' B' ' 25' ' ' VAL . 3.5 tm0? -60.49 -47.84 84.38 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.219 -0.925 . . . . 0.0 110.005 -179.944 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.88 -35.09 80.01 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.296 -0.877 . . . . 0.0 110.195 179.875 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 24' ' ' ARG . . . . . 0.448 ' HG2' ' NH1' ' B' ' 24' ' ' ARG . 17.8 ttp85 -63.62 -45.27 91.08 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.233 -0.917 . . . . 0.0 110.456 -179.857 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 25' ' ' VAL . . . . . 0.87 HG12 ' O ' ' B' ' 22' ' ' GLN . 2.7 p -62.71 -20.8 26.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.178 -0.952 . . . . 0.0 110.306 -179.881 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 1.2 mtm180 -93.22 -45.62 7.77 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-O 122.001 0.905 . . . . 0.0 110.677 -179.649 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 27' ' ' GLU . . . . . 0.485 ' HA ' ' HD3' ' B' ' 28' ' ' PRO . 39.2 tt0 -90.12 133.61 33.18 Favored Pre-proline 0 C--N 1.285 -2.197 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.281 -179.61 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 28' ' ' PRO . . . . . 0.485 ' HD3' ' HA ' ' B' ' 27' ' ' GLU . 3.1 Cg_exo -82.56 118.02 2.79 Favored 'Trans proline' 0 C--N 1.306 -1.682 0 O-C-N 124.044 1.549 . . . . 0.0 110.184 179.981 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.139 -0.976 . . . . 0.0 110.225 179.971 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.517 HG22 ' CE2' ' A' ' 68' ' ' TYR . 1.6 m . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.099 0.476 . . . . 0.0 110.107 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -70.28 -44.23 68.81 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.074 -1.017 . . . . 0.0 109.476 179.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -62.02 -36.09 80.51 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.471 -0.768 . . . . 0.0 109.906 179.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -60.79 -43.08 98.58 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.33 -0.856 . . . . 0.0 110.097 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.518 HG12 ' HD2' ' A' ' 14' ' ' PHE . 62.0 t -66.06 -42.81 92.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.116 -0.99 . . . . 0.0 109.631 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.615 HG23 ' HE1' ' A' ' 60' ' ' TYR . 61.9 mt -61.45 -49.67 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.298 -0.876 . . . . 0.0 109.318 179.314 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.65 -39.09 92.79 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.377 -0.827 . . . . 0.0 109.228 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.2 m -68.18 -44.18 76.47 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.41 -0.806 . . . . 0.0 109.479 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.57 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 0.6 OUTLIER -65.7 -42.59 91.01 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.307 -0.87 . . . . 0.0 109.497 179.386 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.19 -42.91 70.22 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.343 -0.848 . . . . 0.0 109.416 179.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 17.0 mt -60.55 -44.85 97.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.35 -0.843 . . . . 0.0 109.583 179.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.859 HD12 ' HB3' ' A' ' 32' ' ' GLU . 2.5 mm? -65.09 -40.67 94.94 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.359 -0.838 . . . . 0.0 109.966 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.826 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -75.51 1.3 14.53 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.298 -0.876 . . . . 0.0 110.311 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.478 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.1 OUTLIER 67.0 69.18 0.4 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.209 -0.932 . . . . 0.0 110.303 179.866 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 47.04 56.21 7.07 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.243 -0.911 . . . . 0.0 110.28 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.538 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 18.5 mttp -134.34 143.49 47.12 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.16 -0.963 . . . . 0.0 110.023 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -73.83 -0.05 8.91 Favored 'Trans proline' 0 C--N 1.304 -1.815 0 O-C-N 124.04 1.547 . . . . 0.0 110.122 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.538 ' CZ ' ' HD3' ' A' ' 21' ' ' LYS . 23.1 p90 -145.94 163.18 35.96 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.237 -0.914 . . . . 0.0 110.22 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.826 HG12 ' HB2' ' A' ' 18' ' ' ALA . 0.3 OUTLIER -127.07 142.14 44.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.301 -0.874 . . . . 0.0 109.735 179.89 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.485 ' H ' HD13 ' A' ' 24' ' ' ILE . 44.1 mt -88.59 152.26 21.95 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.242 -0.911 . . . . 0.0 110.352 -179.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.26 -44.32 95.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.36 -0.837 . . . . 0.0 110.069 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -60.19 -34.97 74.35 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.365 -0.834 . . . . 0.0 110.242 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.466 ' HB3' HD11 ' A' ' 24' ' ' ILE . 9.0 mm-40 -61.87 -49.59 75.65 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.23 -0.919 . . . . 0.0 109.931 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.468 HD21 HG13 ' A' ' 24' ' ' ILE . 9.1 mt -59.53 -34.17 72.3 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.264 -0.898 . . . . 0.0 109.814 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.17 -42.26 93.86 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.329 -0.857 . . . . 0.0 110.174 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -91.33 -20.36 21.94 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.198 -0.938 . . . . 0.0 110.456 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.859 ' HB3' HD12 ' A' ' 17' ' ' LEU . 17.0 mm-40 -98.68 -23.76 15.32 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.08 -1.012 . . . . 0.0 110.409 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.432 HD22 ' HB3' ' A' ' 37' ' ' GLN . 0.3 OUTLIER -128.16 147.72 64.65 Favored Pre-proline 0 N--CA 1.487 1.393 0 O-C-N 121.165 -0.959 . . . . 0.0 110.066 179.962 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.497 ' O ' ' N ' ' A' ' 37' ' ' GLN . 5.9 Cg_exo -43.59 131.03 7.32 Favored 'Trans proline' 0 C--N 1.304 -1.782 0 O-C-N 123.89 1.469 . . . . 0.0 109.679 179.402 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.429 ' C ' ' O ' ' A' ' 34' ' ' PRO . 12.0 Cg_exo -36.8 -42.38 0.77 Allowed 'Trans proline' 0 C--N 1.306 -1.67 0 O-C-N 124.254 1.66 . . . . 0.0 110.619 -179.392 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -65.94 -36.64 83.89 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.352 -0.843 . . . . 0.0 110.857 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.665 ' HG3' HG11 ' B' ' 20' ' ' VAL . 1.8 mp0 -69.09 -44.5 72.35 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.064 -1.023 . . . . 0.0 110.784 -179.262 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.734 ' O ' HD12 ' A' ' 42' ' ' ILE . . . -58.66 -47.24 85.14 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.195 -0.94 . . . . 0.0 110.707 -179.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.4 tp60 -60.3 -49.43 77.63 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.227 -0.92 . . . . 0.0 110.995 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 51.6 t80 -61.84 -48.0 82.55 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.009 -1.057 . . . . 0.0 110.436 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.447 ' O ' ' SD ' ' A' ' 45' ' ' MET . 69.8 m -65.35 -49.51 69.08 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.256 -0.902 . . . . 0.0 110.64 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.734 HD12 ' O ' ' A' ' 38' ' ' ALA . 18.6 mt -44.45 -24.66 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.12 -0.988 . . . . 0.0 110.535 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -84.15 -41.28 17.22 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.173 -0.955 . . . . 0.0 110.743 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.532 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 1.5 mmt-85 -64.11 -72.62 0.14 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.12 -0.987 . . . . 0.0 110.59 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.468 ' CB ' ' O ' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -48.01 116.9 5.1 Favored Pre-proline 0 N--CA 1.489 1.475 0 O-C-N 121.14 -0.975 . . . . 0.0 110.394 -179.841 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.581 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 10.5 Cg_endo . . . . . 0 C--N 1.305 -1.728 0 O-C-N 124.14 1.6 . . . . 0.0 110.45 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.794 ' O ' HD23 ' A' ' 58' ' ' LEU . . . . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 121.252 0.549 . . . . 0.0 110.194 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.794 HD23 ' O ' ' A' ' 57' ' ' ALA . 25.1 mt -135.88 147.54 48.23 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.197 -0.94 . . . . 0.0 110.147 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.468 ' O ' ' CB ' ' A' ' 45' ' ' MET . 0.7 OUTLIER -103.37 111.83 24.43 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.19 -0.944 . . . . 0.0 110.291 179.916 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.615 ' HE1' HG23 ' A' ' 11' ' ' ILE . 8.0 p90 -81.66 -19.81 40.9 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.275 -0.89 . . . . 0.0 109.63 179.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.53 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -61.48 -40.76 95.73 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.415 -0.803 . . . . 0.0 109.853 179.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.581 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -66.53 -36.21 82.13 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.211 -0.931 . . . . 0.0 109.662 179.645 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.532 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 2.4 t80 -72.07 -34.75 68.95 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.722 -0.611 . . . . 0.0 110.18 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.3 p -60.91 -42.4 97.98 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.331 -0.856 . . . . 0.0 110.38 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 8.5 t -64.14 -36.86 85.43 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.218 -0.926 . . . . 0.0 110.486 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.7 -41.0 84.28 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.211 -0.931 . . . . 0.0 110.473 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.5 -44.07 89.32 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.208 -0.933 . . . . 0.0 110.187 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.517 ' CE2' HG22 ' A' ' 6' ' ' THR . 39.4 m-85 . . . . . 0 N--CA 1.49 1.531 0 O-C-N 121.237 -0.914 . . . . 0.0 110.473 -179.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 5.6 tttt . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.194 0.521 . . . . 0.0 110.072 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 14.5 tttt -67.86 -46.71 70.96 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.297 -0.877 . . . . 0.0 110.148 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.1 -41.08 71.18 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.259 -0.901 . . . . 0.0 109.816 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -60.55 -40.3 91.09 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.299 -0.876 . . . . 0.0 109.71 179.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . 0.538 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -63.19 -42.12 99.28 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.425 -0.797 . . . . 0.0 110.028 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.777 ' O ' HG23 ' B' ' 17' ' ' VAL . 46.6 t -61.28 -40.59 86.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.212 -0.93 . . . . 0.0 109.703 179.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.0 -39.24 77.78 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.259 -0.901 . . . . 0.0 109.499 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.7 m -68.82 -47.21 66.63 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.384 -0.822 . . . . 0.0 109.576 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.622 ' O ' HG23 ' B' ' 20' ' ' VAL . 26.4 t -63.46 -45.54 97.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.316 -0.865 . . . . 0.0 109.595 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.777 HG23 ' O ' ' B' ' 13' ' ' VAL . 49.4 t -62.45 -49.68 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.263 -0.898 . . . . 0.0 109.437 179.283 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.1 -43.07 77.74 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.363 -0.836 . . . . 0.0 109.924 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.18 -36.75 82.45 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.278 -0.888 . . . . 0.0 109.906 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.665 HG11 ' HG3' ' A' ' 37' ' ' GLN . 55.4 t -65.29 -41.43 91.39 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 121.187 -0.946 . . . . 0.0 109.713 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.3 -31.66 72.29 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.349 -0.844 . . . . 0.0 110.129 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.25 -51.23 70.84 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.232 -0.917 . . . . 0.0 110.087 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.26 -34.36 77.83 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.223 -0.923 . . . . 0.0 109.858 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.3 ttt180 . . . . . 0 N--CA 1.492 1.652 0 O-C-N 121.405 -0.809 . . . . 0.0 110.474 -179.811 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.676 HG21 ' CE1' ' A' ' 68' ' ' TYR . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 121.28 0.562 . . . . 0.0 110.245 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.33 -47.45 76.48 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.287 -0.883 . . . . 0.0 109.866 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -54.59 -36.34 64.31 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.382 -0.824 . . . . 0.0 109.828 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.415 ' O ' ' OG ' ' A' ' 13' ' ' SER . 4.2 tp60 -61.63 -48.05 82.63 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.322 -0.861 . . . . 0.0 110.151 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.477 HG12 ' CD2' ' A' ' 14' ' ' PHE . 12.6 t -64.3 -43.08 97.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.139 -0.975 . . . . 0.0 109.9 179.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 30.6 mt -62.0 -48.31 89.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 121.273 -0.892 . . . . 0.0 109.621 179.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.51 -41.01 79.95 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.223 -0.923 . . . . 0.0 109.006 179.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.449 ' HB3' HG23 ' B' ' 16' ' ' VAL . 3.7 m -68.16 -39.09 82.68 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.431 -0.793 . . . . 0.0 109.371 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.499 ' CG ' ' HB2' ' A' ' 60' ' ' TYR . 2.6 m-85 -68.58 -45.35 72.29 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.386 -0.822 . . . . 0.0 109.73 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 11.3 tpp85 -53.72 -41.18 66.74 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.345 -0.847 . . . . 0.0 109.55 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 42.5 mt -62.37 -44.54 99.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.401 -0.812 . . . . 0.0 109.922 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.661 HD22 ' HB3' ' A' ' 32' ' ' GLU . 56.8 mt -64.84 -41.75 95.48 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.344 -0.848 . . . . 0.0 109.861 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.677 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -67.86 -7.88 31.74 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.304 -0.872 . . . . 0.0 110.106 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.8 t 62.43 68.79 0.64 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.268 -0.895 . . . . 0.0 110.302 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 58.36 53.79 6.12 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.245 -0.909 . . . . 0.0 110.189 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.677 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 18.8 mtmt -141.9 143.36 28.23 Favored Pre-proline 0 N--CA 1.489 1.51 0 O-C-N 121.209 -0.932 . . . . 0.0 110.078 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -78.58 5.39 5.59 Favored 'Trans proline' 0 C--N 1.304 -1.787 0 O-C-N 124.078 1.568 . . . . 0.0 109.96 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.475 ' CD1' ' N ' ' A' ' 23' ' ' TYR . 28.9 p90 -145.3 159.83 42.43 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.279 -0.888 . . . . 0.0 109.963 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.817 HD12 HD23 ' A' ' 29' ' ' LEU . 0.3 OUTLIER -126.71 143.21 40.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.154 -0.966 . . . . 0.0 109.882 179.816 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.455 ' H ' HD13 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -100.66 150.64 22.53 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.29 -0.881 . . . . 0.0 110.407 -179.756 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.0 -33.12 66.83 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.283 -0.886 . . . . 0.0 109.74 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -61.53 -40.07 93.32 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.335 -0.853 . . . . 0.0 109.67 179.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.503 ' HB3' HD11 ' A' ' 24' ' ' ILE . 0.6 OUTLIER -68.56 -48.44 64.27 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.389 -0.819 . . . . 0.0 109.794 179.568 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.956 ' CD1' HD12 ' A' ' 33' ' ' LEU . 4.3 mm? -60.78 -34.24 74.2 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.198 -0.939 . . . . 0.0 109.738 179.612 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.0 mmm-85 -68.96 -34.72 75.8 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.36 -0.837 . . . . 0.0 110.109 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.64 -14.6 27.92 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.344 -0.847 . . . . 0.0 110.579 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.661 ' HB3' HD22 ' A' ' 17' ' ' LEU . 21.1 mm-40 -106.7 -23.53 12.4 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.078 -1.014 . . . . 0.0 110.693 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.956 HD12 ' CD1' ' A' ' 29' ' ' LEU . 6.4 mt -122.61 164.6 25.6 Favored Pre-proline 0 N--CA 1.488 1.431 0 O-C-N 121.073 -1.017 . . . . 0.0 110.249 -179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.442 ' CD ' HD23 ' A' ' 33' ' ' LEU . 33.8 Cg_exo -66.11 144.81 76.95 Favored 'Trans proline' 0 C--N 1.305 -1.761 0 O-C-N 124.036 1.545 . . . . 0.0 109.908 179.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.433 ' C ' ' O ' ' A' ' 34' ' ' PRO . 19.4 Cg_endo -40.48 -44.96 4.44 Favored 'Trans proline' 0 C--N 1.304 -1.802 0 O-C-N 124.032 1.543 . . . . 0.0 110.414 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.72 -37.49 86.57 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.244 -0.91 . . . . 0.0 110.729 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.522 ' HG2' HG22 ' B' ' 17' ' ' VAL . 0.0 OUTLIER -69.26 -45.83 68.76 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.137 -0.977 . . . . 0.0 110.554 -179.579 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.55 -44.21 96.39 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.156 -0.965 . . . . 0.0 110.582 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.9 tp60 -66.1 -46.53 77.3 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.096 -1.003 . . . . 0.0 110.473 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -63.28 -45.99 88.87 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.239 -0.913 . . . . 0.0 110.342 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.45 ' SG ' ' O ' ' A' ' 37' ' ' GLN . 74.9 m -60.93 -44.34 97.34 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.253 -0.904 . . . . 0.0 110.54 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 25.5 mt -53.88 -24.2 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.2 -0.937 . . . . 0.0 110.305 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.9 tttm -81.06 -19.43 43.79 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.127 -0.983 . . . . 0.0 110.227 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.591 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 26.4 mmt180 -92.24 -68.5 0.79 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.277 -0.889 . . . . 0.0 110.304 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.469 ' HB2' ' O ' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -55.55 109.6 1.73 Allowed Pre-proline 0 N--CA 1.489 1.489 0 O-C-N 121.186 -0.946 . . . . 0.0 110.324 179.907 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.622 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 19.7 Cg_exo . . . . . 0 C--N 1.304 -1.791 0 O-C-N 124.076 1.566 . . . . 0.0 110.217 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 121.26 0.552 . . . . 0.0 110.284 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.1 mt -121.66 160.15 25.05 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.24 -0.912 . . . . 0.0 110.015 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.529 ' OD2' ' HB2' ' A' ' 62' ' ' ALA . 6.2 t0 -97.6 111.61 23.81 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.252 -0.905 . . . . 0.0 110.349 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.605 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 11.2 p90 -79.6 -23.42 42.69 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.27 -0.894 . . . . 0.0 109.279 179.354 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.605 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -60.01 -42.96 95.41 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.395 -0.816 . . . . 0.0 109.657 179.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.622 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -60.79 -32.83 72.16 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.247 -0.908 . . . . 0.0 109.868 179.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.591 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 1.3 t80 -71.63 -36.77 70.86 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.687 -0.633 . . . . 0.0 110.372 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.2 m -61.47 -38.89 88.89 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.147 -0.971 . . . . 0.0 110.457 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 44.8 p -68.37 -42.36 79.26 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.205 -0.934 . . . . 0.0 110.418 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -63.65 -38.11 89.87 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.216 -0.928 . . . . 0.0 110.619 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.77 -42.3 88.65 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.146 -0.971 . . . . 0.0 110.529 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.676 ' CE1' HG21 ' A' ' 6' ' ' THR . 28.3 m-85 . . . . . 0 N--CA 1.492 1.637 0 O-C-N 121.181 -0.949 . . . . 0.0 110.431 -179.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.281 0.562 . . . . 0.0 110.176 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.95 -48.49 71.16 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.276 -0.89 . . . . 0.0 110.035 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.15 -37.43 66.95 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.28 -0.887 . . . . 0.0 109.883 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -66.23 -40.2 90.09 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.274 -0.891 . . . . 0.0 109.804 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.42 -43.78 98.01 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.259 -0.901 . . . . 0.0 109.649 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.502 ' O ' HG23 ' B' ' 17' ' ' VAL . 76.6 t -58.78 -40.34 79.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.193 -0.942 . . . . 0.0 109.485 179.293 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.06 -38.85 92.82 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.46 -0.775 . . . . 0.0 109.966 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 57.2 m -69.12 -45.53 69.95 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.396 -0.815 . . . . 0.0 110.172 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.72 HG11 HD11 ' A' ' 33' ' ' LEU . 70.3 t -62.47 -46.95 95.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.214 -0.928 . . . . 0.0 109.983 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.522 HG22 ' HG2' ' A' ' 37' ' ' GLN . 77.3 t -60.56 -49.15 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.182 -0.949 . . . . 0.0 110.009 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.5 -39.39 76.38 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.303 -0.873 . . . . 0.0 110.107 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.86 -45.39 78.32 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.309 -0.869 . . . . 0.0 110.116 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 53.3 t -61.85 -41.68 91.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.306 -0.871 . . . . 0.0 110.132 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.07 -38.51 91.48 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.299 -0.875 . . . . 0.0 110.169 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -55.83 -41.35 74.14 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.193 -0.942 . . . . 0.0 110.295 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.5 -42.53 95.76 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.214 -0.929 . . . . 0.0 110.282 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.2 mmm-85 . . . . . 0 N--CA 1.49 1.551 0 O-C-N 121.3 -0.875 . . . . 0.0 110.317 -179.848 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.453 ' HB ' ' CZ ' ' A' ' 68' ' ' TYR . 9.5 p . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 121.242 0.544 . . . . 0.0 110.1 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.02 -44.82 83.22 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.201 -0.937 . . . . 0.0 109.431 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.74 ' HA ' HD12 ' A' ' 11' ' ' ILE . 18.0 tt0 -60.49 -36.2 77.74 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.407 -0.808 . . . . 0.0 109.591 179.314 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -61.8 -48.56 80.07 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.3 -0.875 . . . . 0.0 110.322 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.788 HG12 ' CD2' ' A' ' 14' ' ' PHE . 46.6 t -58.54 -41.22 81.32 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.08 -1.012 . . . . 0.0 109.589 179.574 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.74 HD12 ' HA ' ' A' ' 8' ' ' GLU . 64.8 mt -61.3 -45.66 98.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.412 -0.805 . . . . 0.0 109.472 179.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.22 -47.2 83.51 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.32 -0.863 . . . . 0.0 109.144 179.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.468 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 14.2 m -62.92 -39.26 94.03 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.284 -0.885 . . . . 0.0 109.009 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.788 ' CD2' HG12 ' A' ' 10' ' ' VAL . 1.2 m-85 -66.98 -43.29 83.38 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.434 -0.791 . . . . 0.0 109.41 179.23 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.554 ' CD ' ' HA ' ' A' ' 20' ' ' ASP . 0.0 OUTLIER -53.18 -43.11 66.85 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.29 -0.881 . . . . 0.0 109.009 179.184 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.59 HD12 ' HB2' ' B' ' 12' ' ' ALA . 39.7 mt -58.89 -44.81 91.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.463 -0.773 . . . . 0.0 109.432 179.117 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 13' ' ' SER . 33.2 mt -65.05 -41.99 94.66 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.232 -0.917 . . . . 0.0 109.779 179.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.685 ' HB1' ' O ' ' A' ' 23' ' ' TYR . . . -76.33 -2.07 29.9 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.421 -0.799 . . . . 0.0 110.195 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.455 ' O ' ' C ' ' A' ' 20' ' ' ASP . 0.4 OUTLIER 64.93 77.37 0.31 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.317 -0.864 . . . . 0.0 110.328 179.783 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.554 ' HA ' ' CD ' ' A' ' 15' ' ' ARG . 4.6 p-10 37.44 45.36 0.56 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.593 -0.692 . . . . 0.0 110.517 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 18' ' ' ALA . 10.7 mmtt -122.08 144.89 42.5 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.351 -0.843 . . . . 0.0 110.116 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -65.5 -8.2 18.4 Favored 'Trans proline' 0 C--N 1.304 -1.783 0 O-C-N 124.218 1.641 . . . . 0.0 110.209 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.685 ' O ' ' HB1' ' A' ' 18' ' ' ALA . 19.5 p90 -143.85 167.53 22.1 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.315 -0.866 . . . . 0.0 110.288 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.754 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -123.19 140.66 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.303 -0.873 . . . . 0.0 109.767 179.797 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.754 ' N ' HD13 ' A' ' 24' ' ' ILE . 3.3 mp -81.47 149.96 28.51 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.142 -0.974 . . . . 0.0 110.216 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.511 ' HA ' HD11 ' A' ' 42' ' ' ILE . . . -61.47 -40.03 93.06 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.368 -0.832 . . . . 0.0 110.268 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -63.59 -36.28 83.29 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.219 -0.926 . . . . 0.0 109.899 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.553 ' HB3' HD11 ' A' ' 24' ' ' ILE . 2.6 mm-40 -60.62 -37.53 81.73 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.248 -0.907 . . . . 0.0 109.3 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.713 HD12 ' CD1' ' A' ' 42' ' ' ILE . 22.9 mt -66.53 -36.33 82.42 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.394 -0.816 . . . . 0.0 109.606 179.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.0 mtt85 -68.81 -34.53 75.68 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.331 -0.856 . . . . 0.0 110.116 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.402 ' NH1' ' HG2' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -93.9 -18.67 21.71 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.293 -0.88 . . . . 0.0 110.773 -179.499 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.47 ' CG ' ' O ' ' A' ' 28' ' ' GLU . 12.6 mm-40 -99.55 -23.61 15.03 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.025 -1.047 . . . . 0.0 110.745 -179.616 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.797 HD11 HG11 ' B' ' 16' ' ' VAL . 2.3 mt -128.63 141.83 42.86 Favored Pre-proline 0 N--CA 1.488 1.475 0 O-C-N 121.055 -1.028 . . . . 0.0 110.12 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.592 ' HD2' HD23 ' A' ' 33' ' ' LEU . 31.6 Cg_exo -43.58 130.91 7.28 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.825 1.434 . . . . 0.0 109.634 179.51 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.458 ' C ' ' O ' ' A' ' 34' ' ' PRO . 32.3 Cg_exo -35.18 -38.95 0.2 Allowed 'Trans proline' 0 C--N 1.308 -1.598 0 O-C-N 124.274 1.671 . . . . 0.0 110.904 -179.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.15 -43.9 85.7 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.35 -0.843 . . . . 0.0 110.954 -179.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.71 ' HB3' HD22 ' A' ' 33' ' ' LEU . 2.5 mp0 -70.02 -42.02 73.52 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.081 -1.012 . . . . 0.0 110.99 -179.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.496 ' O ' HG12 ' A' ' 42' ' ' ILE . . . -55.87 -45.83 78.44 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.245 -0.909 . . . . 0.0 110.662 -179.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -54.53 -46.86 73.64 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.111 -0.993 . . . . 0.0 110.68 -179.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -63.16 -47.01 84.48 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.094 -1.004 . . . . 0.0 110.551 -179.638 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.486 ' O ' ' HG2' ' A' ' 45' ' ' MET . 84.3 m -65.33 -48.36 73.3 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.15 -0.969 . . . . 0.0 110.681 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.713 ' CD1' HD12 ' A' ' 29' ' ' LEU . 15.9 mm -47.58 -31.06 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.127 -0.983 . . . . 0.0 110.876 -179.529 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 10.2 tttt -85.01 -36.7 21.11 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.105 -0.997 . . . . 0.0 110.374 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.569 ' HG3' ' CE1' ' A' ' 63' ' ' PHE . 9.3 mmp_? -60.13 -73.42 0.09 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.34 -0.85 . . . . 0.0 110.271 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.668 ' HE2' ' HA ' ' A' ' 60' ' ' TYR . 21.2 ptp -56.73 138.97 77.24 Favored Pre-proline 0 N--CA 1.488 1.453 0 O-C-N 121.213 -0.929 . . . . 0.0 110.301 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.517 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 20.5 Cg_endo . . . . . 0 C--N 1.306 -1.694 0 O-C-N 123.963 1.507 . . . . 0.0 110.504 -179.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 121.287 0.565 . . . . 0.0 110.335 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.403 ' HA ' ' O ' ' A' ' 46' ' ' PRO . 1.2 mp -114.95 159.54 20.61 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.306 -0.871 . . . . 0.0 109.725 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.483 ' O ' ' HB2' ' A' ' 45' ' ' MET . 4.9 m-20 -108.39 110.61 22.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.024 -1.048 . . . . 0.0 110.479 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.668 ' HA ' ' HE2' ' A' ' 45' ' ' MET . 15.0 p90 -73.35 -26.7 61.13 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.336 -0.852 . . . . 0.0 110.14 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.558 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.13 -36.36 68.16 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.273 -0.892 . . . . 0.0 109.983 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.517 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -68.12 -34.41 76.33 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.248 -0.907 . . . . 0.0 109.885 179.616 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.569 ' CE1' ' HG3' ' A' ' 44' ' ' ARG . 2.7 t80 -71.77 -33.44 68.61 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.591 -0.693 . . . . 0.0 110.246 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.7 p -58.26 -48.19 81.2 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.302 -0.874 . . . . 0.0 110.383 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.3 t -68.55 -38.65 80.97 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.223 -0.923 . . . . 0.0 110.324 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.16 -31.03 71.63 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.235 -0.916 . . . . 0.0 110.367 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.605 HD21 ' HB2' ' B' ' 23' ' ' ALA . 0.5 OUTLIER -69.25 -43.27 74.31 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.243 -0.911 . . . . 0.0 110.326 -179.823 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.453 ' CZ ' ' HB ' ' A' ' 6' ' ' THR . 29.5 m-85 . . . . . 0 N--CA 1.492 1.639 0 O-C-N 121.185 -0.947 . . . . 0.0 110.236 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.199 0.523 . . . . 0.0 110.231 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.418 ' HA ' HG21 ' A' ' 16' ' ' ILE . 8.6 ttpt -58.19 -47.29 83.87 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.183 -0.948 . . . . 0.0 110.101 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.69 -37.8 74.11 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.197 -0.939 . . . . 0.0 110.128 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -63.65 -40.21 96.28 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.183 -0.948 . . . . 0.0 110.217 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . 0.59 ' HB2' HD12 ' A' ' 16' ' ' ILE . . . -62.43 -43.07 99.69 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.284 -0.885 . . . . 0.0 110.036 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 87.4 t -62.71 -40.36 88.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.176 -0.952 . . . . 0.0 109.753 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.64 -36.3 82.38 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.421 -0.799 . . . . 0.0 110.182 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 34.8 m -69.85 -40.22 75.92 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.269 -0.894 . . . . 0.0 110.252 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.797 HG11 HD11 ' A' ' 33' ' ' LEU . 57.6 t -69.01 -41.74 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.254 -0.904 . . . . 0.0 110.243 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 18.6 t -60.9 -44.41 97.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.286 -0.884 . . . . 0.0 110.101 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.35 -44.77 93.89 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.235 -0.915 . . . . 0.0 110.197 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.93 -45.76 87.78 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.237 -0.914 . . . . 0.0 110.082 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.57 HG23 ' O ' ' B' ' 16' ' ' VAL . 88.3 t -61.45 -47.23 94.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.349 -0.844 . . . . 0.0 110.16 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . 0.54 ' HA ' ' HD3' ' B' ' 24' ' ' ARG . 15.0 t70 -55.72 -31.89 62.88 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.124 -0.985 . . . . 0.0 109.709 179.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -64.35 -36.49 84.3 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.422 -0.799 . . . . 0.0 110.353 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . 0.605 ' HB2' HD21 ' A' ' 67' ' ' LEU . . . -60.33 -40.38 90.42 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.33 -0.856 . . . . 0.0 110.451 -179.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . 0.54 ' HD3' ' HA ' ' B' ' 21' ' ' ASP . 0.2 OUTLIER . . . . . 0 N--CA 1.493 1.693 0 O-C-N 121.082 -1.011 . . . . 0.0 109.726 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.424 HG22 ' OH ' ' A' ' 68' ' ' TYR . 1.2 m . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 121.144 0.497 . . . . 0.0 110.171 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.74 -40.39 97.07 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.267 -0.896 . . . . 0.0 109.264 179.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -54.31 -34.44 60.96 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.541 -0.724 . . . . 0.0 109.459 179.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -60.08 -40.86 91.02 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.428 -0.795 . . . . 0.0 110.213 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.63 HG12 ' HD2' ' A' ' 14' ' ' PHE . 96.3 t -58.16 -42.42 83.2 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.052 -1.03 . . . . 0.0 109.453 179.514 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.528 HG23 ' HE1' ' A' ' 60' ' ' TYR . 75.3 mt -62.42 -49.29 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.394 -0.816 . . . . 0.0 109.368 179.292 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.09 -46.68 87.66 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.425 -0.797 . . . . 0.0 109.259 179.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 45.4 m -63.35 -40.41 97.2 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.339 -0.851 . . . . 0.0 109.223 179.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.63 ' HD2' HG12 ' A' ' 10' ' ' VAL . 1.6 m-85 -68.5 -41.2 80.38 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.396 -0.815 . . . . 0.0 109.569 179.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.18 -45.95 68.73 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.287 -0.883 . . . . 0.0 109.425 179.477 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.423 HG21 ' HA ' ' B' ' 9' ' ' LYS . 9.6 mt -58.24 -44.58 88.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.314 -0.866 . . . . 0.0 109.286 179.361 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.441 HD21 HD12 ' A' ' 33' ' ' LEU . 4.5 mp -64.97 -39.0 92.82 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.374 -0.829 . . . . 0.0 109.796 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.624 ' HB2' ' HB ' ' A' ' 24' ' ' ILE . . . -81.62 9.66 7.3 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.327 -0.858 . . . . 0.0 110.254 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 60.72 50.02 5.84 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.155 -0.966 . . . . 0.0 110.278 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.1 t70 59.38 58.76 2.88 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.334 -0.854 . . . . 0.0 110.43 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.9 mttp -139.68 141.67 28.82 Favored Pre-proline 0 N--CA 1.49 1.541 0 O-C-N 121.299 -0.876 . . . . 0.0 109.9 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -61.64 -11.79 21.97 Favored 'Trans proline' 0 C--N 1.304 -1.778 0 O-C-N 124.076 1.566 . . . . 0.0 109.913 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 43.4 p90 -138.92 167.45 22.0 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.35 -0.844 . . . . 0.0 110.094 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.67 HD13 ' CD2' ' A' ' 29' ' ' LEU . 9.2 tt -144.67 158.78 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.267 -0.896 . . . . 0.0 110.214 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 16.1 mt -88.14 141.36 28.62 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.277 -0.89 . . . . 0.0 110.099 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.556 ' HB2' ' CD1' ' A' ' 58' ' ' LEU . . . -58.57 -33.7 70.24 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.247 -0.908 . . . . 0.0 110.343 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -62.71 -38.81 91.93 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.205 -0.935 . . . . 0.0 110.134 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -58.59 -40.76 84.07 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.215 -0.928 . . . . 0.0 109.489 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.67 ' CD2' HD13 ' A' ' 24' ' ' ILE . 2.1 mm? -59.37 -36.06 75.06 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.319 -0.863 . . . . 0.0 109.6 179.432 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 44.0 mtt180 -69.14 -34.72 75.45 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.381 -0.824 . . . . 0.0 110.506 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.0 ttt180 -87.26 -18.01 31.21 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.289 -0.882 . . . . 0.0 111.032 -179.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -101.73 -23.66 14.19 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.98 -1.075 . . . . 0.0 110.967 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.501 ' CD2' ' HB3' ' A' ' 37' ' ' GLN . 0.1 OUTLIER -126.93 164.87 32.39 Favored Pre-proline 0 C--N 1.303 -1.455 0 O-C-N 121.019 -1.05 . . . . 0.0 110.365 -179.805 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.465 ' HD2' HD23 ' A' ' 33' ' ' LEU . 30.9 Cg_exo -58.08 138.57 86.61 Favored 'Trans proline' 0 C--N 1.302 -1.904 0 O-C-N 124.173 1.617 . . . . 0.0 109.882 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.422 ' C ' ' O ' ' A' ' 34' ' ' PRO . 16.0 Cg_exo -40.11 -40.67 2.86 Favored 'Trans proline' 0 C--N 1.303 -1.817 0 O-C-N 124.052 1.554 . . . . 0.0 110.438 -179.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.426 ' OD1' ' CD ' ' A' ' 37' ' ' GLN . 1.4 p30 -65.94 -41.77 90.86 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.242 -0.911 . . . . 0.0 110.896 -179.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.501 ' HB3' ' CD2' ' A' ' 33' ' ' LEU . 0.4 OUTLIER -69.35 -39.51 78.08 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.021 -1.049 . . . . 0.0 110.763 -179.382 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.628 ' O ' HD12 ' A' ' 42' ' ' ILE . . . -61.32 -43.53 98.71 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.135 -0.978 . . . . 0.0 110.871 -179.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -64.22 -47.67 78.81 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.064 -1.023 . . . . 0.0 110.818 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.61 -43.15 97.73 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.126 -0.984 . . . . 0.0 110.511 -179.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.447 ' O ' ' HG2' ' A' ' 45' ' ' MET . 72.7 m -65.05 -49.64 69.33 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.257 -0.902 . . . . 0.0 110.579 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.628 HD12 ' O ' ' A' ' 38' ' ' ALA . 27.5 mt -61.44 -17.6 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.156 -0.965 . . . . 0.0 110.279 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -84.64 -19.67 32.55 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.103 -0.998 . . . . 0.0 110.293 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.435 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 5.1 mmt85 -88.99 -69.69 0.69 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.179 -0.95 . . . . 0.0 110.096 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.488 ' HE2' ' CA ' ' A' ' 60' ' ' TYR . 13.7 ptp -45.65 135.35 6.1 Favored Pre-proline 0 N--CA 1.488 1.43 0 O-C-N 121.243 -0.911 . . . . 0.0 110.248 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 45' ' ' MET . 23.0 Cg_exo . . . . . 0 C--N 1.305 -1.75 0 O-C-N 123.968 1.509 . . . . 0.0 110.308 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.176 0.512 . . . . 0.0 110.091 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.556 ' CD1' ' HB2' ' A' ' 26' ' ' ALA . 1.5 mt -119.42 159.93 23.28 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.21 -0.931 . . . . 0.0 110.337 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.439 ' O ' ' HB2' ' A' ' 45' ' ' MET . 3.4 m-20 -114.44 113.58 24.68 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.29 -0.881 . . . . 0.0 110.047 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.528 ' HE1' HG23 ' A' ' 11' ' ' ILE . 18.7 p90 -77.7 -22.08 51.02 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.247 -0.908 . . . . 0.0 110.205 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.446 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.26 -36.54 68.68 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.244 -0.91 . . . . 0.0 109.958 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.02 -34.68 76.96 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.277 -0.889 . . . . 0.0 109.865 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.451 ' O ' ' HB2' ' A' ' 67' ' ' LEU . 3.3 t80 -72.06 -29.2 63.9 Favored 'General case' 0 C--N 1.298 -1.674 0 O-C-N 121.578 -0.701 . . . . 0.0 109.938 179.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.2 p -65.39 -46.73 78.93 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.355 -0.841 . . . . 0.0 110.115 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 47.5 m -66.36 -43.82 84.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.338 -0.851 . . . . 0.0 109.994 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.95 -31.91 73.38 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.341 -0.849 . . . . 0.0 110.154 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.861 HD21 ' HB2' ' B' ' 23' ' ' ALA . 0.5 OUTLIER -63.4 -41.06 98.73 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.215 -0.928 . . . . 0.0 110.248 -179.966 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.424 ' OH ' HG22 ' A' ' 6' ' ' THR . 35.0 m-85 . . . . . 0 N--CA 1.489 1.499 0 O-C-N 121.289 -0.882 . . . . 0.0 110.369 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 8.2 mmtt . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 121.173 0.511 . . . . 0.0 110.295 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.423 ' HA ' HG21 ' A' ' 16' ' ' ILE . 3.0 tttt -63.67 -33.51 75.79 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.271 -0.893 . . . . 0.0 110.213 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.53 -42.73 99.71 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.258 -0.901 . . . . 0.0 110.14 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -61.16 -41.03 96.04 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.214 -0.929 . . . . 0.0 110.085 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.51 -45.21 91.72 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.287 -0.883 . . . . 0.0 110.189 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.465 HG13 ' HG ' ' A' ' 33' ' ' LEU . 71.3 t -60.82 -42.47 92.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.297 -0.877 . . . . 0.0 110.207 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.1 -38.71 80.16 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.249 -0.907 . . . . 0.0 110.182 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 65.3 m -66.49 -38.51 87.44 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.27 -0.894 . . . . 0.0 110.075 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.925 ' O ' HG23 ' B' ' 20' ' ' VAL . 74.0 t -69.91 -46.48 73.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.332 -0.855 . . . . 0.0 110.18 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 80.2 t -58.35 -46.55 89.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.278 -0.889 . . . . 0.0 110.093 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.34 -43.68 98.26 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.268 -0.895 . . . . 0.0 110.071 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.02 -45.63 84.71 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.277 -0.89 . . . . 0.0 110.174 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.925 HG23 ' O ' ' B' ' 16' ' ' VAL . 43.2 t -59.21 -45.32 92.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.328 -0.858 . . . . 0.0 110.165 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . 0.536 ' HA ' ' HG2' ' B' ' 24' ' ' ARG . 12.8 t70 -60.52 -32.92 71.93 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.274 -0.891 . . . . 0.0 110.238 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -66.82 -40.82 88.16 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.206 -0.934 . . . . 0.0 110.478 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . 0.861 ' HB2' HD21 ' A' ' 67' ' ' LEU . . . -65.98 -42.65 89.56 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.247 -0.908 . . . . 0.0 110.961 -179.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . 0.536 ' HG2' ' HA ' ' B' ' 21' ' ' ASP . 3.0 ptp180 . . . . . 0 N--CA 1.493 1.68 0 O-C-N 121.048 -1.032 . . . . 0.0 110.76 -179.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.1 m . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 121.21 0.529 . . . . 0.0 110.213 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.82 -44.53 85.34 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.22 -0.925 . . . . 0.0 109.582 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 29.1 tp10 -54.56 -35.93 63.81 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.384 -0.822 . . . . 0.0 109.889 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -60.91 -43.02 99.16 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.376 -0.828 . . . . 0.0 110.26 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.486 HG12 ' HD2' ' A' ' 14' ' ' PHE . 45.0 t -59.98 -49.76 82.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.148 -0.97 . . . . 0.0 109.915 179.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 46.2 mt -55.08 -49.15 74.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.322 -0.861 . . . . 0.0 109.44 179.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.29 -43.26 83.02 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.297 -0.877 . . . . 0.0 109.096 179.123 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.2 m -66.7 -38.92 87.72 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.374 -0.829 . . . . 0.0 109.308 179.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.596 ' HB3' ' CE1' ' A' ' 60' ' ' TYR . 1.2 m-85 -67.83 -40.79 83.71 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.311 -0.868 . . . . 0.0 109.412 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -55.47 -48.9 73.8 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.315 -0.865 . . . . 0.0 109.526 179.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 37.7 mt -57.99 -42.2 82.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.391 -0.818 . . . . 0.0 109.917 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.505 ' CD1' ' HB3' ' A' ' 32' ' ' GLU . 2.7 mm? -65.09 -41.63 94.81 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.337 -0.852 . . . . 0.0 110.074 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.796 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -78.76 0.24 27.65 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.41 -0.806 . . . . 0.0 110.151 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.493 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 68.65 60.43 0.37 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.332 -0.855 . . . . 0.0 110.502 179.801 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.9 t70 59.04 52.34 6.38 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.202 -0.936 . . . . 0.0 110.42 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.5 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 32.8 mmtt -134.64 143.1 45.1 Favored Pre-proline 0 N--CA 1.489 1.503 0 O-C-N 121.198 -0.939 . . . . 0.0 110.07 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_endo -72.49 -1.68 10.62 Favored 'Trans proline' 0 C--N 1.305 -1.722 0 O-C-N 124.032 1.543 . . . . 0.0 109.988 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 46.9 p90 -143.92 164.38 30.73 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.276 -0.89 . . . . 0.0 110.142 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.796 HG12 ' HB2' ' A' ' 18' ' ' ALA . 0.4 OUTLIER -129.08 149.44 33.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.211 -0.931 . . . . 0.0 110.034 -179.816 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.671 ' H ' HD13 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -91.68 143.95 26.02 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.225 -0.922 . . . . 0.0 110.205 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.47 -45.44 84.81 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.29 -0.881 . . . . 0.0 110.268 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -59.42 -36.0 75.05 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.323 -0.861 . . . . 0.0 110.395 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.425 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 4.7 tt0 -65.17 -42.82 93.3 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.298 -0.876 . . . . 0.0 110.166 -179.775 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.58 HD11 HG21 ' A' ' 24' ' ' ILE . 25.3 mt -64.01 -35.7 81.58 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.201 -0.937 . . . . 0.0 109.914 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.4 ttm-85 -67.99 -34.8 77.23 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.417 -0.802 . . . . 0.0 110.104 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 22.7 ttt-85 -90.84 -26.21 19.51 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.346 -0.846 . . . . 0.0 110.661 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.505 ' HB3' ' CD1' ' A' ' 17' ' ' LEU . 3.5 mm-40 -92.33 -23.58 19.21 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.226 -0.921 . . . . 0.0 111.235 -179.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.679 HD22 ' HB3' ' A' ' 37' ' ' GLN . 0.3 OUTLIER -124.26 164.78 27.88 Favored Pre-proline 0 N--CA 1.49 1.563 0 O-C-N 120.899 -1.126 . . . . 0.0 110.526 -179.562 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.662 ' HD2' HD23 ' A' ' 33' ' ' LEU . 34.3 Cg_exo -63.44 145.46 92.37 Favored 'Trans proline' 0 C--N 1.307 -1.652 0 O-C-N 124.072 1.564 . . . . 0.0 110.178 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -43.87 -35.75 7.32 Favored 'Trans proline' 0 C--N 1.302 -1.876 0 O-C-N 124.081 1.569 . . . . 0.0 110.472 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.97 -47.38 74.79 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.089 -1.007 . . . . 0.0 110.725 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.73 ' HG2' HG22 ' B' ' 17' ' ' VAL . 1.4 mp0 -69.81 -42.96 72.99 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.112 -0.993 . . . . 0.0 110.455 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.466 ' O ' ' CG1' ' A' ' 42' ' ' ILE . . . -56.64 -44.13 80.96 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.248 -0.908 . . . . 0.0 110.476 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -63.38 -49.12 75.1 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.185 -0.947 . . . . 0.0 110.321 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -66.44 -47.93 71.59 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.232 -0.918 . . . . 0.0 110.2 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.403 ' SG ' HG21 ' B' ' 20' ' ' VAL . 71.1 m -63.95 -43.6 95.36 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.207 -0.933 . . . . 0.0 110.147 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.466 ' CG1' ' O ' ' A' ' 38' ' ' ALA . 48.6 mt -61.4 -24.01 32.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.246 -0.908 . . . . 0.0 109.998 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.62 -41.94 15.87 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.212 -0.93 . . . . 0.0 110.224 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.593 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 2.4 mmp_? -66.99 -64.3 0.88 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.193 -0.942 . . . . 0.0 110.106 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.623 ' HE1' ' HB3' ' A' ' 60' ' ' TYR . 1.9 ttm -36.04 101.59 0.22 Allowed Pre-proline 0 N--CA 1.494 1.743 0 O-C-N 121.581 -0.699 . . . . 0.0 111.029 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.434 ' HD3' ' O ' ' A' ' 44' ' ' ARG . 12.7 Cg_endo . . . . . 0 C--N 1.305 -1.746 0 O-C-N 124.0 1.526 . . . . 0.0 109.781 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.186 0.517 . . . . 0.0 110.15 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.431 ' HB3' ' HG2' ' A' ' 45' ' ' MET . 58.3 mt -122.11 156.75 32.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.253 -0.904 . . . . 0.0 110.159 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.509 ' OD1' ' HB3' ' A' ' 61' ' ' ALA . 7.3 t70 -103.91 110.98 23.32 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.135 -0.978 . . . . 0.0 110.583 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.623 ' HB3' ' HE1' ' A' ' 45' ' ' MET . 20.5 p90 -71.36 -25.93 62.59 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.208 -0.933 . . . . 0.0 109.09 179.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.581 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.16 -41.48 75.49 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.493 -0.755 . . . . 0.0 109.563 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.471 ' HB2' ' OD2' ' A' ' 59' ' ' ASP . . . -62.1 -37.5 85.3 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.301 -0.875 . . . . 0.0 109.611 179.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.593 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 2.6 t80 -71.87 -38.87 69.96 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.643 -0.661 . . . . 0.0 110.008 179.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.7 p -60.11 -47.13 87.18 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.339 -0.851 . . . . 0.0 110.294 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.41 -35.73 81.8 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.328 -0.858 . . . . 0.0 110.227 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.01 -32.74 59.54 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.289 -0.882 . . . . 0.0 110.179 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.775 HD21 ' HB2' ' B' ' 23' ' ' ALA . 0.4 OUTLIER -55.16 -38.0 67.72 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.204 -0.935 . . . . 0.0 110.278 179.962 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 . . . . . 0 N--CA 1.491 1.62 0 O-C-N 121.197 -0.939 . . . . 0.0 110.357 -179.874 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 121.241 0.543 . . . . 0.0 110.261 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.727 ' O ' HG23 ' B' ' 13' ' ' VAL . 7.5 ttmt -68.14 -33.14 73.94 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.246 -0.909 . . . . 0.0 110.188 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.7 96.96 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.255 -0.903 . . . . 0.0 110.072 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -63.5 -40.48 97.18 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.201 -0.937 . . . . 0.0 110.03 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . 0.606 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -66.7 -43.53 84.12 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.285 -0.885 . . . . 0.0 110.032 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.727 HG23 ' O ' ' B' ' 9' ' ' LYS . 59.3 t -63.08 -44.14 99.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.433 -0.792 . . . . 0.0 110.108 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.05 -41.61 92.68 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.268 -0.895 . . . . 0.0 109.921 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 99.9 m -62.6 -42.91 99.85 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.211 -0.931 . . . . 0.0 109.932 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.671 ' O ' HG23 ' B' ' 20' ' ' VAL . 56.7 t -65.17 -45.34 94.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.389 -0.819 . . . . 0.0 109.974 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.73 HG22 ' HG2' ' A' ' 37' ' ' GLN . 76.1 t -60.28 -47.01 94.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.302 -0.874 . . . . 0.0 109.883 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.3 -42.83 82.5 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.288 -0.882 . . . . 0.0 110.04 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.25 -40.63 86.27 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.348 -0.845 . . . . 0.0 109.859 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.671 HG23 ' O ' ' B' ' 16' ' ' VAL . 98.6 t -64.9 -47.28 88.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.308 -0.87 . . . . 0.0 110.113 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 54.2 t0 -64.9 -32.51 74.26 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.262 -0.899 . . . . 0.0 110.087 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -58.21 -48.32 80.71 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.233 -0.917 . . . . 0.0 110.123 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . 0.775 ' HB2' HD21 ' A' ' 67' ' ' LEU . . . -60.92 -38.89 87.36 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.318 -0.864 . . . . 0.0 110.37 -179.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 . . . . . 0 N--CA 1.492 1.65 0 O-C-N 121.169 -0.957 . . . . 0.0 110.318 -179.993 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.2 p . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.166 0.507 . . . . 0.0 110.17 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.73 -48.83 73.16 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.208 -0.932 . . . . 0.0 109.874 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.689 ' HA ' HD12 ' A' ' 11' ' ' ILE . 0.9 OUTLIER -54.75 -36.16 64.52 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.402 -0.811 . . . . 0.0 110.055 179.643 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -61.19 -43.98 98.02 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.272 -0.892 . . . . 0.0 110.226 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.541 HG12 ' HD2' ' A' ' 14' ' ' PHE . 73.2 t -58.07 -45.64 88.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.14 -0.975 . . . . 0.0 109.686 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.689 HD12 ' HA ' ' A' ' 8' ' ' GLU . 36.8 mt -58.05 -47.2 87.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.404 -0.81 . . . . 0.0 109.335 179.389 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.56 -44.01 84.92 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.324 -0.86 . . . . 0.0 108.907 179.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.515 ' HA ' ' HB1' ' B' ' 12' ' ' ALA . 46.5 m -65.23 -40.13 93.66 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.373 -0.829 . . . . 0.0 108.976 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.541 ' HD2' HG12 ' A' ' 10' ' ' VAL . 3.1 m-85 -68.53 -41.34 80.05 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.432 -0.793 . . . . 0.0 109.509 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.0 ttt180 -53.5 -45.37 69.64 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.39 -0.819 . . . . 0.0 109.547 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.489 HD12 ' HB2' ' B' ' 12' ' ' ALA . 56.0 mt -61.53 -42.98 96.07 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 O-C-N 121.285 -0.884 . . . . 0.0 109.784 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.418 HD11 HG22 ' B' ' 13' ' ' VAL . 2.7 mp -63.68 -40.47 96.9 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.34 -0.85 . . . . 0.0 109.9 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.433 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -79.53 4.72 14.93 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.377 -0.827 . . . . 0.0 110.218 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.433 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.4 OUTLIER 65.21 58.91 0.85 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.219 -0.926 . . . . 0.0 110.243 -179.986 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 54.51 63.99 1.97 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.263 -0.898 . . . . 0.0 110.345 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.1 mttp -144.86 143.12 19.87 Favored Pre-proline 0 N--CA 1.49 1.542 0 O-C-N 121.266 -0.896 . . . . 0.0 110.007 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -69.89 -4.41 14.05 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 O-C-N 124.037 1.546 . . . . 0.0 110.082 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 50.1 p90 -138.66 165.39 27.04 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.276 -0.89 . . . . 0.0 109.873 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.621 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -139.86 138.53 38.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.165 -0.959 . . . . 0.0 110.277 -179.773 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.646 HD23 ' HB2' ' A' ' 27' ' ' GLU . 5.4 tp -80.3 147.98 30.92 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.281 -0.887 . . . . 0.0 109.911 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.648 ' HB1' ' CD1' ' A' ' 42' ' ' ILE . . . -62.05 -26.85 68.5 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.233 -0.917 . . . . 0.0 110.143 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.646 ' HB2' HD23 ' A' ' 25' ' ' LEU . 4.9 mp0 -70.56 -36.21 73.51 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.334 -0.854 . . . . 0.0 110.318 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.503 ' HB2' HD11 ' A' ' 24' ' ' ILE . 10.6 mt-10 -67.91 -50.18 57.66 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.232 -0.917 . . . . 0.0 110.254 -179.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.745 HD12 ' C ' ' A' ' 29' ' ' LEU . 1.2 pp -66.54 -33.81 76.5 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.196 -0.94 . . . . 0.0 109.703 179.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.572 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -62.37 -35.73 80.05 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.36 -0.838 . . . . 0.0 109.977 179.908 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.82 -8.53 30.82 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.416 -0.802 . . . . 0.0 110.472 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -98.38 -23.27 15.67 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.1 -1.0 . . . . 0.0 110.673 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.729 HD11 HG11 ' B' ' 16' ' ' VAL . 2.9 mt -120.07 155.77 55.27 Favored Pre-proline 0 N--CA 1.488 1.453 0 O-C-N 121.159 -0.963 . . . . 0.0 110.464 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.492 ' HD2' HD23 ' A' ' 33' ' ' LEU . 51.4 Cg_exo -54.92 144.06 69.22 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 O-C-N 124.022 1.538 . . . . 0.0 110.271 179.702 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.409 ' C ' ' O ' ' A' ' 34' ' ' PRO . 26.5 Cg_endo -39.81 -42.41 3.04 Favored 'Trans proline' 0 C--N 1.304 -1.788 0 O-C-N 124.104 1.581 . . . . 0.0 110.59 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.07 -46.88 76.15 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.293 -0.88 . . . . 0.0 111.102 -179.433 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.827 ' NE2' HG13 ' B' ' 17' ' ' VAL . 33.3 mm-40 -69.53 -41.42 76.01 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.021 -1.05 . . . . 0.0 110.741 -179.291 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.572 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -56.08 -42.01 76.02 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.165 -0.96 . . . . 0.0 110.678 -179.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -60.11 -47.9 83.97 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.11 -0.994 . . . . 0.0 110.743 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -58.56 -44.23 89.65 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.189 -0.945 . . . . 0.0 110.559 -179.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 72.0 m -65.26 -42.54 93.14 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.173 -0.954 . . . . 0.0 110.358 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.648 ' CD1' ' HB1' ' A' ' 26' ' ' ALA . 1.1 mm -67.67 -21.64 27.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 O-C-N 121.259 -0.901 . . . . 0.0 110.474 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.81 -30.28 28.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.272 -0.892 . . . . 0.0 111.068 -179.303 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.553 ' HG2' ' CE1' ' A' ' 63' ' ' PHE . 1.1 mpt_? -94.32 -64.14 1.11 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.982 -1.074 . . . . 0.0 111.082 -179.229 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.562 ' CE ' ' HB3' ' A' ' 60' ' ' TYR . 5.5 ttm -30.0 112.15 0.29 Allowed Pre-proline 0 N--CA 1.497 1.886 0 O-C-N 121.796 -0.565 . . . . 0.0 111.305 -179.615 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.484 ' O ' HD23 ' A' ' 58' ' ' LEU . 18.9 Cg_endo . . . . . 0 C--N 1.308 -1.595 0 O-C-N 124.232 1.648 . . . . 0.0 110.395 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.289 0.566 . . . . 0.0 110.251 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.484 HD23 ' O ' ' A' ' 46' ' ' PRO . 1.4 mt -124.17 160.33 28.1 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.322 -0.861 . . . . 0.0 110.054 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.472 ' C ' ' HG3' ' A' ' 45' ' ' MET . 2.1 m-20 -113.91 112.03 22.68 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.144 -0.973 . . . . 0.0 110.694 -179.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.562 ' HB3' ' CE ' ' A' ' 45' ' ' MET . 14.2 p90 -73.67 -21.16 60.35 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.402 -0.811 . . . . 0.0 109.784 179.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.533 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.64 -36.73 67.34 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.36 -0.838 . . . . 0.0 109.466 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.45 -36.37 78.91 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.352 -0.842 . . . . 0.0 109.424 179.271 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.553 ' CE1' ' HG2' ' A' ' 44' ' ' ARG . 6.5 t80 -71.83 -35.42 69.9 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.787 -0.571 . . . . 0.0 110.06 179.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 32.1 t -58.35 -47.51 83.54 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.249 -0.907 . . . . 0.0 109.974 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 11.2 m -62.62 -36.9 84.26 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.197 -0.939 . . . . 0.0 109.901 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.63 -37.84 82.78 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.261 -0.899 . . . . 0.0 109.959 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.96 -42.7 90.52 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.27 -0.894 . . . . 0.0 110.123 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 . . . . . 0 N--CA 1.489 1.516 0 O-C-N 121.204 -0.935 . . . . 0.0 110.27 -179.963 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 31.7 mttp . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.248 0.547 . . . . 0.0 110.131 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.463 ' O ' HG23 ' B' ' 13' ' ' VAL . 5.4 ttpt -57.95 -49.48 76.64 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.245 -0.909 . . . . 0.0 110.121 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.88 -38.27 78.44 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.322 -0.861 . . . . 0.0 110.116 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -64.85 -40.71 95.59 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.25 -0.906 . . . . 0.0 110.102 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . 0.515 ' HB1' ' HA ' ' A' ' 13' ' ' SER . . . -66.43 -41.9 88.48 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.251 -0.906 . . . . 0.0 110.136 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.463 HG23 ' O ' ' B' ' 9' ' ' LYS . 93.2 t -61.4 -42.18 92.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.204 -0.935 . . . . 0.0 110.135 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.75 -40.87 96.65 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.262 -0.899 . . . . 0.0 110.172 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 14.6 m -62.79 -48.91 77.1 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.272 -0.892 . . . . 0.0 110.082 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.729 HG11 HD11 ' A' ' 33' ' ' LEU . 80.4 t -60.38 -47.23 93.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.25 -0.906 . . . . 0.0 110.084 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.827 HG13 ' NE2' ' A' ' 37' ' ' GLN . 58.2 t -60.58 -48.26 89.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.25 -0.906 . . . . 0.0 110.119 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.2 -44.09 92.25 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.224 -0.922 . . . . 0.0 109.943 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.23 -44.87 78.42 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.361 -0.837 . . . . 0.0 109.934 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.597 HG23 ' O ' ' B' ' 16' ' ' VAL . 99.5 t -67.26 -43.58 88.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.248 -0.907 . . . . 0.0 110.107 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -57.57 -35.8 70.84 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.282 -0.886 . . . . 0.0 110.116 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -55.03 -45.17 75.17 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.295 -0.878 . . . . 0.0 110.106 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.86 -37.32 85.85 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.347 -0.845 . . . . 0.0 110.192 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.281 -0.887 . . . . 0.0 110.108 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.218 0.533 . . . . 0.0 110.264 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.99 -46.89 88.91 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.271 -0.893 . . . . 0.0 109.843 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.846 ' HA ' HD12 ' A' ' 11' ' ' ILE . 1.8 tt0 -54.28 -36.56 63.77 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.308 -0.87 . . . . 0.0 109.536 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 10.5 tp60 -62.44 -46.34 88.97 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.328 -0.858 . . . . 0.0 109.949 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.58 HG12 ' CD2' ' A' ' 14' ' ' PHE . 38.4 t -58.7 -41.48 82.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.342 -0.849 . . . . 0.0 109.963 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.846 HD12 ' HA ' ' A' ' 8' ' ' GLU . 51.0 mt -57.92 -49.58 80.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.328 -0.858 . . . . 0.0 109.427 179.531 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.91 -38.33 75.66 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 119.573 -0.851 . . . . 0.0 108.873 178.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.1 m -68.0 -40.55 83.0 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.486 -0.759 . . . . 0.0 109.294 179.048 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.58 ' CD2' HG12 ' A' ' 10' ' ' VAL . 4.1 m-85 -68.23 -41.35 81.36 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.303 -0.873 . . . . 0.0 109.649 179.467 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -54.43 -44.82 72.77 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.284 -0.885 . . . . 0.0 109.452 179.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.415 HG21 ' HA ' ' B' ' 9' ' ' LYS . 46.4 mt -62.22 -40.97 89.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.343 -0.848 . . . . 0.0 109.83 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.407 HD13 ' HA ' ' A' ' 17' ' ' LEU . 2.9 mm? -64.74 -41.69 95.74 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.218 -0.926 . . . . 0.0 109.829 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.7 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -81.76 4.24 22.77 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.323 -0.86 . . . . 0.0 110.201 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.456 ' HB3' ' O ' ' A' ' 18' ' ' ALA . 4.9 t 65.09 64.45 0.63 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.199 -0.938 . . . . 0.0 110.278 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 54.94 60.12 3.66 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.267 -0.896 . . . . 0.0 110.368 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.573 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 18.1 mttm -141.66 142.95 27.44 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.3 -0.875 . . . . 0.0 110.01 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -76.07 2.69 6.86 Favored 'Trans proline' 0 C--N 1.304 -1.803 0 O-C-N 124.147 1.604 . . . . 0.0 110.178 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.573 ' CZ ' ' HD3' ' A' ' 21' ' ' LYS . 32.9 p90 -143.7 155.08 44.09 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.307 -0.871 . . . . 0.0 110.107 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.832 HD12 HD23 ' A' ' 29' ' ' LEU . 0.4 OUTLIER -129.18 147.88 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.268 -0.895 . . . . 0.0 110.016 -179.871 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.765 ' H ' HD13 ' A' ' 24' ' ' ILE . 8.0 mp -92.14 146.37 23.78 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.134 -0.979 . . . . 0.0 110.431 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.14 -43.02 99.53 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.345 -0.847 . . . . 0.0 110.304 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -56.28 -39.6 72.92 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.252 -0.905 . . . . 0.0 109.834 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.45 ' HG3' ' OE1' ' A' ' 32' ' ' GLU . 0.7 OUTLIER -63.66 -45.44 90.17 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.427 -0.796 . . . . 0.0 109.523 179.724 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.832 HD23 HD12 ' A' ' 24' ' ' ILE . 3.1 mm? -58.32 -34.29 70.43 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.392 -0.818 . . . . 0.0 109.72 179.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 28.1 mtp180 -69.1 -34.78 75.64 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.354 -0.842 . . . . 0.0 110.652 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 10.1 ttt180 -93.88 -25.57 17.26 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.127 -0.983 . . . . 0.0 111.085 -179.176 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.45 ' OE1' ' HG3' ' A' ' 28' ' ' GLU . 2.7 mp0 -90.91 -23.34 20.52 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.0 -1.063 . . . . 0.0 111.197 -179.162 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.783 HD23 ' HD2' ' A' ' 34' ' ' PRO . 0.3 OUTLIER -128.61 160.86 60.59 Favored Pre-proline 0 N--CA 1.489 1.492 0 O-C-N 120.94 -1.1 . . . . 0.0 110.559 -179.606 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.783 ' HD2' HD23 ' A' ' 33' ' ' LEU . 28.0 Cg_exo -58.77 144.12 98.49 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 O-C-N 124.035 1.545 . . . . 0.0 110.241 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -46.64 -30.6 9.12 Favored 'Trans proline' 0 C--N 1.304 -1.78 0 O-C-N 124.093 1.575 . . . . 0.0 110.43 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -65.75 -47.37 75.48 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.22 -0.925 . . . . 0.0 110.556 -179.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.621 ' HG2' HG22 ' B' ' 17' ' ' VAL . 2.0 mp0 -69.66 -38.32 77.05 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.197 -0.94 . . . . 0.0 110.254 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.22 -44.03 79.16 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.319 -0.863 . . . . 0.0 110.293 -179.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -64.88 -45.09 87.46 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.254 -0.904 . . . . 0.0 110.317 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -65.6 -47.21 76.48 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.166 -0.959 . . . . 0.0 110.39 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 62.8 m -65.36 -42.74 92.46 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.242 -0.911 . . . . 0.0 110.502 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 68.6 mt -71.68 -16.26 18.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.238 -0.914 . . . . 0.0 110.535 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.9 tptt -84.64 -17.55 38.25 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.221 -0.924 . . . . 0.0 110.263 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.609 ' HB2' ' CD2' ' A' ' 63' ' ' PHE . 4.9 mtt85 -105.13 -66.54 0.97 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.321 -0.862 . . . . 0.0 110.563 -179.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.536 ' HE2' ' HA ' ' A' ' 60' ' ' TYR . 3.1 ttm -26.35 108.98 0.2 Allowed Pre-proline 0 N--CA 1.499 1.985 0 O-C-N 121.877 -0.515 . . . . 0.0 111.495 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.484 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 10.8 Cg_endo . . . . . 0 C--N 1.307 -1.646 0 O-C-N 123.971 1.511 . . . . 0.0 110.227 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.435 ' HB1' ' HB2' ' A' ' 23' ' ' TYR . . . . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 121.265 0.555 . . . . 0.0 110.12 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.805 HD22 ' N ' ' A' ' 58' ' ' LEU . 3.0 mm? -92.89 160.54 14.86 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.289 -0.882 . . . . 0.0 109.965 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.533 ' N ' ' HG2' ' A' ' 45' ' ' MET . 0.7 OUTLIER -105.89 110.16 22.36 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.09 -1.006 . . . . 0.0 110.741 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.554 ' CD1' ' CB ' ' A' ' 14' ' ' PHE . 28.6 p90 -77.49 -19.26 56.16 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.93 -42.59 76.36 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.126 -0.984 . . . . 0.0 108.474 178.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.484 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -61.92 -31.96 72.32 Favored 'General case' 0 N--CA 1.488 1.444 0 CA-C-O 121.931 0.872 . . . . 0.0 108.961 178.451 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.891 ' CE1' HD12 ' A' ' 67' ' ' LEU . 25.7 t80 -60.59 -41.98 95.8 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.792 -0.567 . . . . 0.0 110.412 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.404 ' OG ' ' N ' ' A' ' 65' ' ' SER . 6.2 p -63.1 -50.68 69.56 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.147 -0.971 . . . . 0.0 110.456 -179.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.404 ' N ' ' OG ' ' A' ' 64' ' ' SER . 16.0 m -69.54 -35.68 75.67 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.145 -0.972 . . . . 0.0 110.43 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.36 -39.56 81.77 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.35 -0.844 . . . . 0.0 110.872 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.891 HD12 ' CE1' ' A' ' 63' ' ' PHE . 1.3 mt -75.09 -44.06 49.49 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.079 -1.013 . . . . 0.0 110.485 -179.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 . . . . . 0 N--CA 1.491 1.601 0 O-C-N 121.2 -0.938 . . . . 0.0 110.397 -179.822 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 121.258 0.552 . . . . 0.0 110.095 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.415 ' HA ' HG21 ' A' ' 16' ' ' ILE . 0.1 OUTLIER -66.06 -40.14 90.67 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.256 -0.903 . . . . 0.0 110.194 179.839 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.43 -43.98 79.96 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.323 -0.861 . . . . 0.0 110.113 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -60.33 -40.85 92.11 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.285 -0.884 . . . . 0.0 110.093 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.86 -45.23 82.93 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.303 -0.873 . . . . 0.0 110.14 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.857 ' O ' HG23 ' B' ' 17' ' ' VAL . 76.5 t -57.77 -42.44 81.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.292 -0.88 . . . . 0.0 110.121 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.97 -40.13 96.78 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.246 -0.909 . . . . 0.0 110.132 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 42.8 m -63.87 -43.74 95.18 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.227 -0.921 . . . . 0.0 110.16 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.574 ' O ' HG23 ' B' ' 20' ' ' VAL . 66.2 t -65.97 -43.61 92.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.263 -0.898 . . . . 0.0 110.096 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.857 HG23 ' O ' ' B' ' 13' ' ' VAL . 31.9 t -63.77 -45.83 96.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.294 -0.879 . . . . 0.0 110.111 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.13 -37.07 83.74 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.258 -0.901 . . . . 0.0 110.041 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.99 -42.68 89.5 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.301 -0.874 . . . . 0.0 110.178 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.574 HG23 ' O ' ' B' ' 16' ' ' VAL . 69.3 t -65.42 -40.73 89.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.252 -0.905 . . . . 0.0 110.141 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.75 -35.98 82.81 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.379 -0.825 . . . . 0.0 110.089 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.2 -43.62 95.78 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.402 -0.811 . . . . 0.0 110.186 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.92 -35.25 80.56 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.23 -0.919 . . . . 0.0 110.474 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 5.4 ttt180 . . . . . 0 N--CA 1.493 1.679 0 O-C-N 121.124 -0.985 . . . . 0.0 110.359 -179.829 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.835 HG22 ' OH ' ' A' ' 68' ' ' TYR . 1.7 m . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.16 0.505 . . . . 0.0 110.23 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -63.85 -47.56 80.24 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.226 -0.921 . . . . 0.0 109.814 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -54.45 -36.05 63.67 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.31 -0.869 . . . . 0.0 109.797 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -61.66 -37.6 84.63 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.346 -0.847 . . . . 0.0 110.285 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.497 HG12 ' CD2' ' A' ' 14' ' ' PHE . 17.0 t -58.15 -50.55 77.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.172 -0.955 . . . . 0.0 109.646 179.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 23.4 mt -55.01 -49.95 67.13 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 121.276 -0.89 . . . . 0.0 109.153 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.07 -39.31 78.22 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.352 -0.843 . . . . 0.0 108.739 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.46 ' HA ' ' HB1' ' B' ' 12' ' ' ALA . 72.5 m -66.84 -41.11 87.95 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.46 -0.775 . . . . 0.0 109.087 179.023 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.585 ' HB3' ' CE2' ' A' ' 60' ' ' TYR . 5.1 m-85 -67.24 -41.42 85.67 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.368 -0.832 . . . . 0.0 109.322 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.7 ttt-85 -54.52 -44.62 72.91 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.427 -0.796 . . . . 0.0 109.632 179.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.631 HD12 ' HB2' ' B' ' 12' ' ' ALA . 44.3 mt -60.93 -44.65 98.41 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.368 -0.832 . . . . 0.0 109.953 179.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.492 HD21 HG23 ' B' ' 13' ' ' VAL . 3.2 mm? -64.41 -39.78 94.5 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.224 -0.923 . . . . 0.0 109.84 179.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.504 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -77.09 -4.26 43.47 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.306 -0.871 . . . . 0.0 110.044 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.463 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 66.93 63.34 0.47 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.266 -0.896 . . . . 0.0 110.359 179.895 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 55.59 62.16 2.55 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.276 -0.89 . . . . 0.0 110.432 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.504 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 19.3 mttt -144.73 143.89 22.72 Favored Pre-proline 0 N--CA 1.49 1.563 0 O-C-N 121.329 -0.857 . . . . 0.0 109.887 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -73.72 -0.25 9.13 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 O-C-N 123.938 1.494 . . . . 0.0 110.094 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 13.6 p90 -146.38 155.66 42.76 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.286 -0.884 . . . . 0.0 110.283 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.656 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -124.18 142.22 41.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.427 -0.795 . . . . 0.0 109.754 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.656 ' N ' HD13 ' A' ' 24' ' ' ILE . 3.8 mp -80.23 136.54 36.48 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.136 -0.977 . . . . 0.0 110.003 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.32 -41.02 96.33 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.268 -0.895 . . . . 0.0 109.912 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.15 -42.77 77.49 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.38 -0.825 . . . . 0.0 109.541 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.449 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 64.0 tt0 -69.41 -42.39 75.13 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.501 -0.749 . . . . 0.0 109.648 179.541 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.663 HD21 ' CB ' ' A' ' 41' ' ' CYS . 1.2 tp -62.56 -41.4 98.89 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.412 -0.805 . . . . 0.0 108.92 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.936 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -62.43 -33.65 75.22 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.652 -0.655 . . . . 0.0 110.257 179.619 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.3 ttm180 -96.72 -24.8 15.79 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.355 -0.841 . . . . 0.0 111.504 -179.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.449 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 7.7 mm-40 -80.06 -21.55 43.3 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.815 -1.178 . . . . 0.0 111.073 -179.088 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.535 HD23 ' HD3' ' A' ' 34' ' ' PRO . 7.3 mt -116.72 169.65 6.96 Favored Pre-proline 0 C--N 1.303 -1.426 0 O-C-N 120.939 -1.101 . . . . 0.0 111.164 -179.076 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.558 ' CB ' ' HD2' ' A' ' 35' ' ' PRO . 35.3 Cg_exo -58.41 -149.39 0.01 OUTLIER 'Trans proline' 0 C--N 1.307 -1.62 0 O-C-N 124.225 1.645 . . . . 0.0 109.984 179.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.558 ' HD2' ' CB ' ' A' ' 34' ' ' PRO . 10.8 Cg_endo -96.24 -44.19 0.02 OUTLIER 'Trans proline' 0 C--N 1.308 -1.603 0 O-C-N 123.647 1.34 . . . . 0.0 110.451 179.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.2 -41.17 90.57 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.309 -0.869 . . . . 0.0 111.096 -179.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.774 ' HG2' HG22 ' B' ' 17' ' ' VAL . 10.7 mp0 -69.68 -44.82 69.67 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.061 -1.024 . . . . 0.0 111.011 -179.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.936 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -62.58 -46.76 86.85 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.306 -0.871 . . . . 0.0 110.769 -179.391 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 15.0 tm0? -65.86 -43.99 86.79 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.177 -0.952 . . . . 0.0 111.067 -179.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -65.51 -42.39 92.1 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.065 -1.022 . . . . 0.0 110.631 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.663 ' CB ' HD21 ' A' ' 29' ' ' LEU . 34.9 m -58.08 -50.51 73.2 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.189 -0.944 . . . . 0.0 110.548 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.438 HD12 ' O ' ' A' ' 38' ' ' ALA . 0.5 OUTLIER -58.4 -22.36 19.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.107 -0.995 . . . . 0.0 110.131 -179.924 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -82.15 -15.41 53.43 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.136 -0.978 . . . . 0.0 110.609 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.55 ' HG3' ' CE1' ' A' ' 63' ' ' PHE . 0.8 OUTLIER -113.68 -60.03 1.94 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.033 -1.042 . . . . 0.0 110.682 -179.818 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.564 ' CE ' ' HB3' ' A' ' 60' ' ' TYR . 3.0 ttm -35.3 100.37 0.19 Allowed Pre-proline 0 N--CA 1.495 1.804 0 O-C-N 121.547 -0.72 . . . . 0.0 111.085 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.504 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 18.7 Cg_exo . . . . . 0 C--N 1.305 -1.757 0 O-C-N 124.099 1.578 . . . . 0.0 110.073 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.667 ' C ' HD22 ' A' ' 58' ' ' LEU . . . . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 121.353 0.597 . . . . 0.0 110.361 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.786 HD22 ' N ' ' A' ' 58' ' ' LEU . 3.3 mm? -105.94 160.29 15.38 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.25 -0.907 . . . . 0.0 109.511 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.483 ' C ' ' HG3' ' A' ' 45' ' ' MET . 1.7 m-20 -113.71 111.02 21.12 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.111 -0.993 . . . . 0.0 111.055 -179.365 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.585 ' CE2' ' HB3' ' A' ' 14' ' ' PHE . 15.6 p90 -76.35 -22.76 54.49 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.376 -0.828 . . . . 0.0 109.901 179.422 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.55 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.79 -38.91 70.56 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.341 -0.849 . . . . 0.0 109.632 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.504 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -68.3 -34.68 76.6 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.208 -0.932 . . . . 0.0 109.424 179.376 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.55 ' CE1' ' HG3' ' A' ' 44' ' ' ARG . 4.4 t80 -72.0 -35.84 69.57 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.655 -0.653 . . . . 0.0 110.044 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.5 p -60.83 -49.88 75.71 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.234 -0.916 . . . . 0.0 110.333 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 66.0 p -64.98 -43.84 91.28 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.162 -0.962 . . . . 0.0 110.218 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.48 -31.63 69.52 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.305 -0.872 . . . . 0.0 110.216 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.572 ' CD2' ' HB2' ' B' ' 23' ' ' ALA . 0.6 OUTLIER -65.61 -36.97 85.27 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.203 -0.935 . . . . 0.0 110.202 -179.926 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.835 ' OH ' HG22 ' A' ' 6' ' ' THR . 11.1 m-85 . . . . . 0 N--CA 1.491 1.596 0 O-C-N 121.291 -0.881 . . . . 0.0 110.203 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.279 0.562 . . . . 0.0 110.17 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.76 -45.3 94.5 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.164 -0.96 . . . . 0.0 110.15 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.9 -35.72 69.3 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.232 -0.917 . . . . 0.0 110.042 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -65.26 -45.49 84.34 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.259 -0.901 . . . . 0.0 110.126 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . 0.631 ' HB2' HD12 ' A' ' 16' ' ' ILE . . . -62.91 -39.16 93.72 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.248 -0.907 . . . . 0.0 110.106 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.771 ' O ' HG23 ' B' ' 17' ' ' VAL . 25.1 t -62.45 -42.73 96.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.357 -0.839 . . . . 0.0 110.154 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.7 -40.24 83.06 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.264 -0.898 . . . . 0.0 110.097 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.3 m -62.36 -48.19 80.88 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.32 -0.863 . . . . 0.0 110.203 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.407 ' O ' HG23 ' B' ' 20' ' ' VAL . 46.7 t -64.07 -43.62 97.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.247 -0.908 . . . . 0.0 110.268 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.774 HG22 ' HG2' ' A' ' 37' ' ' GLN . 45.2 t -63.01 -49.31 84.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.244 -0.91 . . . . 0.0 110.317 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.34 -32.67 74.15 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.186 -0.946 . . . . 0.0 110.305 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.47 -44.88 77.53 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.198 -0.939 . . . . 0.0 110.411 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.407 HG23 ' O ' ' B' ' 16' ' ' VAL . 97.6 t -67.17 -42.52 88.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.237 -0.914 . . . . 0.0 110.361 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -65.14 -31.73 73.07 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.255 -0.903 . . . . 0.0 110.447 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -64.16 -49.54 71.7 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.173 -0.954 . . . . 0.0 110.573 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . 0.572 ' HB2' ' CD2' ' A' ' 67' ' ' LEU . . . -65.19 -34.69 78.97 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.101 -0.999 . . . . 0.0 110.505 -179.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.7 ttp85 . . . . . 0 N--CA 1.492 1.629 0 O-C-N 121.289 -0.882 . . . . 0.0 110.634 -179.681 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.64 ' CG2' ' CZ ' ' A' ' 68' ' ' TYR . 31.3 m . . . . . 0 N--CA 1.493 1.691 0 CA-C-O 121.336 0.588 . . . . 0.0 109.985 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.7 -38.29 89.83 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.181 -0.949 . . . . 0.0 109.098 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -59.14 -35.05 72.81 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.585 -0.697 . . . . 0.0 109.57 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.408 ' O ' ' OG ' ' A' ' 13' ' ' SER . 1.8 tt0 -60.87 -44.29 97.25 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.338 -0.851 . . . . 0.0 110.311 -179.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.44 HG12 ' CD2' ' A' ' 14' ' ' PHE . 95.7 t -65.66 -41.46 90.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 120.978 -1.076 . . . . 0.0 109.846 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 75.2 mt -65.54 -47.47 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.273 -0.892 . . . . 0.0 109.448 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.76 -45.99 85.16 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.338 -0.851 . . . . 0.0 108.763 179.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.498 ' HB2' ' CG2' ' B' ' 16' ' ' VAL . 1.5 p -63.12 -42.98 99.63 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.416 -0.803 . . . . 0.0 108.949 178.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.44 ' CD2' HG12 ' A' ' 10' ' ' VAL . 1.1 m-85 -63.61 -41.8 98.28 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.319 -0.863 . . . . 0.0 109.266 179.2 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.625 ' NH2' ' CE2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -55.98 -41.49 74.86 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.482 -0.761 . . . . 0.0 109.321 179.14 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.642 HD12 ' HB2' ' B' ' 12' ' ' ALA . 77.1 mt -61.82 -45.08 99.47 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 O-C-N 121.355 -0.84 . . . . 0.0 109.953 179.545 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.447 HD22 ' HB3' ' A' ' 32' ' ' GLU . 19.9 mt -65.09 -41.31 95.12 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.183 -0.948 . . . . 0.0 110.092 179.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.492 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -73.52 -0.26 14.57 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.253 -0.905 . . . . 0.0 110.229 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.476 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 0.1 OUTLIER 56.71 54.59 7.13 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.216 -0.927 . . . . 0.0 110.381 179.834 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.476 ' HB2' ' O ' ' A' ' 19' ' ' SER . 0.8 OUTLIER 58.43 45.25 16.93 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.255 -0.903 . . . . 0.0 110.384 179.765 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.533 ' O ' ' NH2' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -113.15 145.78 33.86 Favored Pre-proline 0 N--CA 1.494 1.746 0 O-C-N 121.15 -0.969 . . . . 0.0 110.267 179.849 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.576 ' HG2' ' CE2' ' A' ' 23' ' ' TYR . 12.3 Cg_endo -61.25 -11.39 18.92 Favored 'Trans proline' 0 C--N 1.303 -1.838 0 O-C-N 123.971 1.511 . . . . 0.0 109.843 179.292 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.576 ' CE2' ' HG2' ' A' ' 22' ' ' PRO . 8.4 p90 -150.2 170.82 18.05 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.243 -0.911 . . . . 0.0 110.292 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.827 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.3 OUTLIER -123.11 145.09 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.329 -0.857 . . . . 0.0 109.878 179.906 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.827 ' N ' HD13 ' A' ' 24' ' ' ILE . 0.4 OUTLIER -94.44 146.75 23.86 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.157 -0.964 . . . . 0.0 110.281 -179.739 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.514 ' HB2' HD11 ' A' ' 58' ' ' LEU . . . -62.42 -34.49 76.87 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.214 -0.929 . . . . 0.0 110.009 179.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -70.43 -34.17 72.16 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.357 -0.84 . . . . 0.0 110.223 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.48 ' O ' ' HG2' ' A' ' 32' ' ' GLU . 1.5 tp10 -66.32 -50.94 61.94 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.334 -0.854 . . . . 0.0 110.297 -179.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.875 HD12 ' N ' ' A' ' 30' ' ' ARG . 4.4 pp -66.94 -33.57 75.86 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.086 -1.009 . . . . 0.0 109.081 179.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.875 ' N ' HD12 ' A' ' 29' ' ' LEU . 4.6 mtt-85 -55.82 -34.8 65.69 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.432 -0.793 . . . . 0.0 109.795 179.304 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -92.81 -18.68 22.57 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.366 -0.834 . . . . 0.0 110.373 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 28' ' ' GLU . 43.8 mm-40 -92.35 -23.32 19.28 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.122 -0.986 . . . . 0.0 110.53 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.605 HD22 ' HB3' ' A' ' 37' ' ' GLN . 0.5 OUTLIER -122.62 144.28 42.03 Favored Pre-proline 0 N--CA 1.487 1.388 0 O-C-N 121.158 -0.964 . . . . 0.0 110.342 -179.791 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.441 ' O ' ' C ' ' A' ' 35' ' ' PRO . 2.4 Cg_endo -46.42 136.54 15.34 Favored 'Trans proline' 0 C--N 1.305 -1.743 0 O-C-N 123.945 1.497 . . . . 0.0 109.67 179.545 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.441 ' C ' ' O ' ' A' ' 34' ' ' PRO . 26.5 Cg_exo -38.07 -37.75 0.66 Allowed 'Trans proline' 0 C--N 1.304 -1.78 0 O-C-N 124.112 1.585 . . . . 0.0 110.784 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -65.93 -47.64 74.04 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.242 -0.911 . . . . 0.0 110.862 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.605 ' HB3' HD22 ' A' ' 33' ' ' LEU . 2.2 mp0 -70.31 -45.55 66.02 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.176 -0.953 . . . . 0.0 110.714 -179.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.72 ' HB1' ' CD1' ' A' ' 29' ' ' LEU . . . -55.98 -44.74 78.83 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.279 -0.888 . . . . 0.0 110.663 -179.45 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.8 -40.29 79.55 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.238 -0.914 . . . . 0.0 110.664 -179.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.11 -45.43 85.17 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.159 -0.963 . . . . 0.0 110.573 -179.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.51 ' O ' ' HG2' ' A' ' 45' ' ' MET . 49.2 m -65.29 -51.44 60.69 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.178 -0.951 . . . . 0.0 110.731 -179.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.589 HD11 ' HG3' ' A' ' 30' ' ' ARG . 97.3 mt -45.26 -27.89 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.098 -1.001 . . . . 0.0 110.29 -179.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.8 tttp -86.14 -37.36 18.84 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.307 -0.871 . . . . 0.0 110.245 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.598 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 19.1 mmt180 -69.11 -76.47 0.09 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.358 -0.839 . . . . 0.0 110.75 -179.491 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.559 ' CB ' ' O ' ' A' ' 59' ' ' ASP . 2.8 ptp -39.42 102.73 0.26 Allowed Pre-proline 0 N--CA 1.493 1.675 0 O-C-N 121.417 -0.802 . . . . 0.0 110.41 -179.225 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.958 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 13.6 Cg_endo . . . . . 0 C--N 1.307 -1.634 0 O-C-N 124.448 1.762 . . . . 0.0 110.986 -179.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.405 ' HB1' ' HB2' ' A' ' 23' ' ' TYR . . . . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 121.386 0.612 . . . . 0.0 110.354 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.514 HD11 ' HB2' ' A' ' 26' ' ' ALA . 64.8 mt -132.7 153.48 51.1 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.277 -0.889 . . . . 0.0 109.666 179.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.559 ' O ' ' CB ' ' A' ' 45' ' ' MET . 12.6 t0 -86.98 109.62 19.5 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.033 -1.042 . . . . 0.0 110.326 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.625 ' CE2' ' NH2' ' A' ' 15' ' ' ARG . 26.1 p90 -83.57 -21.96 32.49 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.327 -0.858 . . . . 0.0 109.123 179.17 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.429 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -67.46 -37.72 83.36 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.454 -0.779 . . . . 0.0 109.548 179.472 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.958 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -63.66 -33.02 74.7 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.148 -0.97 . . . . 0.0 109.846 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.598 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 4.1 t80 -71.84 -34.48 69.32 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.503 -0.748 . . . . 0.0 110.163 179.699 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 33.7 p -66.44 -49.77 65.61 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.238 -0.914 . . . . 0.0 110.458 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.74 -39.56 93.83 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.202 -0.936 . . . . 0.0 110.308 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.88 -36.38 80.15 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.246 -0.909 . . . . 0.0 110.329 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.563 HD21 ' O ' ' B' ' 19' ' ' ALA . 0.4 OUTLIER -58.57 -42.25 87.55 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.162 -0.961 . . . . 0.0 110.251 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.64 ' CZ ' ' CG2' ' A' ' 6' ' ' THR . 10.5 m-85 . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.316 -0.865 . . . . 0.0 110.218 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 121.169 0.509 . . . . 0.0 110.241 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.557 ' HA ' HG21 ' A' ' 16' ' ' ILE . 0.6 OUTLIER -58.19 -44.54 88.12 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.166 -0.959 . . . . 0.0 110.051 179.859 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.98 -34.89 78.48 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.266 -0.897 . . . . 0.0 109.982 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -65.55 -40.41 92.83 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.259 -0.9 . . . . 0.0 109.924 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . 0.706 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -62.89 -39.38 94.3 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.322 -0.861 . . . . 0.0 109.871 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.841 ' O ' HG23 ' B' ' 17' ' ' VAL . 99.4 t -60.37 -41.59 87.86 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.349 -0.844 . . . . 0.0 109.883 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.78 -42.27 95.22 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.321 -0.862 . . . . 0.0 110.061 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 22.2 m -61.91 -46.07 90.96 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.215 -0.928 . . . . 0.0 110.061 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.706 HG23 ' O ' ' B' ' 12' ' ' ALA . 21.1 t -64.39 -41.76 93.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.228 -0.92 . . . . 0.0 110.014 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.841 HG23 ' O ' ' B' ' 13' ' ' VAL . 91.0 t -60.09 -46.23 94.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.275 -0.891 . . . . 0.0 110.136 179.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.17 -42.21 98.17 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.238 -0.913 . . . . 0.0 110.18 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.563 ' O ' HD21 ' A' ' 67' ' ' LEU . . . -65.37 -43.82 89.52 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.256 -0.902 . . . . 0.0 110.212 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.507 HG22 ' HZ ' ' A' ' 63' ' ' PHE . 55.7 t -67.46 -45.57 85.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.256 -0.902 . . . . 0.0 110.169 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -57.25 -33.47 67.62 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.349 -0.844 . . . . 0.0 110.241 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.03 -45.88 90.22 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.248 -0.908 . . . . 0.0 110.211 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -58.51 -35.02 71.61 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.175 -0.953 . . . . 0.0 110.198 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 44.7 ttt180 . . . . . 0 N--CA 1.491 1.589 0 O-C-N 121.218 -0.926 . . . . 0.0 110.185 -179.99 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.994 HG22 ' CE2' ' A' ' 68' ' ' TYR . 1.9 m . . . . . 0 N--CA 1.491 1.621 0 CA-C-O 121.181 0.515 . . . . 0.0 110.375 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -68.36 -39.6 81.76 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.258 -0.901 . . . . 0.0 109.831 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.62 ' HA ' HD12 ' A' ' 11' ' ' ILE . 5.8 tm-20 -67.39 -36.45 81.33 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.392 -0.817 . . . . 0.0 109.9 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 6.0 tp60 -61.29 -45.97 92.24 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.327 -0.858 . . . . 0.0 110.139 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.747 HG12 ' HD2' ' A' ' 14' ' ' PHE . 75.6 t -58.05 -44.88 88.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.24 -0.913 . . . . 0.0 110.071 179.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.62 HD12 ' HA ' ' A' ' 8' ' ' GLU . 73.1 mt -54.78 -48.51 73.12 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.239 -0.913 . . . . 0.0 109.716 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.74 -42.67 84.39 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.173 -0.954 . . . . 0.0 109.099 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.438 ' HB2' ' CG2' ' B' ' 16' ' ' VAL . 2.2 m -68.1 -39.75 82.77 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.496 -0.753 . . . . 0.0 109.356 179.134 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.747 ' HD2' HG12 ' A' ' 10' ' ' VAL . 2.4 m-85 -68.58 -42.09 78.73 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.307 -0.871 . . . . 0.0 109.528 179.293 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.3 ttt-85 -53.34 -46.78 69.63 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.284 -0.885 . . . . 0.0 109.42 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.604 HD12 ' HB2' ' B' ' 12' ' ' ALA . 37.8 mt -59.42 -42.54 87.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.352 -0.842 . . . . 0.0 109.571 179.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.663 HD11 ' CG2' ' B' ' 13' ' ' VAL . 4.4 mp -63.99 -41.55 97.47 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.358 -0.839 . . . . 0.0 109.806 179.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.632 ' HB1' ' O ' ' A' ' 23' ' ' TYR . . . -74.45 -2.81 27.19 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.342 -0.849 . . . . 0.0 110.141 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.43 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.3 OUTLIER 65.29 74.69 0.38 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.263 -0.898 . . . . 0.0 110.258 -179.921 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.8 t0 49.04 59.08 4.7 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.264 -0.897 . . . . 0.0 110.317 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.583 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 11.2 mttt -148.6 144.81 18.88 Favored Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.19 -0.944 . . . . 0.0 110.169 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -77.25 4.33 5.96 Favored 'Trans proline' 0 C--N 1.305 -1.748 0 O-C-N 124.063 1.559 . . . . 0.0 110.117 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.632 ' O ' ' HB1' ' A' ' 18' ' ' ALA . 48.8 p90 -148.99 175.34 11.39 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.208 -0.932 . . . . 0.0 110.319 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.6 tt -151.33 156.96 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.274 -0.891 . . . . 0.0 110.119 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.2 mp -89.26 149.05 23.25 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.264 -0.897 . . . . 0.0 110.258 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.502 ' O ' ' HG ' ' A' ' 29' ' ' LEU . . . -58.03 -34.79 70.45 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.27 -0.894 . . . . 0.0 110.028 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -70.76 -34.11 71.49 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.269 -0.894 . . . . 0.0 110.018 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.453 ' O ' ' CG ' ' A' ' 32' ' ' GLU . 3.8 tp10 -62.5 -50.97 69.27 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.3 -0.875 . . . . 0.0 110.513 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.769 HD12 ' C ' ' A' ' 29' ' ' LEU . 3.5 pp -66.98 -33.16 74.96 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.006 -1.059 . . . . 0.0 109.295 179.444 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.76 ' N ' HD12 ' A' ' 29' ' ' LEU . 3.2 ttt85 -58.18 -34.75 70.68 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.394 -0.816 . . . . 0.0 109.61 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.8 ttt180 -91.62 -29.85 16.67 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.433 -0.792 . . . . 0.0 110.196 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.453 ' CG ' ' O ' ' A' ' 28' ' ' GLU . 5.0 mm-40 -82.2 -23.56 35.39 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.174 -0.954 . . . . 0.0 110.26 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.755 HD23 ' HD2' ' A' ' 34' ' ' PRO . 6.5 mt -119.96 146.9 43.15 Favored Pre-proline 0 N--CA 1.489 1.476 0 O-C-N 121.257 -0.902 . . . . 0.0 110.094 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.755 ' HD2' HD23 ' A' ' 33' ' ' LEU . 1.1 Cg_endo -53.67 158.19 8.62 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 O-C-N 123.938 1.493 . . . . 0.0 110.284 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -50.54 -39.44 55.35 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 124.108 1.583 . . . . 0.0 110.69 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.97 -46.46 81.39 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.21 -0.932 . . . . 0.0 110.445 -179.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.574 ' CB ' HD22 ' A' ' 33' ' ' LEU . 58.5 mm-40 -69.66 -38.33 77.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.25 -0.906 . . . . 0.0 110.686 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.617 ' HA ' HD13 ' A' ' 29' ' ' LEU . . . -57.46 -42.12 81.91 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.203 -0.936 . . . . 0.0 110.798 -179.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.5 tp60 -60.69 -47.08 87.87 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.179 -0.951 . . . . 0.0 110.692 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -66.0 -43.87 86.49 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.21 -0.931 . . . . 0.0 110.586 -179.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.453 ' HB3' HD22 ' A' ' 29' ' ' LEU . 3.2 m -62.67 -42.91 99.88 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.223 -0.923 . . . . 0.0 111.005 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.73 HG13 HD21 ' A' ' 29' ' ' LEU . 68.6 mt -75.2 -12.35 14.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.067 -1.021 . . . . 0.0 110.524 -179.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.88 -16.07 49.01 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.23 -0.919 . . . . 0.0 111.129 -179.359 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.514 ' O ' ' C ' ' A' ' 45' ' ' MET . 1.1 mpp_? -117.26 -56.66 2.22 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.086 -1.009 . . . . 0.0 110.997 -179.479 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.539 ' HE2' ' HA ' ' A' ' 60' ' ' TYR . 3.9 ttm -29.48 94.52 0.06 OUTLIER Pre-proline 0 N--CA 1.498 1.964 0 O-C-N 121.691 -0.63 . . . . 0.0 111.531 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.471 ' N ' ' O ' ' A' ' 44' ' ' ARG . 11.5 Cg_endo . . . . . 0 C--N 1.307 -1.641 0 O-C-N 124.121 1.59 . . . . 0.0 110.363 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.565 ' C ' HD22 ' A' ' 58' ' ' LEU . . . . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 121.293 0.568 . . . . 0.0 110.227 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.849 HD22 ' N ' ' A' ' 58' ' ' LEU . 2.1 mm? -112.77 156.4 22.91 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.226 -0.921 . . . . 0.0 109.785 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.485 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.6 OUTLIER -111.53 110.46 20.89 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.068 -1.02 . . . . 0.0 110.441 -179.855 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.539 ' HA ' ' HE2' ' A' ' 45' ' ' MET . 18.4 p90 -75.02 -21.75 58.89 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.263 -0.898 . . . . 0.0 109.593 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.519 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.9 -39.15 71.17 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.295 -0.878 . . . . 0.0 109.457 179.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.47 -32.33 73.2 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.34 -0.85 . . . . 0.0 109.087 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.473 ' O ' ' HB3' ' A' ' 67' ' ' LEU . 2.0 t80 -61.78 -38.53 88.39 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-O 121.192 0.52 . . . . 0.0 110.35 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 25.1 m -56.79 -49.67 74.62 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.329 -0.857 . . . . 0.0 110.825 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.0 m -66.18 -36.16 82.36 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.076 -1.015 . . . . 0.0 110.74 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.88 -30.12 56.08 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.145 -0.972 . . . . 0.0 110.842 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.543 ' O ' HD12 ' A' ' 67' ' ' LEU . 0.3 OUTLIER -78.18 -46.77 19.64 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.066 -1.021 . . . . 0.0 109.945 -179.632 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.994 ' CE2' HG22 ' A' ' 6' ' ' THR . 12.4 m-85 . . . . . 0 N--CA 1.492 1.652 0 C-N-CA 119.939 -0.705 . . . . 0.0 110.463 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.44 ' HE3' HD13 ' A' ' 16' ' ' ILE . 1.5 ttpt . . . . . 0 N--CA 1.492 1.649 0 CA-C-O 121.142 0.496 . . . . 0.0 110.143 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 1.4 ttmt -58.75 -40.25 83.29 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.122 -0.986 . . . . 0.0 110.001 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.06 -35.43 80.21 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.24 -0.912 . . . . 0.0 109.888 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.6 tm-20 -65.96 -40.32 91.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.373 -0.83 . . . . 0.0 110.144 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . 0.604 ' HB2' HD12 ' A' ' 16' ' ' ILE . . . -62.54 -41.76 99.09 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.338 -0.851 . . . . 0.0 110.068 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.766 ' O ' HG23 ' B' ' 17' ' ' VAL . 58.1 t -63.36 -40.55 89.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.264 -0.897 . . . . 0.0 109.892 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.77 -39.04 87.33 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.369 -0.832 . . . . 0.0 110.276 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 23.7 m -66.15 -43.67 86.36 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.212 -0.93 . . . . 0.0 110.312 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.438 ' CG2' ' HB2' ' A' ' 13' ' ' SER . 61.5 t -67.53 -40.41 84.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.283 -0.886 . . . . 0.0 110.363 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.766 HG23 ' O ' ' B' ' 13' ' ' VAL . 98.8 t -58.14 -49.0 83.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.233 -0.917 . . . . 0.0 110.498 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.44 -38.83 92.4 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.24 -0.912 . . . . 0.0 110.276 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.45 -46.04 74.24 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.261 -0.9 . . . . 0.0 110.145 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.554 HG11 ' OE1' ' A' ' 37' ' ' GLN . 83.8 t -67.49 -45.92 84.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.291 -0.881 . . . . 0.0 110.091 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . 0.401 ' HB2' ' O ' ' B' ' 17' ' ' VAL . 2.5 t70 -57.46 -38.23 74.13 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.204 -0.935 . . . . 0.0 110.194 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.27 -45.32 72.41 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.226 -0.921 . . . . 0.0 109.946 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . 0.417 ' HB2' HD13 ' A' ' 67' ' ' LEU . . . -64.52 -38.81 92.32 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.372 -0.83 . . . . 0.0 109.84 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 22.1 ttt-85 . . . . . 0 N--CA 1.49 1.573 0 O-C-N 121.232 -0.918 . . . . 0.0 109.928 179.767 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.548 ' CG2' ' CE1' ' A' ' 68' ' ' TYR . 3.4 m . . . . . 0 N--CA 1.493 1.699 0 CA-C-O 121.268 0.556 . . . . 0.0 110.076 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -66.57 -44.43 82.29 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.243 -0.91 . . . . 0.0 109.64 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -58.83 -36.52 74.65 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.482 -0.761 . . . . 0.0 109.914 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.49 -47.68 84.52 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.324 -0.86 . . . . 0.0 110.113 -179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.517 HG12 ' CD2' ' A' ' 14' ' ' PHE . 24.5 t -57.98 -51.18 73.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.289 -0.882 . . . . 0.0 109.784 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.404 HG23 ' HE1' ' A' ' 60' ' ' TYR . 16.5 mt -57.88 -49.7 80.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.392 -0.818 . . . . 0.0 109.621 179.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.91 -41.89 83.6 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.289 -0.882 . . . . 0.0 109.183 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 65.3 m -67.96 -37.09 81.14 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.392 -0.817 . . . . 0.0 109.33 179.177 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.591 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 2.1 m-85 -67.91 -44.14 77.61 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.31 -0.869 . . . . 0.0 109.644 179.452 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.68 -48.12 72.79 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.266 -0.896 . . . . 0.0 109.608 179.531 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 60.8 mt -60.33 -42.95 92.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.313 -0.867 . . . . 0.0 109.776 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.604 HD12 ' CD ' ' A' ' 32' ' ' GLU . 1.8 mm? -62.5 -40.54 97.03 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.32 -0.863 . . . . 0.0 109.915 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.486 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -82.9 7.62 14.87 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.394 -0.816 . . . . 0.0 110.295 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.486 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.8 OUTLIER 67.37 66.27 0.4 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.208 -0.933 . . . . 0.0 110.278 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.454 ' N ' ' OD1' ' A' ' 20' ' ' ASP . 1.0 OUTLIER 49.52 62.03 2.84 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.273 -0.892 . . . . 0.0 110.38 179.906 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.598 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 25.6 mttm -140.84 141.96 26.4 Favored Pre-proline 0 N--CA 1.488 1.454 0 O-C-N 121.235 -0.916 . . . . 0.0 110.074 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -72.02 -1.03 9.39 Favored 'Trans proline' 0 C--N 1.305 -1.748 0 O-C-N 124.059 1.558 . . . . 0.0 110.211 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.598 ' CZ ' ' HD3' ' A' ' 21' ' ' LYS . 39.6 p90 -142.07 162.39 35.61 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.287 -0.883 . . . . 0.0 110.035 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.832 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -128.1 140.6 48.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.151 -0.968 . . . . 0.0 110.238 -179.84 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.832 ' N ' HD13 ' A' ' 24' ' ' ILE . 1.1 mt -80.33 144.61 32.63 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.265 -0.897 . . . . 0.0 110.167 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.496 ' HA ' ' CD2' ' A' ' 29' ' ' LEU . . . -62.65 -36.54 83.16 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.338 -0.851 . . . . 0.0 110.296 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -68.25 -34.6 76.51 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.105 -0.997 . . . . 0.0 109.936 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.484 ' O ' ' CG ' ' A' ' 32' ' ' GLU . 62.2 mt-10 -65.88 -50.36 64.8 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.29 -0.881 . . . . 0.0 110.003 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.55 HD12 ' CB ' ' A' ' 38' ' ' ALA . 1.7 pp -67.2 -32.99 74.43 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.2 -0.938 . . . . 0.0 109.933 179.62 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.636 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 6.8 mtt180 -66.35 -34.16 77.35 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.28 -0.887 . . . . 0.0 110.639 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 31' ' ' ARG . 1.5 ttt180 -95.36 -25.54 16.25 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.176 -0.953 . . . . 0.0 111.614 -178.705 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.648 ' HG3' HD12 ' A' ' 33' ' ' LEU . 15.5 pt-20 -92.13 -24.16 19.19 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.815 -1.178 . . . . 0.0 111.204 -178.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.694 HD23 ' CB ' ' A' ' 37' ' ' GLN . 0.1 OUTLIER -108.63 141.89 24.27 Favored Pre-proline 0 N--CA 1.492 1.643 0 O-C-N 121.043 -1.035 . . . . 0.0 110.427 -179.972 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.423 ' O ' ' C ' ' A' ' 35' ' ' PRO . 23.1 Cg_exo -44.54 137.7 8.23 Favored 'Trans proline' 0 C--N 1.303 -1.818 0 O-C-N 124.2 1.632 . . . . 0.0 109.765 179.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.423 ' C ' ' O ' ' A' ' 34' ' ' PRO . 37.1 Cg_endo -39.6 -38.49 1.66 Allowed 'Trans proline' 0 C--N 1.305 -1.721 0 O-C-N 124.039 1.547 . . . . 0.0 110.378 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -66.21 -45.71 79.8 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.275 -0.89 . . . . 0.0 110.665 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.694 ' CB ' HD23 ' A' ' 33' ' ' LEU . 52.4 mm-40 -69.97 -42.56 73.0 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.171 -0.955 . . . . 0.0 110.797 -179.429 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.636 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -63.54 -48.76 76.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.107 -0.995 . . . . 0.0 110.521 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.9 tm0? -56.24 -43.08 78.31 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.196 -0.94 . . . . 0.0 110.499 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -66.27 -42.88 87.85 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.228 -0.92 . . . . 0.0 110.285 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 45' ' ' MET . 84.5 m -65.0 -50.93 64.38 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.273 -0.892 . . . . 0.0 110.446 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.539 ' CD1' HD21 ' A' ' 29' ' ' LEU . 19.0 mm -40.41 -32.07 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.291 -0.881 . . . . 0.0 110.325 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.48 -42.19 14.69 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.377 -0.827 . . . . 0.0 110.805 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.586 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 3.9 mmt180 -63.7 -74.71 0.09 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.205 -0.934 . . . . 0.0 110.499 -179.405 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.532 ' HE2' ' CA ' ' A' ' 60' ' ' TYR . 6.8 ptp -56.82 119.48 30.29 Favored Pre-proline 0 N--CA 1.489 1.479 0 O-C-N 121.05 -1.031 . . . . 0.0 110.2 -179.723 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 45' ' ' MET . 11.8 Cg_exo . . . . . 0 C--N 1.305 -1.726 0 O-C-N 123.972 1.511 . . . . 0.0 110.236 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.69 ' C ' HD22 ' A' ' 58' ' ' LEU . . . . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.187 0.518 . . . . 0.0 110.174 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.841 HD22 ' N ' ' A' ' 58' ' ' LEU . 2.5 mm? -116.62 159.61 21.92 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.307 -0.87 . . . . 0.0 110.08 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.453 ' O ' ' HB2' ' A' ' 45' ' ' MET . 88.1 m-20 -109.32 114.36 27.97 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.248 -0.907 . . . . 0.0 110.183 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.591 ' HB2' ' CD2' ' A' ' 14' ' ' PHE . 23.8 p90 -84.31 -24.85 29.67 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.246 -0.909 . . . . 0.0 110.094 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.501 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.26 -35.9 67.94 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.243 -0.911 . . . . 0.0 109.93 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.99 -33.0 73.8 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.289 -0.882 . . . . 0.0 109.972 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.586 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 1.8 t80 -71.66 -32.75 68.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.558 -0.714 . . . . 0.0 110.053 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.8 t -66.27 -47.31 74.08 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.279 -0.888 . . . . 0.0 110.325 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.7 t -65.51 -36.83 85.0 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.192 -0.943 . . . . 0.0 110.357 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -75.21 -28.81 60.1 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.185 -0.947 . . . . 0.0 110.272 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.824 HD21 ' HB1' ' B' ' 19' ' ' ALA . 0.4 OUTLIER -78.48 -45.25 22.54 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.214 -0.929 . . . . 0.0 109.584 179.966 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.548 ' CE1' ' CG2' ' A' ' 6' ' ' THR . 17.4 m-85 . . . . . 0 N--CA 1.492 1.627 0 O-C-N 121.485 -0.76 . . . . 0.0 110.281 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 4.8 mttt . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 121.229 0.537 . . . . 0.0 110.086 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 14.1 ttmt -61.56 -49.56 76.18 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.269 -0.894 . . . . 0.0 110.083 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.15 -38.14 67.87 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.222 -0.924 . . . . 0.0 109.945 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -66.09 -40.06 90.51 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.286 -0.884 . . . . 0.0 109.814 179.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.7 -37.05 84.95 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.32 -0.863 . . . . 0.0 110.07 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.63 ' O ' HG23 ' B' ' 17' ' ' VAL . 76.6 t -62.49 -40.85 89.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.215 -0.928 . . . . 0.0 109.826 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.28 -38.07 82.44 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.345 -0.847 . . . . 0.0 109.999 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 56.3 m -62.93 -50.33 71.24 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.37 -0.831 . . . . 0.0 110.059 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 92.8 t -62.32 -43.91 98.6 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.318 -0.864 . . . . 0.0 110.053 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.63 HG23 ' O ' ' B' ' 13' ' ' VAL . 93.5 t -59.83 -45.24 95.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.256 -0.903 . . . . 0.0 110.038 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.47 -38.06 89.69 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.179 -0.951 . . . . 0.0 110.094 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.824 ' HB1' HD21 ' A' ' 67' ' ' LEU . . . -64.66 -44.15 91.32 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.256 -0.902 . . . . 0.0 110.178 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.56 HG22 ' CZ ' ' A' ' 63' ' ' PHE . 56.4 t -66.16 -39.78 85.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.238 -0.914 . . . . 0.0 110.265 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -65.46 -31.51 72.64 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.192 -0.942 . . . . 0.0 110.234 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -62.59 -38.21 89.23 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.283 -0.885 . . . . 0.0 110.318 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.74 -39.19 93.68 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.202 -0.936 . . . . 0.0 110.38 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.642 0 O-C-N 121.246 -0.909 . . . . 0.0 109.965 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.298 0.571 . . . . 0.0 110.233 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.11 -47.69 83.48 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.235 -0.915 . . . . 0.0 109.82 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -54.4 -36.23 63.71 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.422 -0.799 . . . . 0.0 109.791 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -61.46 -44.58 96.85 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.401 -0.812 . . . . 0.0 110.281 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.544 HG12 ' CD2' ' A' ' 14' ' ' PHE . 41.7 t -62.64 -41.27 91.54 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.14 -0.975 . . . . 0.0 109.967 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 58.6 mt -59.3 -47.11 91.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.32 -0.862 . . . . 0.0 109.743 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.63 -42.59 83.69 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.265 -0.897 . . . . 0.0 109.055 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.454 ' O ' ' HB1' ' B' ' 12' ' ' ALA . 0.0 OUTLIER -67.74 -38.42 83.5 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.437 -0.789 . . . . 0.0 109.21 178.914 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.544 ' CD2' HG12 ' A' ' 10' ' ' VAL . 0.9 OUTLIER -68.42 -43.22 77.64 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.33 -0.857 . . . . 0.0 109.647 179.284 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.1 ttt180 -53.42 -46.42 69.78 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.264 -0.898 . . . . 0.0 109.565 179.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.496 HG21 ' HA ' ' B' ' 9' ' ' LYS . 42.7 mt -58.13 -45.01 88.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.23 -0.918 . . . . 0.0 109.705 179.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.447 HD11 ' CG2' ' B' ' 13' ' ' VAL . 1.3 mp -63.13 -41.65 99.35 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.396 -0.815 . . . . 0.0 109.74 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.564 ' HB2' ' HB ' ' A' ' 24' ' ' ILE . . . -75.92 -1.78 27.14 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.319 -0.863 . . . . 0.0 110.04 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 67.61 62.43 0.43 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.29 -0.881 . . . . 0.0 110.446 179.997 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' A' ' 19' ' ' SER . 87.0 m-20 54.1 61.22 3.15 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.257 -0.902 . . . . 0.0 110.362 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.418 ' HE3' ' O ' ' A' ' 18' ' ' ALA . 39.2 mtmt -149.03 142.71 16.3 Favored Pre-proline 0 N--CA 1.489 1.495 0 O-C-N 121.297 -0.877 . . . . 0.0 109.86 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -69.9 -3.57 12.37 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 O-C-N 123.981 1.516 . . . . 0.0 110.095 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 33.1 p90 -145.74 159.16 43.58 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.252 -0.905 . . . . 0.0 110.154 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.564 ' HB ' ' HB2' ' A' ' 18' ' ' ALA . 10.5 tt -136.15 153.84 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.213 -0.929 . . . . 0.0 110.216 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.438 HD23 ' HA ' ' A' ' 25' ' ' LEU . 39.9 mt -80.86 134.3 35.74 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.196 -0.94 . . . . 0.0 110.234 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.412 ' HB2' ' CD1' ' A' ' 58' ' ' LEU . . . -55.52 -40.12 71.39 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.231 -0.918 . . . . 0.0 109.875 179.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -61.68 -38.29 87.27 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.319 -0.863 . . . . 0.0 109.729 179.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.432 ' HG2' ' OE2' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -68.66 -43.73 75.59 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.297 -0.877 . . . . 0.0 109.229 179.315 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.763 ' CD1' HD12 ' A' ' 33' ' ' LEU . 0.8 OUTLIER -64.27 -39.95 94.98 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.513 -0.742 . . . . 0.0 109.199 179.124 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.639 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -58.38 -34.77 71.08 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.544 -0.722 . . . . 0.0 110.236 179.826 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.8 ttt85 -93.12 -17.93 23.2 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.258 -0.901 . . . . 0.0 110.441 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.432 ' OE2' ' HG2' ' A' ' 28' ' ' GLU . 0.4 OUTLIER -88.56 -23.25 23.2 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.168 -0.957 . . . . 0.0 110.352 -179.893 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.763 HD12 ' CD1' ' A' ' 29' ' ' LEU . 13.1 mt -123.61 143.93 42.99 Favored Pre-proline 0 C--N 1.304 -1.381 0 O-C-N 121.231 -0.918 . . . . 0.0 110.383 -179.51 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.429 ' HD2' ' HB2' ' A' ' 37' ' ' GLN . 30.3 Cg_exo -46.62 145.19 6.68 Favored 'Trans proline' 0 C--N 1.305 -1.747 0 O-C-N 123.951 1.5 . . . . 0.0 109.918 179.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.424 ' O ' ' HB2' ' A' ' 39' ' ' GLN . 27.8 Cg_endo -42.12 -40.47 6.48 Favored 'Trans proline' 0 C--N 1.304 -1.802 0 O-C-N 123.94 1.495 . . . . 0.0 110.371 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -65.77 -46.92 76.97 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.226 -0.921 . . . . 0.0 110.578 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.474 ' OE1' HG13 ' B' ' 17' ' ' VAL . 1.2 mp0 -69.41 -43.63 73.03 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.219 -0.926 . . . . 0.0 110.289 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.639 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -61.19 -48.13 82.95 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.366 -0.834 . . . . 0.0 110.5 -179.651 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.432 ' O ' ' HB2' ' A' ' 43' ' ' LYS . 9.8 tt0 -57.51 -48.04 80.34 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.174 -0.954 . . . . 0.0 110.106 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -64.02 -41.56 97.42 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.262 -0.899 . . . . 0.0 110.241 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 66.9 m -64.53 -50.77 66.04 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.212 -0.93 . . . . 0.0 110.257 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.493 HG13 HD21 ' A' ' 29' ' ' LEU . 64.2 mt -66.72 -14.42 17.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.269 -0.895 . . . . 0.0 109.955 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.541 ' HD3' ' CZ ' ' A' ' 44' ' ' ARG . 9.8 tttp -73.55 -16.23 61.27 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.379 -0.825 . . . . 0.0 110.253 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.649 ' CB ' ' CD1' ' A' ' 63' ' ' PHE . 5.1 mpt_? -119.06 -58.42 1.94 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.358 -0.839 . . . . 0.0 110.647 -179.6 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.629 ' HE2' ' HA ' ' A' ' 60' ' ' TYR . 3.9 ttm -26.96 90.99 0.05 OUTLIER Pre-proline 0 N--CA 1.499 1.994 0 O-C-N 121.973 -0.454 . . . . 0.0 111.529 -179.663 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.52 ' N ' ' O ' ' A' ' 44' ' ' ARG . 18.1 Cg_endo . . . . . 0 C--N 1.305 -1.728 0 O-C-N 124.141 1.601 . . . . 0.0 110.172 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.551 0 CA-C-O 121.284 0.564 . . . . 0.0 110.205 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.439 ' HB3' ' HG2' ' A' ' 45' ' ' MET . 45.0 mt -130.05 160.15 34.56 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.237 -0.914 . . . . 0.0 109.997 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.486 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.8 OUTLIER -113.38 110.77 20.86 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.086 -1.008 . . . . 0.0 110.706 179.925 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.629 ' HA ' ' HE2' ' A' ' 45' ' ' MET . 18.3 p90 -73.01 -28.12 62.18 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.26 -0.9 . . . . 0.0 109.512 179.283 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.612 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.09 -43.42 78.02 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.445 -0.784 . . . . 0.0 109.881 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.466 ' HB3' ' OD1' ' A' ' 59' ' ' ASP . . . -62.34 -33.3 74.44 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.252 -0.905 . . . . 0.0 109.798 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.649 ' CD1' ' CB ' ' A' ' 44' ' ' ARG . 4.0 t80 -72.12 -34.58 68.7 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.605 -0.684 . . . . 0.0 110.207 179.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.28 -49.67 74.73 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.259 -0.901 . . . . 0.0 110.388 -179.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.1 t -58.46 -39.06 78.9 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.178 -0.951 . . . . 0.0 110.293 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.06 -39.76 75.47 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.32 -0.863 . . . . 0.0 110.245 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.632 HD11 ' CZ ' ' A' ' 63' ' ' PHE . 1.8 mt -59.91 -40.04 87.44 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.24 -0.913 . . . . 0.0 110.277 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 . . . . . 0 N--CA 1.492 1.632 0 O-C-N 121.238 -0.914 . . . . 0.0 110.252 -179.922 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 121.191 0.52 . . . . 0.0 110.218 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.496 ' HA ' HG21 ' A' ' 16' ' ' ILE . 1.4 ttpt -62.39 -42.3 99.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.23 -0.919 . . . . 0.0 110.011 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.31 -36.11 75.04 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.265 -0.897 . . . . 0.0 109.911 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.42 -42.16 83.68 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.253 -0.904 . . . . 0.0 109.938 179.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . 0.561 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -62.72 -40.89 98.6 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.299 -0.875 . . . . 0.0 109.445 179.494 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.596 ' O ' HG23 ' B' ' 17' ' ' VAL . 73.7 t -63.36 -40.39 88.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.356 -0.84 . . . . 0.0 109.493 179.307 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.71 -35.82 79.15 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.39 -0.819 . . . . 0.0 110.074 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 2.4 m -70.07 -47.22 62.82 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.214 -0.929 . . . . 0.0 110.319 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.561 HG23 ' O ' ' B' ' 12' ' ' ALA . 23.1 t -62.33 -43.09 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.248 -0.908 . . . . 0.0 110.352 -179.757 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.596 HG23 ' O ' ' B' ' 13' ' ' VAL . 88.1 t -62.08 -51.04 77.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.276 -0.89 . . . . 0.0 110.334 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.68 -40.16 86.89 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.213 -0.929 . . . . 0.0 110.286 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.85 -41.21 97.84 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.201 -0.937 . . . . 0.0 110.196 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.47 HG23 ' O ' ' B' ' 16' ' ' VAL . 71.5 t -66.79 -41.29 87.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.191 -0.943 . . . . 0.0 110.223 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -64.58 -39.59 94.0 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.273 -0.892 . . . . 0.0 110.307 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -58.44 -47.52 83.7 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.085 -1.009 . . . . 0.0 110.308 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . 0.499 ' HB2' HD22 ' A' ' 67' ' ' LEU . . . -57.3 -40.8 78.6 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.31 -0.869 . . . . 0.0 110.345 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 3.4 mmm-85 . . . . . 0 N--CA 1.492 1.629 0 O-C-N 121.262 -0.899 . . . . 0.0 110.192 -179.878 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.221 0.534 . . . . 0.0 110.208 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.504 ' O ' HD12 ' A' ' 11' ' ' ILE . . . -63.55 -50.01 71.19 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.243 -0.91 . . . . 0.0 109.821 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -36.7 65.53 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.392 -0.817 . . . . 0.0 109.942 179.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.1 tp60 -61.61 -37.49 84.12 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.232 -0.917 . . . . 0.0 110.2 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.435 HG12 ' HD2' ' A' ' 14' ' ' PHE . 66.9 t -58.13 -43.49 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.163 -0.961 . . . . 0.0 109.951 179.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.504 HD12 ' O ' ' A' ' 7' ' ' ALA . 2.2 mp -62.77 -48.66 87.05 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.278 -0.889 . . . . 0.0 109.54 179.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.69 -42.31 83.39 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.213 -0.93 . . . . 0.0 109.095 179.184 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.418 ' HA ' ' HB1' ' B' ' 12' ' ' ALA . 4.7 p -66.68 -39.14 88.0 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.394 -0.816 . . . . 0.0 109.046 178.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.541 ' HB3' ' CZ ' ' A' ' 60' ' ' TYR . 1.1 m-85 -68.6 -41.91 78.92 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.374 -0.829 . . . . 0.0 109.522 179.039 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.9 ttt180 -54.12 -44.02 70.97 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.341 -0.849 . . . . 0.0 109.629 179.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.635 HG21 ' HA ' ' B' ' 9' ' ' LYS . 68.3 mt -62.63 -44.93 99.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.409 -0.807 . . . . 0.0 109.859 179.607 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.404 HD23 HD12 ' A' ' 33' ' ' LEU . 6.4 mp -65.0 -34.4 78.36 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.373 -0.829 . . . . 0.0 109.899 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.491 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -81.07 -1.62 44.9 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.32 -0.863 . . . . 0.0 110.162 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.414 ' HB3' ' O ' ' A' ' 18' ' ' ALA . 8.8 t 59.01 74.75 0.43 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.251 -0.905 . . . . 0.0 110.206 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 47.77 62.63 2.37 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.267 -0.896 . . . . 0.0 110.208 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.586 ' HD2' ' CZ ' ' A' ' 23' ' ' TYR . 0.8 OUTLIER -145.96 142.91 18.34 Favored Pre-proline 0 N--CA 1.489 1.493 0 O-C-N 121.239 -0.913 . . . . 0.0 110.144 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -76.37 3.2 6.51 Favored 'Trans proline' 0 C--N 1.303 -1.831 0 O-C-N 124.094 1.576 . . . . 0.0 110.127 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.586 ' CZ ' ' HD2' ' A' ' 21' ' ' LYS . 9.1 p90 -148.91 167.9 24.5 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.224 -0.922 . . . . 0.0 110.228 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.718 HD13 ' H ' ' A' ' 25' ' ' LEU . 0.3 OUTLIER -129.11 145.48 35.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.19 -0.944 . . . . 0.0 110.053 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.718 ' H ' HD13 ' A' ' 24' ' ' ILE . 4.7 mt -89.42 151.18 22.16 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.236 -0.915 . . . . 0.0 110.235 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.82 -39.35 91.49 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.229 -0.92 . . . . 0.0 110.046 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -65.52 -34.9 79.33 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.298 -0.876 . . . . 0.0 110.077 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.454 ' HB3' HD11 ' A' ' 24' ' ' ILE . 12.2 mm-40 -62.07 -46.42 89.17 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.399 -0.813 . . . . 0.0 110.15 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.404 HD21 HG13 ' A' ' 24' ' ' ILE . 21.7 mt -59.86 -35.38 74.67 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.237 -0.914 . . . . 0.0 109.961 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.2 mmm-85 -69.06 -35.74 76.87 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.299 -0.876 . . . . 0.0 110.696 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -90.1 -29.79 18.09 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.149 -0.969 . . . . 0.0 110.71 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.434 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 3.1 mm-40 -91.61 -23.19 19.94 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.107 -0.996 . . . . 0.0 110.57 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.924 HD22 ' HB3' ' A' ' 37' ' ' GLN . 0.3 OUTLIER -128.48 144.95 53.97 Favored Pre-proline 0 N--CA 1.489 1.48 0 O-C-N 121.073 -1.017 . . . . 0.0 110.385 -179.715 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.781 ' HD2' HD23 ' A' ' 33' ' ' LEU . 2.6 Cg_endo -49.01 142.09 20.8 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 O-C-N 124.082 1.57 . . . . 0.0 110.107 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -43.31 -33.56 4.01 Favored 'Trans proline' 0 C--N 1.304 -1.792 0 O-C-N 124.005 1.529 . . . . 0.0 110.611 -179.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -65.38 -47.11 77.52 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.112 -0.992 . . . . 0.0 110.341 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.924 ' HB3' HD22 ' A' ' 33' ' ' LEU . 1.7 mp0 -70.18 -42.1 72.85 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.189 -0.945 . . . . 0.0 110.355 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.28 -42.61 77.74 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.258 -0.901 . . . . 0.0 110.62 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -60.53 -48.55 81.29 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.168 -0.957 . . . . 0.0 110.429 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -63.51 -46.74 84.69 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.162 -0.961 . . . . 0.0 110.471 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 89.0 m -65.3 -41.06 94.47 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.257 -0.902 . . . . 0.0 110.623 -179.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 63.0 mt -67.85 -23.03 28.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.183 -0.948 . . . . 0.0 110.601 -179.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -84.79 -23.54 29.12 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.191 -0.943 . . . . 0.0 110.783 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.502 ' HG2' ' CE1' ' A' ' 63' ' ' PHE . 0.7 OUTLIER -92.49 -56.91 2.85 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.108 -0.995 . . . . 0.0 110.641 -179.544 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.565 ' HE1' ' HB3' ' A' ' 60' ' ' TYR . 0.6 OUTLIER -33.98 103.57 0.23 Allowed Pre-proline 0 N--CA 1.496 1.839 0 O-C-N 121.606 -0.684 . . . . 0.0 111.059 -179.845 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.426 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 32.2 Cg_exo . . . . . 0 C--N 1.307 -1.65 0 O-C-N 124.122 1.59 . . . . 0.0 110.359 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 121.311 0.577 . . . . 0.0 110.356 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.459 ' HB3' ' HB3' ' A' ' 45' ' ' MET . 15.0 mt -127.86 154.31 45.62 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.331 -0.856 . . . . 0.0 109.871 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.483 ' C ' ' HG3' ' A' ' 45' ' ' MET . 5.5 m-20 -105.23 110.87 23.4 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.105 -0.997 . . . . 0.0 110.552 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.565 ' HB3' ' HE1' ' A' ' 45' ' ' MET . 22.2 p90 -80.42 -21.22 42.43 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.322 -0.861 . . . . 0.0 109.759 179.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.509 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.9 -37.85 69.42 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.372 -0.83 . . . . 0.0 109.808 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.426 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -65.06 -33.75 76.78 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.246 -0.909 . . . . 0.0 109.642 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.502 ' CE1' ' HG2' ' A' ' 44' ' ' ARG . 1.5 t80 -71.91 -35.93 69.83 Favored 'General case' 0 C--N 1.299 -1.597 0 O-C-N 121.553 -0.717 . . . . 0.0 109.874 179.539 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.34 -49.61 76.58 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.279 -0.888 . . . . 0.0 110.074 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 41.8 m -64.3 -36.85 85.44 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.183 -0.948 . . . . 0.0 110.05 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.47 -34.43 72.39 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.297 -0.877 . . . . 0.0 110.024 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.59 HD21 ' HB2' ' B' ' 23' ' ' ALA . 0.2 OUTLIER -61.38 -44.75 96.62 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.285 -0.884 . . . . 0.0 109.955 179.891 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 . . . . . 0 N--CA 1.489 1.521 0 O-C-N 121.298 -0.876 . . . . 0.0 110.129 179.676 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.453 ' O ' ' HG3' ' B' ' 8' ' ' LYS . 5.5 ptpp? . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 121.218 0.532 . . . . 0.0 110.264 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.635 ' HA ' HG21 ' A' ' 16' ' ' ILE . 3.4 ttmt -57.66 -49.18 77.34 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.191 -0.943 . . . . 0.0 109.882 179.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.69 -33.84 64.53 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.252 -0.905 . . . . 0.0 109.612 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.66 -40.55 84.51 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.352 -0.843 . . . . 0.0 109.878 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . 0.599 ' HB2' HD12 ' A' ' 16' ' ' ILE . . . -62.66 -42.78 99.8 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.324 -0.86 . . . . 0.0 109.715 179.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.92 ' O ' HG23 ' B' ' 17' ' ' VAL . 70.2 t -59.48 -40.46 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.358 -0.839 . . . . 0.0 109.593 179.464 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.9 -41.41 87.15 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.402 -0.811 . . . . 0.0 109.893 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.11 -44.95 94.21 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.357 -0.839 . . . . 0.0 110.129 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.445 ' O ' HG23 ' B' ' 20' ' ' VAL . 95.6 t -64.31 -42.9 96.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.302 -0.873 . . . . 0.0 109.921 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.92 HG23 ' O ' ' B' ' 13' ' ' VAL . 22.1 t -61.29 -48.21 89.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.311 -0.868 . . . . 0.0 110.025 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.71 -45.87 90.76 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.249 -0.907 . . . . 0.0 109.995 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.01 -45.57 88.35 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.254 -0.904 . . . . 0.0 110.048 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.445 HG23 ' O ' ' B' ' 16' ' ' VAL . 46.9 t -62.6 -43.02 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.156 -0.965 . . . . 0.0 109.887 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.09 -36.85 75.83 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.252 -0.905 . . . . 0.0 109.972 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.63 -44.52 96.07 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.318 -0.864 . . . . 0.0 109.903 179.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . 0.59 ' HB2' HD21 ' A' ' 67' ' ' LEU . . . -63.1 -35.08 79.08 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.308 -0.87 . . . . 0.0 110.258 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 44.3 ttt180 . . . . . 0 N--CA 1.492 1.654 0 O-C-N 121.311 -0.868 . . . . 0.0 110.369 -179.855 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 121.276 0.56 . . . . 0.0 110.035 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -66.91 -44.84 79.72 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.307 -0.871 . . . . 0.0 109.681 179.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -54.66 -35.71 63.82 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.426 -0.796 . . . . 0.0 109.789 179.44 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -60.9 -45.33 95.06 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.295 -0.878 . . . . 0.0 109.986 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.518 HG12 ' HD2' ' A' ' 14' ' ' PHE . 61.8 t -63.87 -43.83 97.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.183 -0.948 . . . . 0.0 109.46 179.472 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 86.3 mt -60.67 -45.7 97.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.389 -0.819 . . . . 0.0 109.369 179.293 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.54 -41.67 81.4 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.327 -0.858 . . . . 0.0 108.778 179.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.546 ' HA ' ' HB1' ' B' ' 12' ' ' ALA . 2.6 m -68.03 -39.53 83.1 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 178.687 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.587 ' HB3' ' CZ ' ' A' ' 60' ' ' TYR . 2.6 m-85 -68.47 -41.96 79.41 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.481 -0.762 . . . . 0.0 109.506 179.205 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -53.39 -45.84 69.43 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.298 -0.876 . . . . 0.0 109.436 179.428 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.471 HG21 ' HA ' ' B' ' 9' ' ' LYS . 49.7 mt -62.34 -41.3 91.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.415 -0.803 . . . . 0.0 109.711 179.387 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.404 HD11 HG22 ' B' ' 13' ' ' VAL . 2.2 mp -65.02 -38.58 91.38 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.313 -0.867 . . . . 0.0 110.0 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.515 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -85.5 3.68 39.28 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.311 -0.868 . . . . 0.0 110.334 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.473 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 0.1 OUTLIER 60.6 61.39 1.73 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.248 -0.908 . . . . 0.0 110.379 179.949 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' A' ' 19' ' ' SER . 1.2 m-20 56.13 61.94 2.55 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.218 -0.926 . . . . 0.0 110.439 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.515 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 89.8 mttt -144.84 138.68 14.58 Favored Pre-proline 0 N--CA 1.489 1.494 0 O-C-N 121.287 -0.883 . . . . 0.0 109.733 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -68.3 -3.69 11.36 Favored 'Trans proline' 0 C--N 1.304 -1.8 0 O-C-N 124.008 1.53 . . . . 0.0 110.44 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 18.5 p90 -138.79 156.52 47.28 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.173 -0.954 . . . . 0.0 110.145 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.798 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -128.93 138.19 55.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.259 -0.9 . . . . 0.0 110.235 -179.803 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.798 ' N ' HD13 ' A' ' 24' ' ' ILE . 0.8 OUTLIER -80.54 141.9 34.67 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.277 -0.889 . . . . 0.0 110.41 -179.862 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.21 -40.63 94.71 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.37 -0.831 . . . . 0.0 110.455 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -55.97 -36.78 68.22 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.273 -0.892 . . . . 0.0 110.516 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.413 ' HB3' HD11 ' A' ' 24' ' ' ILE . 1.9 tt0 -67.42 -45.55 75.79 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.198 -0.939 . . . . 0.0 109.888 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.67 ' HG ' HD12 ' A' ' 24' ' ' ILE . 20.4 mt -60.77 -36.68 79.57 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.241 -0.912 . . . . 0.0 109.756 179.697 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.0 tpt180 -62.21 -34.63 76.84 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.33 -0.856 . . . . 0.0 109.643 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 7.4 ttp180 -92.92 -35.91 13.07 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.325 -0.86 . . . . 0.0 110.212 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -77.98 -23.76 48.27 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.334 -0.853 . . . . 0.0 110.744 -179.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.675 HD22 ' HB3' ' A' ' 37' ' ' GLN . 0.2 OUTLIER -125.46 163.5 38.17 Favored Pre-proline 0 N--CA 1.487 1.409 0 O-C-N 121.094 -1.004 . . . . 0.0 110.422 -179.622 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.485 ' HB2' ' OD2' ' A' ' 36' ' ' ASP . 39.6 Cg_exo -64.58 149.58 89.63 Favored 'Trans proline' 0 C--N 1.305 -1.754 0 O-C-N 124.035 1.545 . . . . 0.0 110.101 179.774 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -43.72 -44.85 11.29 Favored 'Trans proline' 0 C--N 1.304 -1.8 0 O-C-N 124.035 1.545 . . . . 0.0 110.418 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.49 ' OD1' ' NE2' ' A' ' 37' ' ' GLN . 3.4 p30 -65.89 -40.06 91.22 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.174 -0.954 . . . . 0.0 110.68 -179.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.675 ' HB3' HD22 ' A' ' 33' ' ' LEU . 76.0 mm-40 -70.07 -38.54 75.77 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.007 -1.058 . . . . 0.0 110.434 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.2 -42.44 93.53 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.162 -0.961 . . . . 0.0 110.363 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.414 ' O ' ' HB2' ' A' ' 43' ' ' LYS . 2.6 tt0 -58.54 -48.98 79.07 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.182 -0.949 . . . . 0.0 110.213 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -66.33 -48.08 71.42 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.242 -0.911 . . . . 0.0 110.17 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 89.6 m -65.39 -43.08 91.78 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.414 -0.804 . . . . 0.0 110.531 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 83.8 mt -71.2 -21.17 21.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.164 -0.96 . . . . 0.0 110.364 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 39' ' ' GLN . 38.5 ttmt -84.31 -43.59 14.64 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.176 -0.952 . . . . 0.0 110.382 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.613 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 1.6 mmp_? -68.83 -62.87 1.2 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.198 -0.939 . . . . 0.0 110.459 -179.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.678 ' HE1' ' HB3' ' A' ' 60' ' ' TYR . 2.3 ttm -30.43 118.1 0.33 Allowed Pre-proline 0 N--CA 1.494 1.768 0 O-C-N 121.853 -0.529 . . . . 0.0 111.336 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.565 ' O ' HD23 ' A' ' 58' ' ' LEU . 9.6 Cg_endo . . . . . 0 C--N 1.306 -1.694 0 O-C-N 124.084 1.571 . . . . 0.0 110.321 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.437 ' C ' ' HG ' ' A' ' 58' ' ' LEU . . . . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 121.247 0.546 . . . . 0.0 110.135 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.565 HD23 ' O ' ' A' ' 46' ' ' PRO . 1.1 mt -135.54 160.34 38.78 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.245 -0.91 . . . . 0.0 110.29 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.454 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.5 OUTLIER -107.16 111.26 23.6 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.34 -0.85 . . . . 0.0 110.138 179.759 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.678 ' HB3' ' HE1' ' A' ' 45' ' ' MET . 17.9 p90 -72.57 -23.69 61.0 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.286 -0.883 . . . . 0.0 110.081 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.516 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.88 -35.81 66.92 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.251 -0.906 . . . . 0.0 109.787 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.2 -34.26 75.93 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.285 -0.885 . . . . 0.0 109.821 179.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.613 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 12.1 t80 -72.04 -34.81 69.07 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.633 -0.667 . . . . 0.0 110.292 179.761 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.4 m -57.04 -49.72 74.95 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.21 -0.932 . . . . 0.0 110.461 -179.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.2 m -57.89 -35.71 71.39 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.171 -0.956 . . . . 0.0 110.614 -179.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.17 -46.09 82.24 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.13 -0.981 . . . . 0.0 110.635 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.469 HD21 ' CE1' ' A' ' 63' ' ' PHE . 0.1 OUTLIER -62.08 -43.54 98.61 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.253 -0.904 . . . . 0.0 110.593 -179.695 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 . . . . . 0 N--CA 1.493 1.71 0 O-C-N 121.182 -0.948 . . . . 0.0 110.509 -179.633 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.286 0.565 . . . . 0.0 110.203 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.759 ' O ' HG23 ' B' ' 13' ' ' VAL . 0.0 OUTLIER -70.81 -51.01 29.45 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.206 -0.934 . . . . 0.0 110.027 179.945 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.34 -40.57 71.37 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.258 -0.901 . . . . 0.0 109.943 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -65.63 -40.77 92.92 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.331 -0.856 . . . . 0.0 110.168 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . 0.546 ' HB1' ' HA ' ' A' ' 13' ' ' SER . . . -67.43 -38.01 83.9 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.269 -0.894 . . . . 0.0 110.2 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.759 HG23 ' O ' ' B' ' 9' ' ' LYS . 46.9 t -63.13 -44.14 99.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.328 -0.858 . . . . 0.0 110.152 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.2 -41.84 89.52 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.195 -0.94 . . . . 0.0 110.226 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 28.3 m -63.77 -37.43 87.32 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.317 -0.864 . . . . 0.0 110.234 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.664 ' O ' HG23 ' B' ' 20' ' ' VAL . 88.0 t -68.89 -46.43 79.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.202 -0.936 . . . . 0.0 110.198 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.517 HG23 ' O ' ' B' ' 13' ' ' VAL . 59.3 t -58.74 -43.52 88.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.225 -0.922 . . . . 0.0 110.195 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.97 -44.72 91.88 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.266 -0.897 . . . . 0.0 110.243 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.27 -43.54 94.49 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.196 -0.94 . . . . 0.0 110.22 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.664 HG23 ' O ' ' B' ' 16' ' ' VAL . 61.2 t -66.96 -42.5 88.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.323 -0.861 . . . . 0.0 110.328 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' B' ' 17' ' ' VAL . 3.1 t0 -60.82 -31.63 71.03 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.252 -0.905 . . . . 0.0 110.376 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -59.24 -51.24 70.83 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.184 -0.948 . . . . 0.0 110.251 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.4 -38.24 87.06 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.245 -0.909 . . . . 0.0 110.148 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.614 0 O-C-N 121.385 -0.822 . . . . 0.0 110.512 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.417 HG22 ' CE1' ' A' ' 68' ' ' TYR . 6.6 m . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.282 0.563 . . . . 0.0 110.159 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.54 -46.04 84.54 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.249 -0.907 . . . . 0.0 109.71 179.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -57.61 -36.65 72.06 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.402 -0.811 . . . . 0.0 109.879 179.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 37.3 tt0 -61.61 -45.85 92.33 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.263 -0.898 . . . . 0.0 110.115 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.495 HG21 ' HE2' ' A' ' 68' ' ' TYR . 54.1 t -59.47 -42.11 86.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.109 -0.995 . . . . 0.0 109.745 179.675 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 86.8 mt -65.31 -48.12 84.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 121.321 -0.862 . . . . 0.0 109.36 179.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.56 -39.81 77.53 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.282 -0.886 . . . . 0.0 108.792 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.485 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 7.0 m -67.21 -43.92 80.87 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 178.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.532 ' CB ' ' CD1' ' A' ' 60' ' ' TYR . 5.8 m-85 -67.32 -40.71 85.98 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.474 -0.766 . . . . 0.0 109.309 179.044 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.517 ' HG2' ' HA ' ' A' ' 20' ' ' ASP . 17.2 ttt180 -52.93 -40.95 64.01 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.407 -0.808 . . . . 0.0 109.223 179.241 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.412 HG21 ' HA ' ' B' ' 9' ' ' LYS . 49.1 mt -64.55 -43.91 96.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.407 -0.808 . . . . 0.0 110.224 179.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 13' ' ' SER . 15.5 mt -62.96 -41.73 99.62 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.087 -1.008 . . . . 0.0 110.096 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.693 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -83.59 13.31 4.7 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.311 -0.868 . . . . 0.0 110.299 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.429 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 65.69 57.8 0.83 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.21 -0.931 . . . . 0.0 110.28 179.899 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.517 ' HA ' ' HG2' ' A' ' 15' ' ' ARG . 0.6 OUTLIER 55.42 63.29 2.13 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.303 -0.873 . . . . 0.0 110.48 179.858 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -147.34 143.7 18.47 Favored Pre-proline 0 N--CA 1.49 1.565 0 O-C-N 121.202 -0.936 . . . . 0.0 110.034 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.467 ' O ' ' CD1' ' A' ' 23' ' ' TYR . 14.5 Cg_endo -72.89 -1.23 10.14 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 124.153 1.607 . . . . 0.0 110.114 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.467 ' CD1' ' O ' ' A' ' 22' ' ' PRO . 10.7 m-85 -130.44 150.06 51.84 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.262 -0.899 . . . . 0.0 109.866 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.693 HG12 ' HB2' ' A' ' 18' ' ' ALA . 0.1 OUTLIER -135.28 145.01 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.116 -0.99 . . . . 0.0 110.106 -179.828 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.577 ' N ' HD13 ' A' ' 24' ' ' ILE . 2.1 mp -80.09 153.54 28.67 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.267 -0.896 . . . . 0.0 110.061 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.462 ' O ' ' HB2' ' A' ' 29' ' ' LEU . . . -66.32 -45.37 80.54 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.249 -0.907 . . . . 0.0 110.071 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.84 -36.93 77.84 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.143 -0.973 . . . . 0.0 109.687 179.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.548 ' HB3' HD11 ' A' ' 24' ' ' ILE . 0.9 OUTLIER -58.37 -38.7 77.81 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.294 -0.878 . . . . 0.0 109.183 179.273 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.466 ' HG ' HD12 ' A' ' 24' ' ' ILE . 20.3 mt -61.42 -38.04 85.67 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.42 -0.8 . . . . 0.0 109.571 179.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 14.4 mtp85 -68.27 -34.03 75.45 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.306 -0.871 . . . . 0.0 110.077 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 15.4 ttt-85 -87.17 -21.56 25.85 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.284 -0.885 . . . . 0.0 110.7 -179.66 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 0.5 OUTLIER -99.02 -23.83 15.14 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.048 -1.033 . . . . 0.0 110.646 -179.552 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.791 HD22 ' HB3' ' A' ' 37' ' ' GLN . 3.5 mt -124.01 162.17 42.85 Favored Pre-proline 0 C--N 1.304 -1.39 0 O-C-N 121.11 -0.994 . . . . 0.0 110.196 -179.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.487 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 34.8 Cg_exo -62.72 179.86 0.64 Allowed 'Trans proline' 0 C--N 1.304 -1.768 0 O-C-N 123.918 1.483 . . . . 0.0 109.889 179.418 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.487 ' HD2' ' HB3' ' A' ' 34' ' ' PRO . 19.0 Cg_endo -63.99 -49.26 4.07 Favored 'Trans proline' 0 C--N 1.304 -1.772 0 O-C-N 123.941 1.495 . . . . 0.0 110.35 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -66.01 -40.94 91.55 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.292 -0.88 . . . . 0.0 110.863 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.791 ' HB3' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -69.65 -40.9 76.2 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.07 -1.019 . . . . 0.0 110.564 -179.5 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.45 -40.74 89.61 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.151 -0.968 . . . . 0.0 110.353 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -66.08 -48.87 69.56 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.187 -0.946 . . . . 0.0 110.509 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -62.08 -45.58 92.88 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.237 -0.914 . . . . 0.0 110.593 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 68.7 m -60.74 -44.33 96.8 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.149 -0.969 . . . . 0.0 110.514 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 72.3 mt -61.17 -32.84 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.169 -0.957 . . . . 0.0 110.404 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -76.44 -24.49 53.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.136 -0.978 . . . . 0.0 110.346 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.639 ' CD ' ' CE1' ' A' ' 63' ' ' PHE . 0.1 OUTLIER -84.07 -61.79 1.73 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.207 -0.933 . . . . 0.0 110.142 179.987 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.519 ' HE2' ' HA ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -34.39 103.46 0.23 Allowed Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.672 -0.642 . . . . 0.0 111.241 179.89 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo . . . . . 0 C--N 1.305 -1.725 0 O-C-N 123.889 1.468 . . . . 0.0 109.683 179.361 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 121.253 0.549 . . . . 0.0 110.204 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.479 ' HB3' ' HB3' ' A' ' 45' ' ' MET . 54.5 mt -114.57 159.77 20.04 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.322 -0.861 . . . . 0.0 110.198 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.478 ' C ' ' HG3' ' A' ' 45' ' ' MET . 13.5 p30 -110.34 111.09 22.15 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.253 -0.905 . . . . 0.0 110.468 179.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.572 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 24.8 p90 -74.8 -27.35 60.27 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.169 -0.957 . . . . 0.0 109.268 179.435 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.572 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.12 -44.74 79.43 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.446 -0.784 . . . . 0.0 109.591 179.616 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.48 -32.83 72.85 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.254 -0.904 . . . . 0.0 109.472 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.639 ' CE1' ' CD ' ' A' ' 44' ' ' ARG . 1.1 t80 -71.67 -40.34 69.69 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.626 -0.671 . . . . 0.0 109.983 179.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 21.0 p -58.92 -45.14 91.07 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.295 -0.878 . . . . 0.0 110.23 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 16.3 t -60.51 -39.69 88.69 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.276 -0.89 . . . . 0.0 110.219 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.26 -40.7 51.22 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.215 -0.928 . . . . 0.0 110.104 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.692 ' O ' HD12 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -66.48 -45.55 79.31 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.274 -0.891 . . . . 0.0 109.68 179.821 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.507 ' N ' ' HG ' ' A' ' 67' ' ' LEU . 3.9 m-85 . . . . . 0 N--CA 1.491 1.62 0 O-C-N 121.632 -0.668 . . . . 0.0 110.223 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 33.3 tttt . . . . . 0 N--CA 1.498 1.952 0 CA-C-O 120.928 0.394 . . . . 0.0 110.767 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.69 ' O ' HG23 ' B' ' 13' ' ' VAL . 7.2 ttmt -57.02 -33.85 67.59 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.038 -1.038 . . . . 0.0 110.037 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.38 -38.65 88.0 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.269 -0.894 . . . . 0.0 109.664 179.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -65.39 -42.1 93.0 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.296 -0.877 . . . . 0.0 109.807 179.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . 0.401 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -63.16 -33.05 74.63 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.35 -0.844 . . . . 0.0 109.888 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.69 HG23 ' O ' ' B' ' 9' ' ' LYS . 87.8 t -65.72 -42.29 92.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.287 -0.883 . . . . 0.0 110.135 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.71 -39.56 81.17 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.23 -0.919 . . . . 0.0 110.245 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.5 m -65.97 -43.74 87.01 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.301 -0.874 . . . . 0.0 110.193 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.658 ' O ' HG23 ' B' ' 20' ' ' VAL . 67.9 t -64.93 -43.22 96.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.246 -0.909 . . . . 0.0 110.06 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.728 HG22 ' HG2' ' A' ' 37' ' ' GLN . 43.6 t -58.58 -50.44 78.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.288 -0.883 . . . . 0.0 110.039 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.8 -46.69 88.44 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.251 -0.905 . . . . 0.0 109.822 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.78 -45.96 87.4 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.342 -0.849 . . . . 0.0 109.901 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.658 HG23 ' O ' ' B' ' 16' ' ' VAL . 75.3 t -63.26 -44.14 99.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.278 -0.889 . . . . 0.0 109.642 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -59.61 -40.25 86.91 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.399 -0.813 . . . . 0.0 109.708 179.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -54.21 -40.13 67.34 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.231 -0.918 . . . . 0.0 109.532 179.539 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . 0.504 ' HB2' HD13 ' A' ' 67' ' ' LEU . . . -60.04 -39.39 85.77 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.344 -0.847 . . . . 0.0 109.627 179.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 6.9 ttm-85 . . . . . 0 N--CA 1.488 1.449 0 O-C-N 121.261 -0.899 . . . . 0.0 109.69 179.506 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.643 HG22 ' CE2' ' A' ' 68' ' ' TYR . 3.6 m . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.338 0.59 . . . . 0.0 110.15 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -69.99 -45.2 67.8 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.253 -0.904 . . . . 0.0 109.864 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -54.78 -37.07 65.58 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.34 -0.85 . . . . 0.0 109.806 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.0 tp60 -61.98 -45.0 95.55 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.306 -0.871 . . . . 0.0 110.0 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.826 HG12 ' CD2' ' A' ' 14' ' ' PHE . 17.3 t -60.36 -45.14 96.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.238 -0.914 . . . . 0.0 109.947 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 69.2 mt -59.4 -49.65 82.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.319 -0.863 . . . . 0.0 109.911 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.97 -47.91 81.54 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.186 -0.947 . . . . 0.0 109.343 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.41 ' HB2' HG23 ' B' ' 16' ' ' VAL . 2.0 p -65.42 -36.06 82.8 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.336 -0.852 . . . . 0.0 109.201 179.161 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.826 ' CD2' HG12 ' A' ' 10' ' ' VAL . 1.0 OUTLIER -68.29 -43.99 76.46 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.431 -0.793 . . . . 0.0 109.323 179.308 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.2 ttt180 -53.53 -48.44 69.04 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.391 -0.818 . . . . 0.0 108.974 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.523 HG21 ' HA ' ' B' ' 9' ' ' LYS . 50.7 mt -58.93 -43.42 88.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.412 -0.805 . . . . 0.0 109.566 179.195 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.1 mp -64.94 -36.05 83.13 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.324 -0.86 . . . . 0.0 110.033 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.641 ' HB1' ' O ' ' A' ' 23' ' ' TYR . . . -81.04 0.78 34.29 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.311 -0.868 . . . . 0.0 110.149 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.459 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 3.3 t 65.28 76.14 0.34 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.259 -0.901 . . . . 0.0 110.172 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.409 ' C ' ' O ' ' A' ' 19' ' ' SER . 10.4 t70 42.85 56.34 4.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.284 -0.885 . . . . 0.0 110.298 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.459 ' HG3' ' O ' ' A' ' 19' ' ' SER . 9.5 mttm -143.94 143.85 24.43 Favored Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.225 -0.922 . . . . 0.0 110.116 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.464 ' O ' ' CD1' ' A' ' 23' ' ' TYR . 19.2 Cg_endo -76.27 3.36 6.32 Favored 'Trans proline' 0 C--N 1.304 -1.795 0 O-C-N 124.049 1.552 . . . . 0.0 110.182 179.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.641 ' O ' ' HB1' ' A' ' 18' ' ' ALA . 47.7 m-85 -141.91 165.84 26.37 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.305 -0.872 . . . . 0.0 110.429 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.57 HD13 ' HB3' ' A' ' 28' ' ' GLU . 0.3 OUTLIER -132.48 146.32 33.1 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.376 -0.827 . . . . 0.0 109.841 179.932 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.496 ' N ' HD13 ' A' ' 24' ' ' ILE . 49.2 mt -92.33 155.64 17.79 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.164 -0.96 . . . . 0.0 110.344 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.574 ' HA ' HD21 ' A' ' 29' ' ' LEU . . . -63.07 -38.97 93.32 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.35 -0.844 . . . . 0.0 110.056 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.05 -33.99 70.81 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.226 -0.921 . . . . 0.0 109.705 179.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.57 ' HB3' HD13 ' A' ' 24' ' ' ILE . 19.9 tt0 -62.9 -51.27 67.62 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.357 -0.839 . . . . 0.0 110.227 -179.563 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.64 HD13 ' HA ' ' A' ' 38' ' ' ALA . 4.0 pp -67.8 -33.28 74.49 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.01 -1.056 . . . . 0.0 109.221 179.132 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.494 ' N ' HD12 ' A' ' 29' ' ' LEU . 0.0 OUTLIER -65.55 -33.91 77.02 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.233 -0.917 . . . . 0.0 110.539 179.908 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -89.73 -15.1 33.22 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.062 -1.023 . . . . 0.0 111.395 -179.147 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.538 ' HG2' ' HA ' ' A' ' 29' ' ' LEU . 12.1 pt-20 -108.79 -24.32 11.35 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.797 -1.19 . . . . 0.0 111.329 -179.339 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.637 HD22 ' HB3' ' A' ' 37' ' ' GLN . 0.5 OUTLIER -110.1 146.32 33.95 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 120.944 -1.098 . . . . 0.0 110.173 -179.929 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.428 ' O ' ' C ' ' A' ' 35' ' ' PRO . 47.8 Cg_exo -48.17 140.75 19.2 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 O-C-N 123.934 1.491 . . . . 0.0 110.194 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.428 ' C ' ' O ' ' A' ' 34' ' ' PRO . 29.8 Cg_endo -41.12 -38.15 3.07 Favored 'Trans proline' 0 C--N 1.304 -1.804 0 O-C-N 124.062 1.559 . . . . 0.0 110.263 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -65.74 -44.16 86.79 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.308 -0.87 . . . . 0.0 110.441 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.637 ' HB3' HD22 ' A' ' 33' ' ' LEU . 62.6 mm-40 -68.95 -42.19 77.02 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.197 -0.939 . . . . 0.0 110.26 -179.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.64 ' HA ' HD13 ' A' ' 29' ' ' LEU . . . -56.25 -43.4 78.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.23 -0.919 . . . . 0.0 110.248 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -65.9 -44.75 84.3 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.24 -0.912 . . . . 0.0 110.148 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.09 -47.81 78.6 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.233 -0.917 . . . . 0.0 110.009 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.489 ' O ' ' HG2' ' A' ' 45' ' ' MET . 60.9 m -65.84 -51.0 62.57 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.453 -0.779 . . . . 0.0 111.082 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.637 HD11 HD11 ' A' ' 29' ' ' LEU . 44.3 mt -50.84 -28.49 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 O-C-N 121.208 -0.932 . . . . 0.0 110.675 -179.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 6.1 tttt -85.81 -27.14 25.33 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.218 -0.926 . . . . 0.0 110.693 -179.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.583 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 13.8 mmt180 -76.72 -71.63 0.39 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.245 -0.909 . . . . 0.0 110.801 -179.452 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.548 ' HE2' ' CA ' ' A' ' 60' ' ' TYR . 12.0 ptp -57.33 122.48 55.0 Favored Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 121.173 -0.954 . . . . 0.0 110.498 -179.636 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.404 ' O ' HD23 ' A' ' 58' ' ' LEU . 18.7 Cg_endo . . . . . 0 C--N 1.307 -1.657 0 O-C-N 123.95 1.5 . . . . 0.0 110.199 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.19 0.519 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.429 ' HB3' ' HG3' ' A' ' 45' ' ' MET . 70.8 mt -118.99 156.89 28.81 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.278 -0.889 . . . . 0.0 110.33 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.404 ' O ' ' HB2' ' A' ' 45' ' ' MET . 0.7 OUTLIER -107.81 113.29 26.42 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.278 -0.888 . . . . 0.0 110.212 -179.964 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.548 ' CA ' ' HE2' ' A' ' 45' ' ' MET . 26.0 p90 -83.78 -23.29 31.57 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.214 -0.929 . . . . 0.0 110.339 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.482 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.02 -41.46 74.99 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.119 -0.988 . . . . 0.0 109.508 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.51 -32.42 73.77 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.321 -0.862 . . . . 0.0 109.612 179.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.583 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 5.3 t80 -69.65 -33.09 72.12 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 121.62 -0.675 . . . . 0.0 110.252 179.725 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.447 ' O ' ' HB2' ' A' ' 68' ' ' TYR . 5.8 p -63.92 -50.05 70.21 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.222 -0.924 . . . . 0.0 110.154 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 25.8 t -68.8 -35.39 76.96 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.203 -0.936 . . . . 0.0 110.108 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.18 -46.17 68.17 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.333 -0.854 . . . . 0.0 110.512 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.678 HD12 ' C ' ' A' ' 67' ' ' LEU . 0.3 OUTLIER -69.33 -38.19 78.06 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.1 -1.0 . . . . 0.0 110.112 -179.84 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.643 ' CE2' HG22 ' A' ' 6' ' ' THR . 2.4 m-85 . . . . . 0 N--CA 1.493 1.685 0 O-C-N 121.484 -0.76 . . . . 0.0 110.248 179.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.52 ' HG2' ' N ' ' B' ' 9' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.092 0.472 . . . . 0.0 110.408 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.523 ' HA ' HG21 ' A' ' 16' ' ' ILE . 0.7 OUTLIER -57.61 -51.1 70.87 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.008 -1.058 . . . . 0.0 109.834 179.914 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.11 -33.98 67.89 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.252 -0.905 . . . . 0.0 109.581 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -68.7 -40.75 79.85 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.406 -0.809 . . . . 0.0 109.809 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.04 -35.87 81.69 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.344 -0.847 . . . . 0.0 109.983 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.487 HG23 ' O ' ' B' ' 9' ' ' LYS . 57.8 t -61.62 -43.4 96.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.359 -0.838 . . . . 0.0 110.043 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.87 -35.57 75.08 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.236 -0.915 . . . . 0.0 110.131 179.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 17.0 m -68.16 -48.6 64.86 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.271 -0.893 . . . . 0.0 109.956 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.41 HG23 ' HB2' ' A' ' 13' ' ' SER . 74.1 t -61.22 -44.32 98.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.237 -0.914 . . . . 0.0 110.13 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.537 HG22 ' HG3' ' A' ' 37' ' ' GLN . 44.1 t -58.46 -48.07 86.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.227 -0.921 . . . . 0.0 110.05 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.3 -39.81 88.24 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.348 -0.845 . . . . 0.0 110.134 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.54 -44.29 82.82 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.274 -0.891 . . . . 0.0 110.006 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.449 ' HB ' ' OE1' ' A' ' 37' ' ' GLN . 77.5 t -63.79 -47.49 90.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.21 -0.931 . . . . 0.0 110.138 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -55.2 -38.05 67.88 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.18 -0.95 . . . . 0.0 109.636 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -63.38 -36.88 85.19 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.395 -0.816 . . . . 0.0 109.953 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . 0.554 ' HB1' HH21 ' A' ' 44' ' ' ARG . . . -64.76 -39.48 93.68 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.305 -0.872 . . . . 0.0 110.3 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.58 0 O-C-N 121.257 -0.902 . . . . 0.0 109.845 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.608 ' CG2' ' CE1' ' A' ' 68' ' ' TYR . 2.9 m . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 121.229 0.538 . . . . 0.0 110.09 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -69.84 -44.31 70.15 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.205 -0.934 . . . . 0.0 109.774 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 19.7 tp10 -54.98 -36.41 65.35 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.371 -0.831 . . . . 0.0 109.697 179.583 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.402 ' O ' ' OG ' ' A' ' 13' ' ' SER . 1.1 tp60 -61.25 -44.83 96.61 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.295 -0.878 . . . . 0.0 109.858 179.89 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 59.2 t -58.38 -41.22 80.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.244 -0.91 . . . . 0.0 109.549 179.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.578 HG23 ' HE1' ' A' ' 60' ' ' TYR . 69.2 mt -66.71 -43.91 89.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.419 -0.801 . . . . 0.0 109.492 179.295 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.59 -43.27 84.5 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.276 -0.89 . . . . 0.0 108.861 179.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.447 ' O ' HD23 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -66.74 -38.66 87.1 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 178.71 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.565 ' HB3' ' CE2' ' A' ' 60' ' ' TYR . 1.2 m-85 -68.38 -42.28 79.36 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.491 -0.755 . . . . 0.0 109.437 179.124 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.77 -43.37 72.73 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.296 -0.878 . . . . 0.0 109.399 179.303 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.429 ' CD1' ' HB2' ' B' ' 12' ' ' ALA . 80.9 mt -63.79 -44.83 98.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.314 -0.866 . . . . 0.0 109.624 179.402 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.495 HD13 ' HA ' ' A' ' 17' ' ' LEU . 3.2 mm? -63.31 -34.75 78.36 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.32 -0.863 . . . . 0.0 109.735 179.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.731 ' HB1' ' O ' ' A' ' 23' ' ' TYR . . . -79.92 2.44 23.43 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.375 -0.828 . . . . 0.0 110.112 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.482 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 4.3 t 60.27 80.3 0.21 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.282 -0.886 . . . . 0.0 110.113 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.482 ' O ' ' HG2' ' A' ' 21' ' ' LYS . 6.3 m-20 45.31 59.33 3.6 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.346 -0.846 . . . . 0.0 110.438 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.482 ' HG2' ' O ' ' A' ' 20' ' ' ASP . 18.4 mttp -153.5 141.72 14.01 Favored Pre-proline 0 N--CA 1.489 1.502 0 O-C-N 121.25 -0.906 . . . . 0.0 110.047 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.512 ' HG2' ' CE2' ' A' ' 23' ' ' TYR . 23.4 Cg_endo -78.36 6.25 4.89 Favored 'Trans proline' 0 C--N 1.303 -1.824 0 O-C-N 124.172 1.617 . . . . 0.0 110.232 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.731 ' O ' ' HB1' ' A' ' 18' ' ' ALA . 22.1 m-85 -135.91 166.16 23.97 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.277 -0.889 . . . . 0.0 110.107 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.64 HD13 ' H ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -138.45 140.58 39.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.137 -0.977 . . . . 0.0 110.062 -179.945 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.64 ' H ' HD13 ' A' ' 24' ' ' ILE . 4.4 mp -83.55 154.45 23.81 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.174 -0.953 . . . . 0.0 110.019 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.83 -45.28 71.57 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.254 -0.904 . . . . 0.0 110.304 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -56.54 -39.69 73.84 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.268 -0.895 . . . . 0.0 109.937 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -59.26 -41.62 89.26 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.327 -0.858 . . . . 0.0 109.199 179.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 1.037 HD13 HD12 ' A' ' 33' ' ' LEU . 2.0 mm? -61.52 -33.82 74.47 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.53 -0.731 . . . . 0.0 109.417 179.265 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 14.8 mmm-85 -68.91 -34.38 75.31 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.381 -0.824 . . . . 0.0 110.322 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.2 -25.45 15.29 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.146 -0.971 . . . . 0.0 111.413 -179.139 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.482 ' HB3' HD12 ' A' ' 17' ' ' LEU . 12.3 mm-40 -91.64 -23.59 19.79 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 120.925 -1.109 . . . . 0.0 111.449 -178.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 1.037 HD12 HD13 ' A' ' 29' ' ' LEU . 7.8 mt -123.85 163.64 33.93 Favored Pre-proline 0 N--CA 1.487 1.392 0 O-C-N 120.847 -1.158 . . . . 0.0 110.734 -179.297 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.518 ' HD3' HD23 ' A' ' 33' ' ' LEU . 21.7 Cg_exo -61.52 139.33 81.2 Favored 'Trans proline' 0 C--N 1.306 -1.69 0 O-C-N 124.114 1.586 . . . . 0.0 110.003 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.431 ' C ' ' O ' ' A' ' 34' ' ' PRO . 31.7 Cg_endo -39.98 -41.65 3.03 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 O-C-N 124.065 1.561 . . . . 0.0 110.511 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -66.0 -37.58 86.31 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.283 -0.885 . . . . 0.0 111.081 -179.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.875 ' OE1' HG22 ' B' ' 17' ' ' VAL . 0.1 OUTLIER -69.64 -42.16 74.62 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.928 -1.107 . . . . 0.0 110.42 -179.562 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.489 ' O ' HG12 ' A' ' 42' ' ' ILE . . . -56.01 -48.3 76.17 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.179 -0.951 . . . . 0.0 110.288 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -56.11 -48.83 75.43 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.086 -1.009 . . . . 0.0 110.469 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -62.56 -48.12 80.88 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.152 -0.968 . . . . 0.0 110.101 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 56.6 m -65.26 -47.29 77.25 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.255 -0.903 . . . . 0.0 110.046 179.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.489 HG12 ' O ' ' A' ' 38' ' ' ALA . 16.2 mm -57.41 -22.88 18.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.389 -0.819 . . . . 0.0 110.109 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 26.1 tttt -84.47 -24.14 29.6 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.284 -0.885 . . . . 0.0 110.385 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.603 ' HB3' ' CG ' ' A' ' 63' ' ' PHE . 10.6 mmt180 -93.65 -67.92 0.83 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.246 -0.909 . . . . 0.0 110.275 -179.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.505 ' HE1' ' HB3' ' A' ' 60' ' ' TYR . 2.0 ttm -36.62 105.44 0.3 Allowed Pre-proline 0 N--CA 1.493 1.721 0 O-C-N 121.598 -0.689 . . . . 0.0 111.001 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.458 ' HD2' ' OD1' ' A' ' 59' ' ' ASP . 37.6 Cg_exo . . . . . 0 C--N 1.305 -1.729 0 O-C-N 124.03 1.542 . . . . 0.0 109.785 179.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 121.317 0.58 . . . . 0.0 110.275 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.409 ' HB3' ' HB3' ' A' ' 45' ' ' MET . 1.1 mt -111.62 157.75 20.05 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.226 -0.921 . . . . 0.0 110.181 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.475 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.7 OUTLIER -110.52 111.44 22.69 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.125 -0.984 . . . . 0.0 110.397 179.738 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.578 ' HE1' HG23 ' A' ' 11' ' ' ILE . 22.7 p90 -73.66 -24.82 60.03 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.217 -0.927 . . . . 0.0 109.182 179.362 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.547 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.65 -42.68 79.36 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.465 -0.772 . . . . 0.0 109.765 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.45 -40.3 86.39 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.298 -0.876 . . . . 0.0 109.874 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.603 ' CG ' ' HB3' ' A' ' 44' ' ' ARG . 1.7 t80 -71.97 -35.17 69.46 Favored 'General case' 0 C--N 1.298 -1.666 0 O-C-N 121.591 -0.693 . . . . 0.0 110.384 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 70.3 m -58.37 -43.48 88.46 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.21 -0.931 . . . . 0.0 110.465 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.28 -40.69 95.05 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.173 -0.954 . . . . 0.0 110.272 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.61 -31.94 67.46 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.281 -0.887 . . . . 0.0 110.452 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.722 HD21 ' HB2' ' B' ' 23' ' ' ALA . 0.5 OUTLIER -64.67 -44.41 90.48 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.109 -0.994 . . . . 0.0 110.386 -179.825 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.608 ' CE1' ' CG2' ' A' ' 6' ' ' THR . 28.4 m-85 . . . . . 0 N--CA 1.49 1.571 0 O-C-N 121.198 -0.939 . . . . 0.0 110.27 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.241 0.543 . . . . 0.0 110.134 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.815 ' O ' HG23 ' B' ' 13' ' ' VAL . 0.3 OUTLIER -58.32 -40.34 81.82 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.291 -0.88 . . . . 0.0 110.159 -179.944 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.11 -46.5 79.1 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.23 -0.919 . . . . 0.0 109.964 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -62.12 -40.95 97.63 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.277 -0.89 . . . . 0.0 110.032 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . 0.468 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -64.33 -37.11 86.33 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.342 -0.849 . . . . 0.0 110.184 179.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.929 ' O ' HG23 ' B' ' 17' ' ' VAL . 42.7 t -65.31 -45.09 94.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.321 -0.862 . . . . 0.0 110.128 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.33 -35.94 74.75 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.234 -0.916 . . . . 0.0 110.173 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 15.0 m -67.54 -40.95 85.01 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.378 -0.826 . . . . 0.0 110.347 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.85 ' O ' HG23 ' B' ' 20' ' ' VAL . 57.4 t -69.91 -40.18 78.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.248 -0.908 . . . . 0.0 110.168 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.929 HG23 ' O ' ' B' ' 13' ' ' VAL . 16.7 t -61.45 -47.41 93.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.365 -0.834 . . . . 0.0 110.238 -179.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.86 -46.01 92.27 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.253 -0.904 . . . . 0.0 110.322 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.04 -41.4 95.23 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.228 -0.92 . . . . 0.0 110.287 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.85 HG23 ' O ' ' B' ' 16' ' ' VAL . 75.1 t -67.1 -39.44 83.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.25 -0.906 . . . . 0.0 110.425 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.44 -33.73 76.55 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.235 -0.916 . . . . 0.0 110.333 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -58.09 -49.38 77.14 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.286 -0.884 . . . . 0.0 110.267 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . 0.722 ' HB2' HD21 ' A' ' 67' ' ' LEU . . . -66.15 -37.32 85.39 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.235 -0.915 . . . . 0.0 110.411 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 51.1 ttt-85 . . . . . 0 N--CA 1.493 1.694 0 O-C-N 121.268 -0.895 . . . . 0.0 110.648 -179.609 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.5 m . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.194 0.521 . . . . 0.0 110.141 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.568 ' HA ' ' CZ ' ' A' ' 68' ' ' TYR . . . -69.99 -41.48 74.34 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.335 -0.853 . . . . 0.0 109.873 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -59.66 -36.9 77.35 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.278 -0.889 . . . . 0.0 109.742 179.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -64.58 -44.04 91.94 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.439 -0.788 . . . . 0.0 110.284 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.628 HG21 ' OH ' ' A' ' 68' ' ' TYR . 54.3 t -57.87 -43.75 85.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.203 -0.936 . . . . 0.0 109.86 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.494 HD12 ' O ' ' A' ' 7' ' ' ALA . 5.5 mt -63.74 -49.16 83.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.329 -0.857 . . . . 0.0 109.351 179.35 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.06 -43.15 86.78 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.294 -0.879 . . . . 0.0 108.92 179.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.499 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 1.0 OUTLIER -63.56 -46.63 85.02 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.608 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.578 ' HB3' ' CE2' ' A' ' 60' ' ' TYR . 3.6 m-85 -59.81 -43.14 94.63 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.465 -0.772 . . . . 0.0 109.129 178.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -52.96 -40.59 63.82 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.405 HG21 ' HA ' ' B' ' 9' ' ' LYS . 61.6 mt -67.1 -44.93 87.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.541 -0.724 . . . . 0.0 110.267 179.41 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.568 HD13 ' OE1' ' A' ' 32' ' ' GLU . 9.3 mt -57.88 -42.11 83.9 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.929 -1.107 . . . . 0.0 109.698 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.446 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -79.5 4.07 16.79 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.378 -0.826 . . . . 0.0 110.298 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.448 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 0.3 OUTLIER 64.91 66.8 0.55 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.268 -0.895 . . . . 0.0 110.234 179.959 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 52.11 59.88 4.22 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.213 -0.929 . . . . 0.0 110.308 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.448 ' HG3' ' O ' ' A' ' 19' ' ' SER . 20.9 mttt -143.51 142.05 20.27 Favored Pre-proline 0 N--CA 1.49 1.525 0 O-C-N 121.182 -0.949 . . . . 0.0 110.014 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -69.81 -3.15 11.47 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 O-C-N 124.089 1.573 . . . . 0.0 110.263 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.523 ' CD1' ' O ' ' A' ' 23' ' ' TYR . 7.0 p90 -143.4 152.37 41.5 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.239 -0.913 . . . . 0.0 110.055 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.404 HD13 HG21 ' A' ' 24' ' ' ILE . 3.9 tt -123.0 147.39 27.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.243 -0.911 . . . . 0.0 110.344 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.503 ' HB2' ' HB2' ' A' ' 28' ' ' GLU . 1.2 mp -80.48 141.43 35.22 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.241 -0.912 . . . . 0.0 109.92 179.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.496 ' O ' ' HG ' ' A' ' 29' ' ' LEU . . . -60.27 -40.6 90.94 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.203 -0.936 . . . . 0.0 110.471 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -65.01 -35.17 80.34 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.165 -0.959 . . . . 0.0 110.124 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.503 ' HB2' ' HB2' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -68.8 -49.98 54.04 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.366 -0.834 . . . . 0.0 109.869 179.992 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.725 HD12 ' C ' ' A' ' 29' ' ' LEU . 0.9 OUTLIER -66.82 -34.07 77.01 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.373 -0.829 . . . . 0.0 110.042 179.834 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.76 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 17.2 ttp180 -69.18 -34.48 75.0 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.319 -0.863 . . . . 0.0 111.12 -179.642 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.551 ' NH1' ' HB3' ' A' ' 31' ' ' ARG . 5.0 ttp-105 -86.48 -22.46 26.43 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.007 -1.058 . . . . 0.0 111.32 -178.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.568 ' OE1' HD13 ' A' ' 17' ' ' LEU . 12.8 pt-20 -90.7 -24.03 20.55 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.831 -1.168 . . . . 0.0 110.776 -179.542 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.589 HD23 ' HD2' ' A' ' 34' ' ' PRO . 7.6 mt -103.17 155.91 36.06 Favored Pre-proline 0 N--CA 1.488 1.457 0 O-C-N 121.122 -0.986 . . . . 0.0 110.409 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.589 ' HD2' HD23 ' A' ' 33' ' ' LEU . 6.2 Cg_exo -59.18 142.54 99.36 Favored 'Trans proline' 0 C--N 1.302 -1.892 0 O-C-N 124.069 1.563 . . . . 0.0 109.775 179.593 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.429 ' C ' ' O ' ' A' ' 34' ' ' PRO . 33.7 Cg_exo -37.72 -44.08 1.56 Allowed 'Trans proline' 0 C--N 1.305 -1.749 0 O-C-N 124.055 1.555 . . . . 0.0 110.917 -179.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.486 ' OD1' ' HB2' ' A' ' 34' ' ' PRO . 2.9 p-10 -65.9 -45.82 80.58 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.091 -1.006 . . . . 0.0 111.04 -179.606 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.626 ' HG2' HG22 ' B' ' 17' ' ' VAL . 0.6 OUTLIER -69.82 -37.85 76.36 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.951 -1.093 . . . . 0.0 110.705 -179.53 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.76 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -60.96 -43.86 98.13 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.369 -0.832 . . . . 0.0 110.952 -179.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.3 tm0? -60.09 -44.92 94.46 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.255 -0.903 . . . . 0.0 110.849 -179.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -62.21 -41.72 98.63 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.237 -0.914 . . . . 0.0 110.922 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 27.5 m -62.69 -50.88 69.41 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.128 -0.982 . . . . 0.0 110.755 -179.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.644 HD12 HD11 ' A' ' 29' ' ' LEU . 1.1 mt -63.84 -18.01 21.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.203 -0.935 . . . . 0.0 110.188 -179.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.45 ' C ' ' HD2' ' A' ' 44' ' ' ARG . 9.2 tttt -83.22 -16.01 48.19 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.25 -0.906 . . . . 0.0 110.772 -179.69 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.592 ' HB3' ' CG ' ' A' ' 63' ' ' PHE . 2.0 mpt_? -114.32 -62.26 1.62 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.106 -0.996 . . . . 0.0 110.675 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.492 ' HE1' ' HB3' ' A' ' 60' ' ' TYR . 2.3 ttm -32.88 111.1 0.35 Allowed Pre-proline 0 N--CA 1.497 1.92 0 O-C-N 121.618 -0.676 . . . . 0.0 111.272 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.428 ' O ' ' HA ' ' A' ' 58' ' ' LEU . 12.3 Cg_endo . . . . . 0 C--N 1.306 -1.687 0 O-C-N 124.024 1.539 . . . . 0.0 110.194 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 121.253 0.549 . . . . 0.0 110.107 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.438 ' HB3' ' HB3' ' A' ' 45' ' ' MET . 54.3 mt -93.76 159.04 15.38 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.323 -0.861 . . . . 0.0 110.176 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.479 ' C ' ' HG3' ' A' ' 45' ' ' MET . 1.2 m-20 -115.28 110.42 19.39 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.105 -0.997 . . . . 0.0 110.41 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.579 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 15.9 p90 -72.77 -25.77 61.29 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.379 -0.826 . . . . 0.0 110.271 179.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.579 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.7 -36.73 67.5 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.279 -0.888 . . . . 0.0 109.958 -179.7 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.56 -43.36 80.84 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.322 -0.861 . . . . 0.0 109.557 179.416 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.592 ' CG ' ' HB3' ' A' ' 44' ' ' ARG . 1.5 t80 -72.12 -35.29 69.11 Favored 'General case' 0 C--N 1.297 -1.689 0 O-C-N 121.75 -0.593 . . . . 0.0 110.311 179.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.566 ' O ' ' CE2' ' A' ' 68' ' ' TYR . 44.3 m -59.67 -49.87 76.07 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.298 -0.876 . . . . 0.0 110.569 -179.606 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.97 -41.24 82.49 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.184 -0.947 . . . . 0.0 110.344 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.64 -39.6 73.96 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.231 -0.918 . . . . 0.0 110.386 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.546 ' CD2' ' HB2' ' B' ' 23' ' ' ALA . 15.3 mt -57.75 -41.12 81.3 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.144 -0.972 . . . . 0.0 110.241 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.628 ' OH ' HG21 ' A' ' 10' ' ' VAL . 2.7 m-85 . . . . . 0 N--CA 1.49 1.568 0 O-C-N 121.271 -0.893 . . . . 0.0 110.077 -179.736 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.466 ' HB2' ' OE1' ' B' ' 11' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.204 0.526 . . . . 0.0 110.133 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.405 ' HA ' HG21 ' A' ' 16' ' ' ILE . 0.0 OUTLIER -65.65 -45.63 82.24 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.24 -0.913 . . . . 0.0 110.025 179.849 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.99 -40.84 77.34 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.314 -0.866 . . . . 0.0 109.997 179.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 0.466 ' OE1' ' HB2' ' B' ' 8' ' ' LYS . 5.2 mt-10 -62.05 -40.92 97.39 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.333 -0.854 . . . . 0.0 110.024 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . 0.458 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -65.43 -43.08 91.61 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.415 -0.803 . . . . 0.0 110.0 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.558 ' O ' HG23 ' B' ' 17' ' ' VAL . 90.1 t -58.64 -44.25 89.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.215 -0.928 . . . . 0.0 110.013 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.29 -39.56 90.89 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.307 -0.87 . . . . 0.0 110.179 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 19.7 m -64.66 -44.43 90.42 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.226 -0.921 . . . . 0.0 110.136 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.458 HG23 ' O ' ' B' ' 12' ' ' ALA . 59.8 t -65.18 -42.28 93.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.246 -0.909 . . . . 0.0 110.08 179.898 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.626 HG22 ' HG2' ' A' ' 37' ' ' GLN . 74.4 t -60.66 -44.79 97.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.271 -0.893 . . . . 0.0 110.256 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.71 -46.32 90.16 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.197 -0.94 . . . . 0.0 110.199 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.51 -42.02 92.53 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.27 -0.894 . . . . 0.0 110.232 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.449 HG23 ' O ' ' B' ' 16' ' ' VAL . 57.6 t -66.04 -46.04 89.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.304 -0.873 . . . . 0.0 110.244 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -63.08 -32.58 73.98 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.235 -0.915 . . . . 0.0 110.221 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 4.5 tp60 -56.9 -41.45 78.12 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.268 -0.895 . . . . 0.0 110.11 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . 0.546 ' HB2' ' CD2' ' A' ' 67' ' ' LEU . . . -60.63 -39.06 86.85 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.207 -0.933 . . . . 0.0 109.981 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 O-C-N 121.367 -0.833 . . . . 0.0 110.264 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.778 HG22 ' CZ ' ' A' ' 68' ' ' TYR . 1.9 m . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 121.195 0.521 . . . . 0.0 110.258 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -67.8 -37.97 82.69 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.289 -0.882 . . . . 0.0 109.43 179.592 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.6 tp10 -59.85 -36.02 75.98 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.418 -0.801 . . . . 0.0 109.681 179.209 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.15 -45.66 93.74 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.327 -0.858 . . . . 0.0 110.046 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.684 HG12 ' CD2' ' A' ' 14' ' ' PHE . 21.7 t -61.88 -43.64 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.097 -1.002 . . . . 0.0 109.649 179.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 34.8 mt -57.3 -49.47 79.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.385 -0.822 . . . . 0.0 109.413 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.05 -41.85 93.19 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.293 -0.879 . . . . 0.0 109.063 179.09 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.444 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 5.1 m -65.46 -41.24 93.6 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.48 -0.762 . . . . 0.0 109.153 179.022 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.684 ' CD2' HG12 ' A' ' 10' ' ' VAL . 2.2 m-85 -68.43 -41.26 80.58 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.385 -0.822 . . . . 0.0 109.395 179.257 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.471 ' HD3' ' HA ' ' A' ' 20' ' ' ASP . 1.5 tmm_? -53.58 -43.63 68.7 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.353 -0.842 . . . . 0.0 109.612 179.509 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.633 HD12 ' HB2' ' B' ' 12' ' ' ALA . 54.8 mt -60.14 -44.94 96.28 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.283 -0.886 . . . . 0.0 109.691 179.627 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 13' ' ' SER . 38.5 mt -65.36 -40.15 93.21 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.295 -0.878 . . . . 0.0 109.803 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.561 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -72.35 -4.88 32.58 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.298 -0.876 . . . . 0.0 110.103 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.468 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.3 OUTLIER 68.48 54.17 0.54 Allowed 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.24 -0.912 . . . . 0.0 110.2 -179.922 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.471 ' HA ' ' HD3' ' A' ' 15' ' ' ARG . 2.2 t70 63.02 36.74 12.2 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.204 -0.935 . . . . 0.0 110.313 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.561 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 7.5 mmtt -118.47 144.75 35.86 Favored Pre-proline 0 N--CA 1.49 1.543 0 O-C-N 121.237 -0.914 . . . . 0.0 110.037 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 21' ' ' LYS . 38.4 Cg_exo -68.77 -5.33 15.2 Favored 'Trans proline' 0 C--N 1.304 -1.79 0 O-C-N 124.123 1.591 . . . . 0.0 109.999 179.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.544 ' CD1' ' N ' ' A' ' 23' ' ' TYR . 18.0 p90 -141.01 165.11 28.45 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.419 -0.8 . . . . 0.0 110.106 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.859 HD12 ' CD2' ' A' ' 29' ' ' LEU . 0.4 OUTLIER -125.76 149.88 30.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.217 -0.927 . . . . 0.0 109.96 -179.886 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.823 HD22 ' N ' ' A' ' 25' ' ' LEU . 2.9 mm? -90.99 154.64 19.3 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.26 -0.9 . . . . 0.0 110.238 -179.872 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.0 -37.64 78.83 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.3 -0.875 . . . . 0.0 110.112 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -65.89 -35.2 79.98 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.277 -0.889 . . . . 0.0 110.071 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.44 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 1.1 mt-10 -62.59 -43.99 97.43 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.322 -0.862 . . . . 0.0 109.93 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.859 ' CD2' HD12 ' A' ' 24' ' ' ILE . 3.8 mm? -62.55 -34.31 76.69 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.173 -0.955 . . . . 0.0 109.883 179.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.77 -39.05 80.43 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.312 -0.868 . . . . 0.0 110.175 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.74 -15.9 27.68 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.267 -0.895 . . . . 0.0 110.298 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.44 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 3.1 mm-40 -100.41 -23.58 14.71 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.109 -0.994 . . . . 0.0 110.383 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.9 HD23 ' HD2' ' A' ' 34' ' ' PRO . 0.3 OUTLIER -134.8 151.4 75.63 Favored Pre-proline 0 N--CA 1.487 1.395 0 O-C-N 121.103 -0.998 . . . . 0.0 110.306 -179.694 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.9 ' HD2' HD23 ' A' ' 33' ' ' LEU . 8.8 Cg_endo -50.5 140.41 35.73 Favored 'Trans proline' 0 C--N 1.304 -1.763 0 O-C-N 124.009 1.531 . . . . 0.0 110.218 179.727 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -43.72 -35.03 6.19 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 124.029 1.542 . . . . 0.0 110.328 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -62.68 -45.63 91.89 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.179 -0.951 . . . . 0.0 110.239 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.743 ' HG2' HG22 ' B' ' 17' ' ' VAL . 1.9 mp0 -69.33 -42.23 75.6 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.179 -0.951 . . . . 0.0 110.297 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.45 -48.42 79.21 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.243 -0.911 . . . . 0.0 110.225 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -57.48 -43.06 83.79 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.31 -0.869 . . . . 0.0 109.867 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -66.13 -44.22 84.85 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.284 -0.885 . . . . 0.0 110.127 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.475 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 5.5 m -59.52 -50.7 72.9 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.3 -0.875 . . . . 0.0 110.494 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 81.2 mt -60.0 -25.21 32.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.269 -0.895 . . . . 0.0 110.339 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.85 -40.37 72.41 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.27 -0.894 . . . . 0.0 109.721 179.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.615 ' HB2' ' CD2' ' A' ' 63' ' ' PHE . 11.1 mpt_? -84.46 -69.07 0.67 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.373 -0.829 . . . . 0.0 109.815 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.699 ' HE1' ' HB3' ' A' ' 60' ' ' TYR . 21.5 mtt -32.04 116.78 0.39 Allowed Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.775 -0.578 . . . . 0.0 111.197 179.42 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.692 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 38.8 Cg_exo . . . . . 0 C--N 1.305 -1.753 0 O-C-N 124.013 1.533 . . . . 0.0 110.048 179.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.507 ' C ' HD13 ' A' ' 58' ' ' LEU . . . . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 121.274 0.559 . . . . 0.0 110.016 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.854 HD22 ' N ' ' A' ' 58' ' ' LEU . 0.9 OUTLIER -105.6 160.73 14.96 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.28 -0.887 . . . . 0.0 110.217 -179.615 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.514 ' OD1' ' N ' ' A' ' 59' ' ' ASP . 1.5 p-10 -107.46 110.53 22.5 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.097 -1.002 . . . . 0.0 111.081 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.699 ' HB3' ' HE1' ' A' ' 45' ' ' MET . 16.0 p90 -72.77 -23.21 60.79 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.328 -0.858 . . . . 0.0 109.231 178.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.576 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.19 -41.92 72.59 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.273 -0.892 . . . . 0.0 108.719 179.436 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.692 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -58.89 -32.19 69.28 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 119.494 -0.882 . . . . 0.0 108.79 178.493 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.634 ' CZ ' HG22 ' B' ' 20' ' ' VAL . 26.2 t80 -59.7 -49.33 78.16 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 121.257 0.551 . . . . 0.0 110.708 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.474 ' OG ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -70.5 -37.25 74.16 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.123 -0.985 . . . . 0.0 110.78 -179.432 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 51.3 p -64.52 -41.78 96.18 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.149 -0.969 . . . . 0.0 110.467 -179.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -75.57 -40.69 56.31 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.148 -0.97 . . . . 0.0 110.507 -179.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.577 HD13 ' CD1' ' A' ' 63' ' ' PHE . 0.2 OUTLIER -64.02 -43.98 93.95 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.204 -0.935 . . . . 0.0 110.424 -179.713 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.778 ' CZ ' HG22 ' A' ' 6' ' ' THR . 24.5 m-85 . . . . . 0 N--CA 1.489 1.501 0 O-C-N 121.23 -0.919 . . . . 0.0 110.287 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.649 0 CA-C-O 121.248 0.547 . . . . 0.0 110.282 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.444 ' HA ' HG21 ' A' ' 16' ' ' ILE . 10.4 ttpt -62.3 -39.45 93.05 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.251 -0.906 . . . . 0.0 110.239 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.66 -40.04 86.42 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.211 -0.931 . . . . 0.0 110.15 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.31 -39.81 91.87 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.316 -0.865 . . . . 0.0 110.273 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . 0.808 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -61.98 -41.87 98.51 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.18 -0.95 . . . . 0.0 109.984 -179.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.669 HG13 ' HG ' ' A' ' 33' ' ' LEU . 59.0 t -63.65 -43.11 98.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.264 -0.898 . . . . 0.0 109.721 179.518 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.51 -42.21 95.91 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.317 -0.864 . . . . 0.0 110.005 179.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 22.8 m -64.57 -43.21 94.63 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.314 -0.866 . . . . 0.0 110.018 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.808 HG23 ' O ' ' B' ' 12' ' ' ALA . 30.9 t -63.61 -46.51 94.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.255 -0.903 . . . . 0.0 110.024 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.743 HG22 ' HG2' ' A' ' 37' ' ' GLN . 83.2 t -58.16 -42.32 82.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.245 -0.91 . . . . 0.0 109.944 179.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.67 -45.57 93.66 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.231 -0.918 . . . . 0.0 109.917 179.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.97 -42.06 90.35 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.301 -0.874 . . . . 0.0 109.957 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.634 HG22 ' CZ ' ' A' ' 63' ' ' PHE . 52.2 t -67.77 -43.2 86.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.278 -0.889 . . . . 0.0 110.045 179.837 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . 0.461 ' O ' ' HG2' ' B' ' 24' ' ' ARG . 2.0 t70 -64.2 -34.04 77.17 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.283 -0.885 . . . . 0.0 110.123 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.9 -36.58 82.6 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.232 -0.917 . . . . 0.0 110.243 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . 0.539 ' HB2' ' CD2' ' A' ' 67' ' ' LEU . . . -65.38 -42.77 92.32 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.238 -0.913 . . . . 0.0 110.618 -179.701 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . 0.461 ' HG2' ' O ' ' B' ' 21' ' ' ASP . 2.1 ptm180 . . . . . 0 N--CA 1.493 1.679 0 O-C-N 121.041 -1.037 . . . . 0.0 110.274 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.418 HG22 ' CZ ' ' A' ' 68' ' ' TYR . 4.2 m . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 121.265 0.555 . . . . 0.0 110.092 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -70.04 -46.25 65.42 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.162 -0.961 . . . . 0.0 109.909 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -54.64 -36.68 64.79 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.383 -0.823 . . . . 0.0 110.051 179.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.416 ' HG2' HG21 ' B' ' 15' ' ' THR . 40.6 tt0 -61.63 -43.09 99.51 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.255 -0.903 . . . . 0.0 110.236 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 98.2 t -61.79 -42.13 93.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.194 -0.941 . . . . 0.0 109.996 179.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.622 HG23 ' HE1' ' A' ' 60' ' ' TYR . 82.7 mt -57.41 -49.88 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.31 -0.869 . . . . 0.0 109.683 179.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.54 -37.61 76.04 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 119.504 -0.878 . . . . 0.0 108.796 178.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.475 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 41.7 m -67.66 -39.7 84.54 Favored 'General case' 0 N--CA 1.485 1.324 0 O-C-N 121.456 -0.778 . . . . 0.0 109.206 178.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.517 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 0.7 OUTLIER -68.41 -42.62 78.73 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.346 -0.847 . . . . 0.0 109.534 179.185 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -53.95 -41.57 67.92 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.245 -0.91 . . . . 0.0 108.939 179.077 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.8 mt -62.0 -41.11 89.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.459 -0.775 . . . . 0.0 109.611 179.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 13' ' ' SER . 26.7 mt -64.89 -41.94 95.19 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.256 -0.902 . . . . 0.0 109.456 179.455 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.666 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -77.14 -7.31 55.58 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.438 -0.789 . . . . 0.0 110.092 179.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.477 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 68.07 67.44 0.34 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.231 -0.918 . . . . 0.0 110.235 -179.908 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.413 ' O ' ' HG2' ' A' ' 21' ' ' LYS . 0.3 OUTLIER 59.85 61.84 1.82 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.246 -0.908 . . . . 0.0 110.3 179.885 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.666 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 6.3 mttt -147.92 142.78 16.93 Favored Pre-proline 0 N--CA 1.489 1.487 0 O-C-N 121.234 -0.916 . . . . 0.0 110.01 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 21' ' ' LYS . 35.2 Cg_exo -74.29 0.92 7.9 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 O-C-N 123.955 1.503 . . . . 0.0 110.081 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.477 ' CD1' ' HB1' ' A' ' 57' ' ' ALA . 45.5 p90 -145.83 164.82 30.73 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.259 -0.901 . . . . 0.0 110.159 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.815 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -131.62 141.91 44.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.162 -0.961 . . . . 0.0 110.2 -179.873 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.815 ' N ' HD13 ' A' ' 24' ' ' ILE . 4.2 mt -81.52 157.7 24.73 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.13 -0.981 . . . . 0.0 110.205 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.73 -41.06 75.8 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.302 -0.874 . . . . 0.0 110.32 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -60.7 -35.41 76.23 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.176 -0.953 . . . . 0.0 110.17 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.455 ' OE1' ' OE2' ' A' ' 32' ' ' GLU . 9.0 mt-10 -64.25 -44.11 92.82 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.348 -0.845 . . . . 0.0 109.925 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.637 HD12 HG13 ' A' ' 42' ' ' ILE . 18.0 mt -60.66 -33.72 73.24 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.203 -0.936 . . . . 0.0 109.609 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.594 HH12 HD13 ' A' ' 42' ' ' ILE . 18.9 mtt85 -67.89 -35.08 77.88 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.388 -0.82 . . . . 0.0 110.309 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.4 ttt180 -95.62 -20.62 18.81 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.164 -0.96 . . . . 0.0 110.82 -179.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.456 ' OE1' ' HB3' ' A' ' 17' ' ' LEU . 86.5 mt-10 -96.14 -23.78 16.59 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.05 -1.031 . . . . 0.0 110.466 -179.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.521 HD22 ' CB ' ' A' ' 37' ' ' GLN . 6.0 mt -129.44 153.59 80.62 Favored Pre-proline 0 C--N 1.305 -1.348 0 O-C-N 121.233 -0.917 . . . . 0.0 110.078 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.415 ' CD ' HD23 ' A' ' 33' ' ' LEU . 33.1 Cg_exo -56.19 154.46 28.45 Favored 'Trans proline' 0 C--N 1.306 -1.69 0 O-C-N 123.94 1.495 . . . . 0.0 110.264 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -47.68 -38.74 29.66 Favored 'Trans proline' 0 C--N 1.307 -1.652 0 O-C-N 124.048 1.551 . . . . 0.0 110.305 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.73 -46.33 85.87 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.248 -0.908 . . . . 0.0 110.291 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.621 ' HG2' HG22 ' B' ' 17' ' ' VAL . 9.6 mp0 -69.27 -44.42 71.92 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.282 -0.886 . . . . 0.0 110.383 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.904 ' O ' HD12 ' A' ' 42' ' ' ILE . . . -56.26 -48.07 77.29 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.175 -0.953 . . . . 0.0 110.367 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.8 tm0? -64.74 -43.02 94.7 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.226 -0.921 . . . . 0.0 110.191 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -64.93 -46.79 80.17 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.281 -0.887 . . . . 0.0 110.305 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.443 ' SG ' ' O ' ' A' ' 37' ' ' GLN . 62.2 m -65.46 -49.71 68.09 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.157 -0.965 . . . . 0.0 110.452 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.904 HD12 ' O ' ' A' ' 38' ' ' ALA . 6.3 mt -58.22 -24.03 23.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.221 -0.924 . . . . 0.0 110.38 -179.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.41 -30.3 33.62 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.156 -0.965 . . . . 0.0 110.367 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.576 ' HG3' ' CE1' ' A' ' 63' ' ' PHE . 2.2 mmt180 -86.27 -58.93 2.44 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.218 -0.927 . . . . 0.0 110.195 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.687 ' SD ' HG22 ' A' ' 24' ' ' ILE . 1.4 ttm -38.29 119.27 1.02 Allowed Pre-proline 0 N--CA 1.492 1.641 0 O-C-N 121.511 -0.743 . . . . 0.0 110.722 179.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.446 ' CD ' ' HB3' ' A' ' 62' ' ' ALA . 12.4 Cg_endo . . . . . 0 C--N 1.305 -1.736 0 O-C-N 123.937 1.493 . . . . 0.0 110.22 179.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.477 ' HB1' ' CD1' ' A' ' 23' ' ' TYR . . . . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 121.268 0.556 . . . . 0.0 110.207 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.487 ' CB ' ' HG2' ' A' ' 45' ' ' MET . 13.2 mt -92.71 155.76 17.49 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.186 -0.946 . . . . 0.0 110.17 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.472 ' C ' ' HG3' ' A' ' 45' ' ' MET . 4.4 m-20 -103.32 111.7 24.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.2 -0.938 . . . . 0.0 110.13 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.622 ' HE1' HG23 ' A' ' 11' ' ' ILE . 23.7 p90 -72.63 -22.35 60.96 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.389 -0.82 . . . . 0.0 110.157 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.488 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.01 -34.18 65.58 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.182 -0.949 . . . . 0.0 110.021 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.446 ' HB3' ' CD ' ' A' ' 46' ' ' PRO . . . -68.23 -36.49 79.58 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.234 -0.916 . . . . 0.0 109.827 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.606 ' CE1' ' HB3' ' A' ' 67' ' ' LEU . 3.5 t80 -72.1 -35.42 69.2 Favored 'General case' 0 C--N 1.297 -1.683 0 O-C-N 121.676 -0.64 . . . . 0.0 110.455 179.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.5 m -56.51 -49.76 73.78 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.258 -0.901 . . . . 0.0 110.567 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.5 m -66.15 -35.6 80.92 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.247 -0.908 . . . . 0.0 110.471 -179.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.13 -39.36 63.36 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.299 -0.875 . . . . 0.0 110.841 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.732 HD12 ' C ' ' A' ' 67' ' ' LEU . 0.3 OUTLIER -72.55 -41.22 66.02 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.099 -1.001 . . . . 0.0 110.413 -179.499 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.627 ' CD2' HD11 ' A' ' 67' ' ' LEU . 1.8 m-85 . . . . . 0 N--CA 1.491 1.625 0 O-C-N 121.38 -0.825 . . . . 0.0 110.206 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 5.6 ptpp? . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.217 0.532 . . . . 0.0 110.093 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.544 ' O ' HG23 ' B' ' 13' ' ' VAL . 6.2 ttmt -62.63 -45.67 91.77 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.277 -0.89 . . . . 0.0 109.983 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.52 -37.87 79.47 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.219 -0.926 . . . . 0.0 109.906 179.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -63.34 -43.08 98.77 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.238 -0.914 . . . . 0.0 110.014 179.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . 0.465 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -63.65 -37.56 87.81 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.299 -0.875 . . . . 0.0 110.088 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.591 ' O ' HG23 ' B' ' 17' ' ' VAL . 87.9 t -60.63 -43.27 94.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.269 -0.894 . . . . 0.0 110.018 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.07 -39.07 84.77 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.298 -0.876 . . . . 0.0 110.158 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . 0.416 HG21 ' HG2' ' A' ' 9' ' ' GLN . 53.0 m -65.52 -49.01 70.53 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.182 -0.949 . . . . 0.0 110.118 179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.607 ' O ' HG23 ' B' ' 20' ' ' VAL . 36.9 t -63.53 -40.73 90.15 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.319 -0.863 . . . . 0.0 110.21 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.621 HG22 ' HG2' ' A' ' 37' ' ' GLN . 71.6 t -61.94 -47.26 94.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.224 -0.922 . . . . 0.0 110.271 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.44 -41.1 96.75 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.161 -0.962 . . . . 0.0 110.425 -179.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.78 -45.6 81.82 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.18 -0.95 . . . . 0.0 110.371 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.607 HG23 ' O ' ' B' ' 16' ' ' VAL . 58.4 t -67.83 -45.91 83.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.178 -0.951 . . . . 0.0 110.39 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -56.88 -31.78 65.19 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.253 -0.904 . . . . 0.0 110.271 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -56.79 -49.88 74.0 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.268 -0.895 . . . . 0.0 110.572 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.94 -34.87 73.84 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.226 -0.921 . . . . 0.0 110.545 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 2.5 tpt180 . . . . . 0 N--CA 1.493 1.689 0 O-C-N 121.164 -0.96 . . . . 0.0 110.489 -179.654 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.824 HG21 ' OH ' ' A' ' 68' ' ' TYR . 2.0 m . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 121.261 0.553 . . . . 0.0 110.107 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.88 -44.99 83.71 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.237 -0.914 . . . . 0.0 109.628 179.626 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.14 -36.01 67.78 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.467 -0.771 . . . . 0.0 109.959 179.532 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -61.11 -44.17 97.76 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.296 -0.878 . . . . 0.0 110.273 -179.642 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.473 ' HB ' ' HB3' ' A' ' 64' ' ' SER . 22.8 t -58.62 -46.36 90.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.151 -0.968 . . . . 0.0 109.964 179.842 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 21.5 mt -65.18 -49.73 77.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.303 -0.873 . . . . 0.0 109.699 179.789 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.14 -40.84 91.2 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.268 -0.895 . . . . 0.0 109.177 179.274 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.471 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 68.1 m -67.02 -41.15 87.11 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.394 -0.816 . . . . 0.0 109.277 179.134 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.537 ' HB3' ' CD2' ' A' ' 60' ' ' TYR . 1.7 m-85 -68.2 -43.01 79.03 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.386 -0.821 . . . . 0.0 109.57 179.426 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.1 ttp180 -53.24 -41.19 65.2 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.217 -0.927 . . . . 0.0 109.124 179.222 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.5 mt -59.8 -44.86 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.446 -0.784 . . . . 0.0 109.504 179.151 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 13' ' ' SER . 18.4 mt -65.05 -41.68 94.94 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.287 -0.883 . . . . 0.0 109.701 179.508 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.629 ' HB1' ' O ' ' A' ' 23' ' ' TYR . . . -73.29 -1.41 17.82 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.307 -0.871 . . . . 0.0 110.074 179.778 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.489 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 1.4 t 68.28 64.92 0.34 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.198 -0.939 . . . . 0.0 110.267 -179.998 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 50.26 58.2 5.75 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.397 -0.814 . . . . 0.0 110.293 179.953 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.577 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 29.8 mttt -140.7 143.01 30.64 Favored Pre-proline 0 N--CA 1.49 1.56 0 O-C-N 121.303 -0.873 . . . . 0.0 110.085 179.852 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_endo -65.62 -7.6 16.81 Favored 'Trans proline' 0 C--N 1.305 -1.722 0 O-C-N 123.931 1.49 . . . . 0.0 110.122 179.83 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.629 ' O ' ' HB1' ' A' ' 18' ' ' ALA . 23.3 p90 -138.99 166.4 24.59 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.214 -0.929 . . . . 0.0 110.495 -179.927 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.727 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -136.32 144.48 32.85 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.374 -0.829 . . . . 0.0 109.87 -179.967 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.727 ' N ' HD13 ' A' ' 24' ' ' ILE . 4.0 mt -79.87 150.4 30.64 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.188 -0.945 . . . . 0.0 110.075 -179.825 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.581 ' HB2' HD11 ' A' ' 58' ' ' LEU . . . -67.17 -45.61 76.46 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.297 -0.877 . . . . 0.0 110.327 -179.875 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.456 ' CG ' ' N ' ' A' ' 28' ' ' GLU . 22.9 pt-20 -59.27 -37.54 77.88 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.138 -0.976 . . . . 0.0 109.747 179.883 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.456 ' N ' ' CG ' ' A' ' 27' ' ' GLU . 6.2 tt0 -66.75 -34.66 78.32 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.237 -0.914 . . . . 0.0 108.876 179.076 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.556 HD11 ' HA ' ' A' ' 38' ' ' ALA . 2.6 tp -66.67 -39.92 88.37 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 108.706 -0.849 . . . . 0.0 108.706 178.803 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.23 -34.43 78.09 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.561 -0.712 . . . . 0.0 109.544 179.065 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.7 tpt180 -84.46 -39.3 19.1 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.484 -0.76 . . . . 0.0 110.876 -179.792 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -76.15 -23.5 54.79 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.217 -0.927 . . . . 0.0 110.973 -179.084 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.684 HD11 HG11 ' B' ' 16' ' ' VAL . 4.2 mt -127.87 156.59 75.69 Favored Pre-proline 0 N--CA 1.488 1.458 0 O-C-N 121.07 -1.019 . . . . 0.0 110.228 -179.837 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.606 ' CD ' HD23 ' A' ' 33' ' ' LEU . 22.9 Cg_exo -60.01 142.49 98.55 Favored 'Trans proline' 0 C--N 1.304 -1.774 0 O-C-N 124.011 1.532 . . . . 0.0 110.184 179.979 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -41.68 -38.87 4.59 Favored 'Trans proline' 0 C--N 1.304 -1.773 0 O-C-N 124.065 1.561 . . . . 0.0 110.225 179.996 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -63.12 -43.28 98.87 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.337 -0.852 . . . . 0.0 110.242 179.956 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.794 ' HG3' HG22 ' B' ' 17' ' ' VAL . 25.0 mm100 -69.21 -41.99 76.34 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.188 -0.945 . . . . 0.0 109.981 179.966 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.556 ' HA ' HD11 ' A' ' 29' ' ' LEU . . . -63.67 -48.22 78.08 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.294 -0.879 . . . . 0.0 110.089 179.969 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -54.95 -48.6 72.96 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.251 -0.906 . . . . 0.0 109.926 179.932 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -64.01 -47.86 78.61 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.311 -0.868 . . . . 0.0 109.854 179.771 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.509 ' O ' ' HG2' ' A' ' 45' ' ' MET . 75.9 m -65.43 -49.57 68.69 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.341 -0.849 . . . . 0.0 110.381 179.929 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.474 HG12 ' O ' ' A' ' 38' ' ' ALA . 9.0 mm -41.54 -33.43 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.317 -0.865 . . . . 0.0 110.241 -179.893 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.44 -37.67 19.52 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.29 -0.881 . . . . 0.0 110.263 179.948 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.521 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 0.9 OUTLIER -65.79 -75.66 0.09 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.284 -0.885 . . . . 0.0 110.243 -179.878 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.549 ' CE ' ' HB3' ' A' ' 60' ' ' TYR . 6.3 ptp -53.02 108.58 1.14 Allowed Pre-proline 0 N--CA 1.488 1.462 0 O-C-N 121.22 -0.925 . . . . 0.0 110.175 179.952 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.506 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 17.3 Cg_exo . . . . . 0 C--N 1.305 -1.756 0 O-C-N 123.995 1.524 . . . . 0.0 110.326 -179.865 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.413 ' HB1' ' HB2' ' A' ' 23' ' ' TYR . . . . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.269 0.557 . . . . 0.0 110.334 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.581 HD11 ' HB2' ' A' ' 26' ' ' ALA . 91.7 mt -127.71 160.29 32.12 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.294 -0.879 . . . . 0.0 110.024 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -111.75 111.93 23.26 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.149 -0.969 . . . . 0.0 110.517 -179.775 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.549 ' HB3' ' CE ' ' A' ' 45' ' ' MET . 14.5 p90 -81.66 -19.82 40.87 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.318 -0.864 . . . . 0.0 109.647 179.415 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.422 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.03 -36.65 68.24 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.249 -0.907 . . . . 0.0 109.793 179.883 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.506 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -63.94 -34.95 79.14 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.224 -0.923 . . . . 0.0 109.763 179.593 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.953 ' CZ ' HD11 ' A' ' 67' ' ' LEU . 4.6 t80 -71.78 -32.74 67.96 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.567 -0.708 . . . . 0.0 110.114 179.628 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.473 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.9 OUTLIER -71.79 -49.29 40.02 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.348 -0.845 . . . . 0.0 110.297 -179.876 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 66.2 m -63.75 -42.34 97.86 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.251 -0.905 . . . . 0.0 110.301 -179.887 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.52 -28.75 65.18 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.188 -0.945 . . . . 0.0 110.27 -179.87 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.953 HD11 ' CZ ' ' A' ' 63' ' ' PHE . 8.4 mt -61.44 -42.41 98.71 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.205 -0.935 . . . . 0.0 110.365 -179.935 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.824 ' OH ' HG21 ' A' ' 6' ' ' THR . 20.1 m-85 . . . . . 0 N--CA 1.492 1.644 0 O-C-N 121.208 -0.932 . . . . 0.0 110.223 179.987 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 3.1 tmtm? . . . . . 0 N--CA 1.492 1.641 0 CA-C-O 121.268 0.556 . . . . 0.0 110.132 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.402 ' O ' HG23 ' B' ' 13' ' ' VAL . 0.7 OUTLIER -61.79 -44.69 96.37 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.18 -0.95 . . . . 0.0 110.147 179.974 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.01 -38.8 68.35 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.219 -0.926 . . . . 0.0 109.949 179.871 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -65.48 -39.93 92.51 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.286 -0.884 . . . . 0.0 110.017 179.806 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.28 -37.5 85.75 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.208 -0.933 . . . . 0.0 109.991 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.402 HG23 ' O ' ' B' ' 9' ' ' LYS . 51.9 t -65.0 -40.44 89.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.208 -0.933 . . . . 0.0 109.8 179.658 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.63 -35.59 76.57 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.326 -0.858 . . . . 0.0 110.058 179.843 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 41.2 m -68.1 -43.6 78.12 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.291 -0.88 . . . . 0.0 110.238 -179.981 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.684 HG11 HD11 ' A' ' 33' ' ' LEU . 92.1 t -66.6 -42.48 89.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.273 -0.892 . . . . 0.0 110.134 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.794 HG22 ' HG3' ' A' ' 37' ' ' GLN . 70.1 t -63.38 -47.54 91.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.406 -0.809 . . . . 0.0 110.313 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.31 -40.76 95.36 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.307 -0.871 . . . . 0.0 110.198 -179.976 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.67 -37.97 88.0 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.286 -0.884 . . . . 0.0 110.236 179.977 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.526 HG23 ' O ' ' B' ' 16' ' ' VAL . 54.5 t -67.92 -43.86 85.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.199 -0.938 . . . . 0.0 110.273 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 38.4 t0 -62.1 -35.57 79.1 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.308 -0.87 . . . . 0.0 110.366 -179.965 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -60.05 -50.08 75.12 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.222 -0.924 . . . . 0.0 110.297 -179.978 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . 0.43 ' HB2' ' CD2' ' A' ' 67' ' ' LEU . . . -63.76 -35.07 79.39 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.278 -0.889 . . . . 0.0 110.107 179.994 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.689 0 O-C-N 121.247 -0.908 . . . . 0.0 110.182 179.833 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 121.237 0.541 . . . . 0.0 110.191 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.68 -47.78 77.17 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.186 -0.946 . . . . 0.0 109.867 179.909 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.65 -36.15 64.26 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.425 -0.797 . . . . 0.0 109.981 179.586 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.45 -44.68 96.68 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.364 -0.835 . . . . 0.0 110.37 -179.711 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.48 HG21 HD21 ' A' ' 67' ' ' LEU . 88.6 t -57.99 -41.38 80.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.261 -0.9 . . . . 0.0 110.012 179.996 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 59.5 mt -63.65 -49.83 80.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.359 -0.838 . . . . 0.0 109.651 179.653 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.25 -42.45 91.15 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.284 -0.885 . . . . 0.0 109.033 179.22 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.471 ' HA ' HD12 ' A' ' 16' ' ' ILE . 0.1 OUTLIER -64.09 -39.43 94.05 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.379 -0.826 . . . . 0.0 109.302 179.033 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.623 ' CB ' ' CD1' ' A' ' 60' ' ' TYR . 3.1 m-85 -68.15 -42.17 80.51 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.308 -0.87 . . . . 0.0 109.51 179.282 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -55.85 -41.18 73.94 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.166 -0.959 . . . . 0.0 109.429 179.209 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.637 ' CD1' ' HB2' ' B' ' 12' ' ' ALA . 96.8 mt -60.27 -44.84 96.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.388 -0.82 . . . . 0.0 109.728 179.408 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 13' ' ' SER . 61.1 mt -64.98 -41.89 95.04 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.315 -0.866 . . . . 0.0 109.548 179.561 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.566 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -71.06 -15.27 62.53 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.357 -0.839 . . . . 0.0 110.089 179.625 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.478 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 68.05 72.25 0.31 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.291 -0.881 . . . . 0.0 110.339 -179.985 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.463 ' HB2' ' O ' ' A' ' 19' ' ' SER . 2.7 m-20 56.62 61.9 2.49 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.347 -0.845 . . . . 0.0 110.367 179.857 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.566 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 35.1 mttp -153.5 142.1 14.3 Favored Pre-proline 0 N--CA 1.489 1.49 0 O-C-N 121.274 -0.891 . . . . 0.0 110.093 179.878 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -76.59 3.9 6.02 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 O-C-N 124.092 1.575 . . . . 0.0 110.188 179.912 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.416 ' CD1' ' C ' ' A' ' 23' ' ' TYR . 20.6 p90 -145.9 156.52 43.59 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.185 -0.947 . . . . 0.0 110.026 179.999 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.827 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -125.67 142.74 41.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.169 -0.957 . . . . 0.0 109.735 179.997 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.827 ' N ' HD13 ' A' ' 24' ' ' ILE . 6.0 mp -80.14 145.81 32.15 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.132 -0.98 . . . . 0.0 109.919 -179.729 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.469 ' O ' ' HG ' ' A' ' 29' ' ' LEU . . . -58.68 -44.91 90.36 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.324 -0.86 . . . . 0.0 110.366 -179.628 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.77 -34.18 77.74 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.216 -0.928 . . . . 0.0 110.369 180.0 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.619 ' HB3' HD11 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -64.08 -51.08 65.74 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.12 -0.988 . . . . 0.0 110.288 -179.698 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.861 HD21 ' CG1' ' A' ' 42' ' ' ILE . 1.0 OUTLIER -67.27 -33.54 75.51 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.141 -0.974 . . . . 0.0 109.579 179.402 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.802 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -61.23 -35.0 76.04 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.524 -0.735 . . . . 0.0 110.347 -179.965 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.2 ttt180 -94.03 -17.83 22.48 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.221 -0.925 . . . . 0.0 110.262 -179.949 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -90.09 -21.62 22.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.273 -0.892 . . . . 0.0 110.246 179.972 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.702 HD11 HG11 ' B' ' 16' ' ' VAL . 11.2 mt -117.59 154.27 50.69 Favored Pre-proline 0 N--CA 1.487 1.395 0 O-C-N 121.261 -0.899 . . . . 0.0 110.249 -179.698 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.468 ' HD2' ' HB2' ' A' ' 37' ' ' GLN . 39.7 Cg_exo -59.24 153.87 50.17 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 O-C-N 123.875 1.461 . . . . 0.0 110.134 179.788 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -43.89 -44.1 11.95 Favored 'Trans proline' 0 C--N 1.305 -1.72 0 O-C-N 124.088 1.573 . . . . 0.0 110.542 -179.857 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.424 ' O ' ' HB2' ' A' ' 40' ' ' TYR . 0.3 OUTLIER -65.53 -46.91 77.76 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.273 -0.892 . . . . 0.0 110.393 -179.835 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.612 ' HG2' HG22 ' B' ' 17' ' ' VAL . 3.8 mp0 -69.69 -41.82 74.94 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.202 -0.936 . . . . 0.0 110.377 -179.935 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.802 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -59.21 -48.38 81.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.183 -0.948 . . . . 0.0 110.374 -179.811 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 -66.23 -43.48 86.49 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.25 -0.906 . . . . 0.0 110.37 -179.894 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.424 ' HB2' ' O ' ' A' ' 36' ' ' ASP . 1.2 t80 -62.31 -47.08 85.88 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.31 -0.869 . . . . 0.0 110.548 -179.76 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.455 ' O ' ' SD ' ' A' ' 45' ' ' MET . 71.9 m -62.43 -51.17 68.59 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.284 -0.885 . . . . 0.0 110.508 -179.668 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.861 ' CG1' HD21 ' A' ' 29' ' ' LEU . 53.3 mt -58.84 -19.08 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.244 -0.91 . . . . 0.0 110.332 -179.96 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 4.9 tttm -85.22 -19.98 30.84 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.323 -0.861 . . . . 0.0 110.529 -179.717 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.601 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 12.6 mmt85 -100.35 -72.82 0.66 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.176 -0.953 . . . . 0.0 110.759 -179.56 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.531 ' N ' ' HB2' ' A' ' 63' ' ' PHE . 1.4 ptm -45.25 127.47 5.85 Favored Pre-proline 0 N--CA 1.487 1.412 0 O-C-N 121.14 -0.975 . . . . 0.0 110.265 -179.698 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.706 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 9.4 Cg_endo . . . . . 0 C--N 1.305 -1.738 0 O-C-N 124.084 1.571 . . . . 0.0 110.3 -179.94 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.591 0 CA-C-O 121.069 0.461 . . . . 0.0 110.213 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.5 HD12 ' N ' ' A' ' 58' ' ' LEU . 2.5 mp -129.03 143.66 50.94 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.223 -0.923 . . . . 0.0 110.089 179.592 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.543 ' OD1' ' HB3' ' A' ' 61' ' ' ALA . 7.7 t0 -94.69 111.29 23.06 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.18 -0.95 . . . . 0.0 110.244 179.755 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.623 ' CD1' ' CB ' ' A' ' 14' ' ' PHE . 21.7 p90 -76.87 -25.29 52.92 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.189 -0.944 . . . . 0.0 108.882 179.118 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.543 ' HB3' ' OD1' ' A' ' 59' ' ' ASP . . . -56.42 -45.35 80.76 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.519 -0.738 . . . . 0.0 109.449 179.33 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.706 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -57.16 -36.15 70.4 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.346 -0.846 . . . . 0.0 109.643 179.549 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.601 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 1.6 t80 -71.8 -37.86 70.32 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.647 -0.658 . . . . 0.0 110.004 179.581 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.4 p -56.03 -49.73 72.89 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.313 -0.867 . . . . 0.0 110.234 -179.897 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.1 m -62.27 -37.3 84.95 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.165 -0.96 . . . . 0.0 110.064 179.892 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.89 -39.05 64.17 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.234 -0.916 . . . . 0.0 110.115 179.753 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.701 HD12 ' C ' ' A' ' 67' ' ' LEU . 0.1 OUTLIER -60.32 -44.86 95.08 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.247 -0.908 . . . . 0.0 109.593 179.893 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.557 ' N ' ' HG ' ' A' ' 67' ' ' LEU . 4.5 m-85 . . . . . 0 N--CA 1.492 1.65 0 O-C-N 121.569 -0.707 . . . . 0.0 110.239 179.985 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 24.6 ttmt . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 121.157 0.503 . . . . 0.0 110.153 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.413 ' HA ' HG21 ' A' ' 16' ' ' ILE . 8.7 ttpt -62.37 -48.44 79.78 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.274 -0.891 . . . . 0.0 110.174 -179.935 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.74 -40.22 72.21 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.196 -0.94 . . . . 0.0 109.986 179.915 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.35 -41.43 98.85 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.215 -0.928 . . . . 0.0 109.974 179.855 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . 0.637 ' HB2' ' CD1' ' A' ' 16' ' ' ILE . . . -62.86 -42.83 99.9 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.276 -0.89 . . . . 0.0 110.057 179.909 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.665 ' O ' HG23 ' B' ' 17' ' ' VAL . 79.0 t -57.53 -43.06 82.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.261 -0.899 . . . . 0.0 110.057 179.829 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.94 -37.55 85.13 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.338 -0.851 . . . . 0.0 109.97 179.849 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . 0.402 ' HB ' ' OG ' ' A' ' 13' ' ' SER . 11.8 m -64.61 -44.26 91.13 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.296 -0.878 . . . . 0.0 109.879 179.91 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.702 HG11 HD11 ' A' ' 33' ' ' LEU . 73.5 t -65.71 -45.54 91.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.294 -0.879 . . . . 0.0 110.043 179.935 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.665 HG23 ' O ' ' B' ' 13' ' ' VAL . 59.5 t -58.42 -45.84 89.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.255 -0.903 . . . . 0.0 110.116 179.914 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.36 -43.79 93.45 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.297 -0.877 . . . . 0.0 110.256 179.993 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.44 -45.86 82.18 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.279 -0.888 . . . . 0.0 110.2 -179.95 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.427 HG23 ' O ' ' B' ' 16' ' ' VAL . 54.8 t -60.22 -41.17 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.259 -0.9 . . . . 0.0 110.056 179.826 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -64.79 -33.01 74.98 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.364 -0.835 . . . . 0.0 110.143 179.994 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.36 -49.98 75.71 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.206 -0.934 . . . . 0.0 110.027 179.881 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.42 -40.42 97.13 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.253 -0.905 . . . . 0.0 109.993 179.805 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 2.4 ttp85 . . . . . 0 N--CA 1.492 1.627 0 O-C-N 121.37 -0.831 . . . . 0.0 110.316 -179.966 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.601 HG22 ' CZ ' ' A' ' 68' ' ' TYR . 7.4 m . . . . . 0 N--CA 1.492 1.641 0 CA-C-O 121.096 0.474 . . . . 0.0 110.248 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -68.41 -36.2 78.75 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.158 -0.964 . . . . 0.0 109.561 179.702 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.593 ' HA ' HD12 ' A' ' 11' ' ' ILE . 0.5 OUTLIER -70.69 -36.49 73.32 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.401 -0.812 . . . . 0.0 109.812 179.474 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.57 -42.62 99.11 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.33 -0.856 . . . . 0.0 110.081 179.9 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.527 HG12 ' CD2' ' A' ' 14' ' ' PHE . 96.0 t -60.61 -46.44 95.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.224 -0.922 . . . . 0.0 109.829 179.643 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.593 HD12 ' HA ' ' A' ' 8' ' ' GLU . 56.8 mt -54.73 -45.78 73.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.328 -0.858 . . . . 0.0 109.393 179.471 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.72 -41.07 81.03 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.22 -0.925 . . . . 0.0 108.635 178.859 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.4 m -68.21 -37.95 81.42 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 178.718 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.577 ' HB3' ' CD1' ' A' ' 60' ' ' TYR . 1.9 m-85 -68.39 -41.95 79.77 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.452 -0.78 . . . . 0.0 109.387 179.033 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -54.15 -46.42 72.27 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.407 -0.808 . . . . 0.0 109.393 179.355 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 53.2 mt -58.13 -43.69 85.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.389 -0.819 . . . . 0.0 109.501 179.336 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.481 HD11 HG22 ' B' ' 13' ' ' VAL . 2.5 mp -65.0 -40.13 94.49 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.397 -0.814 . . . . 0.0 109.748 179.485 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.669 ' HB2' ' HB ' ' A' ' 24' ' ' ILE . . . -77.19 -1.35 29.02 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.374 -0.829 . . . . 0.0 110.246 179.739 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.483 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 0.3 OUTLIER 68.71 63.87 0.32 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.226 -0.922 . . . . 0.0 110.308 179.965 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 51.68 59.02 4.87 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.19 -0.944 . . . . 0.0 110.141 179.937 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 19' ' ' SER . 9.0 mttt -145.46 142.92 18.75 Favored Pre-proline 0 N--CA 1.49 1.525 0 O-C-N 121.248 -0.908 . . . . 0.0 110.071 179.985 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -69.63 -4.84 14.76 Favored 'Trans proline' 0 C--N 1.305 -1.723 0 O-C-N 123.973 1.512 . . . . 0.0 109.907 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.434 ' CD1' ' C ' ' A' ' 23' ' ' TYR . 19.6 p90 -144.77 161.9 38.09 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.349 -0.844 . . . . 0.0 109.884 179.866 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.669 ' HB ' ' HB2' ' A' ' 18' ' ' ALA . 11.3 tt -139.32 153.14 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.137 -0.977 . . . . 0.0 110.311 -179.823 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.2 mp -89.24 156.24 18.89 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.309 -0.87 . . . . 0.0 109.964 179.798 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.38 -42.23 92.92 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.172 -0.955 . . . . 0.0 110.256 -179.825 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -56.45 -40.48 74.87 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.28 -0.887 . . . . 0.0 110.152 179.931 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 1.9 mt-10 -68.32 -41.12 81.31 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.212 -0.93 . . . . 0.0 108.771 179.215 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.702 HD23 HG13 ' A' ' 42' ' ' ILE . 3.3 tp -66.83 -38.84 87.19 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 179.012 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.5 ttm180 -66.96 -34.58 78.08 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.559 -0.713 . . . . 0.0 110.587 -179.923 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.08 -20.26 22.24 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.21 -0.931 . . . . 0.0 111.04 -179.391 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.461 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 86.2 mt-10 -94.87 -19.26 20.44 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.012 -1.055 . . . . 0.0 110.814 -179.447 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.617 HD12 ' CD1' ' A' ' 29' ' ' LEU . 5.7 mt -120.92 162.06 37.03 Favored Pre-proline 0 N--CA 1.489 1.498 0 O-C-N 121.079 -1.013 . . . . 0.0 110.303 -179.857 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.492 ' CD ' HD23 ' A' ' 33' ' ' LEU . 32.5 Cg_exo -67.76 148.43 77.27 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 124.032 1.543 . . . . 0.0 110.246 179.914 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.402 ' C ' ' O ' ' A' ' 34' ' ' PRO . 16.6 Cg_exo -41.78 -40.59 5.73 Favored 'Trans proline' 0 C--N 1.303 -1.864 0 O-C-N 124.116 1.588 . . . . 0.0 110.496 -179.823 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -63.58 -47.25 82.27 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.223 -0.923 . . . . 0.0 110.37 -179.705 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.636 ' HG2' HG22 ' B' ' 17' ' ' VAL . 14.5 mp0 -69.58 -40.85 76.47 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.192 -0.943 . . . . 0.0 110.267 179.957 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.865 ' O ' HD12 ' A' ' 42' ' ' ILE . . . -58.88 -47.84 83.51 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.303 -0.873 . . . . 0.0 110.299 -179.921 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 48.7 tp60 -61.63 -48.83 79.12 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.309 -0.869 . . . . 0.0 110.378 -179.906 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.19 -42.22 89.15 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.235 -0.916 . . . . 0.0 110.228 179.991 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 13.7 m -63.65 -48.24 78.03 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.305 -0.872 . . . . 0.0 110.15 179.885 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.865 HD12 ' O ' ' A' ' 38' ' ' ALA . 1.2 mt -61.23 -21.24 24.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.274 -0.891 . . . . 0.0 110.071 -179.993 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -81.56 -39.79 24.08 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.15 -0.969 . . . . 0.0 110.144 179.794 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.599 ' HB2' ' CD2' ' A' ' 63' ' ' PHE . 40.4 mmt-85 -77.11 -66.09 0.87 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.273 -0.892 . . . . 0.0 109.97 179.805 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.634 ' HE3' ' CB ' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -29.91 114.92 0.31 Allowed Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.9 -0.5 . . . . 0.0 111.471 179.648 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.801 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 18.5 Cg_endo . . . . . 0 C--N 1.305 -1.743 0 O-C-N 124.003 1.528 . . . . 0.0 109.932 179.649 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.756 ' C ' HD22 ' A' ' 58' ' ' LEU . . . . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.33 0.586 . . . . 0.0 110.143 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.789 HD22 ' N ' ' A' ' 58' ' ' LEU . 3.1 mm? -113.66 160.49 18.55 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.361 -0.837 . . . . 0.0 110.021 179.962 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.886 ' OD1' ' HB3' ' A' ' 61' ' ' ALA . 6.9 t70 -109.38 110.23 21.31 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.993 -1.067 . . . . 0.0 111.008 -179.915 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.634 ' CB ' ' HE3' ' A' ' 45' ' ' MET . 26.4 p90 -73.1 -23.61 60.53 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 178.192 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.886 ' HB3' ' OD1' ' A' ' 59' ' ' ASP . . . -56.29 -40.68 74.67 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.702 -0.624 . . . . 0.0 109.71 179.667 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.801 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -56.4 -32.17 64.57 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.241 -0.912 . . . . 0.0 109.619 179.532 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.599 ' CD2' ' HB2' ' A' ' 44' ' ' ARG . 1.7 t80 -65.78 -47.6 74.63 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.6 -0.688 . . . . 0.0 110.559 179.976 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.0 t -55.81 -47.53 77.0 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.168 -0.958 . . . . 0.0 110.759 -179.288 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.32 -39.19 92.13 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.14 -0.975 . . . . 0.0 110.521 -179.721 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.26 -30.53 57.89 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.149 -0.969 . . . . 0.0 110.556 -179.656 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.815 HD13 ' HB2' ' B' ' 23' ' ' ALA . 0.6 OUTLIER -78.59 -45.2 22.24 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.119 -0.988 . . . . 0.0 109.603 -179.955 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.601 ' CZ ' HG22 ' A' ' 6' ' ' THR . 17.1 m-85 . . . . . 0 N--CA 1.491 1.607 0 O-C-N 121.535 -0.728 . . . . 0.0 110.316 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.155 0.503 . . . . 0.0 110.161 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.728 ' O ' HG23 ' B' ' 13' ' ' VAL . 2.4 ttmt -57.84 -50.04 74.62 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.2 -0.938 . . . . 0.0 109.926 179.863 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.0 -38.36 67.79 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.184 -0.948 . . . . 0.0 109.706 179.66 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -67.79 -41.03 83.82 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.407 -0.808 . . . . 0.0 109.874 179.684 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.53 -37.67 88.36 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.315 -0.865 . . . . 0.0 109.902 179.718 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.728 HG23 ' O ' ' B' ' 9' ' ' LYS . 46.5 t -61.1 -41.51 89.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.266 -0.896 . . . . 0.0 109.998 179.732 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.95 -42.94 99.97 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.264 -0.897 . . . . 0.0 110.022 179.778 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 90.6 m -61.29 -43.2 99.26 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.22 -0.925 . . . . 0.0 110.159 179.88 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.663 ' O ' HG23 ' B' ' 20' ' ' VAL . 98.2 t -64.81 -41.27 91.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.177 -0.952 . . . . 0.0 110.053 179.86 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.664 HG23 ' O ' ' B' ' 13' ' ' VAL . 86.5 t -59.87 -46.31 93.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.295 -0.878 . . . . 0.0 110.271 -179.964 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.17 -39.63 94.41 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.247 -0.908 . . . . 0.0 110.27 -179.948 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.42 -41.49 96.58 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.257 -0.902 . . . . 0.0 110.399 -179.855 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.663 HG23 ' O ' ' B' ' 16' ' ' VAL . 61.4 t -67.01 -41.67 87.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.225 -0.922 . . . . 0.0 110.367 -179.807 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.86 -40.14 91.8 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.269 -0.894 . . . . 0.0 110.303 -179.964 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.21 -49.03 72.99 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.251 -0.905 . . . . 0.0 110.287 -179.977 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . 0.815 ' HB2' HD13 ' A' ' 67' ' ' LEU . . . -63.02 -37.44 87.18 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.277 -0.889 . . . . 0.0 110.233 179.997 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 9.9 ttp180 . . . . . 0 N--CA 1.492 1.639 0 O-C-N 121.271 -0.893 . . . . 0.0 110.05 179.925 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.351 0.596 . . . . 0.0 110.134 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -66.16 -46.82 76.09 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.262 -0.899 . . . . 0.0 109.725 179.826 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.571 ' HA ' HD12 ' A' ' 11' ' ' ILE . 23.4 tt0 -54.52 -36.78 64.6 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.358 -0.839 . . . . 0.0 109.82 179.633 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -62.02 -48.39 80.49 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.29 -0.881 . . . . 0.0 109.91 179.92 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.531 HG12 ' HD2' ' A' ' 14' ' ' PHE . 77.7 t -58.92 -43.25 88.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.251 -0.906 . . . . 0.0 109.773 179.657 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.571 HD12 ' HA ' ' A' ' 8' ' ' GLU . 45.0 mt -62.0 -47.07 94.92 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.305 -0.872 . . . . 0.0 109.545 179.433 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.56 -42.13 82.41 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.324 -0.86 . . . . 0.0 108.944 179.175 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.473 ' O ' HD13 ' A' ' 17' ' ' LEU . 0.8 OUTLIER -68.43 -40.39 81.19 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.416 -0.802 . . . . 0.0 109.277 179.004 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.558 ' HB3' ' CD1' ' A' ' 60' ' ' TYR . 1.7 m-85 -65.26 -42.94 92.73 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.242 -0.911 . . . . 0.0 109.587 179.396 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 35.8 ttm-85 -55.96 -47.08 78.27 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.302 -0.873 . . . . 0.0 109.579 179.388 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.1 mt -60.73 -41.14 87.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.398 -0.814 . . . . 0.0 109.649 179.403 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.531 HD23 ' OE2' ' A' ' 32' ' ' GLU . 5.5 mp -64.86 -40.5 95.24 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.419 -0.8 . . . . 0.0 109.781 179.602 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.585 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -73.65 -4.89 37.04 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.405 -0.809 . . . . 0.0 110.103 179.842 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.458 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.1 OUTLIER 67.46 59.42 0.5 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.298 -0.876 . . . . 0.0 110.158 -179.948 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.423 ' CB ' ' O ' ' A' ' 19' ' ' SER . 0.2 OUTLIER 63.96 64.66 0.74 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.276 -0.89 . . . . 0.0 110.295 179.939 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.585 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 73.4 mttt -153.02 143.6 15.67 Favored Pre-proline 0 N--CA 1.489 1.491 0 O-C-N 121.212 -0.93 . . . . 0.0 110.093 -179.979 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -75.69 2.0 7.44 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 O-C-N 123.957 1.504 . . . . 0.0 110.011 179.539 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.549 ' CD1' ' N ' ' A' ' 23' ' ' TYR . 14.7 p90 -142.48 169.7 17.09 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.326 -0.858 . . . . 0.0 109.952 179.949 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.823 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -137.27 141.63 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.104 -0.998 . . . . 0.0 110.165 -179.897 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.823 ' N ' HD13 ' A' ' 24' ' ' ILE . 1.4 mp -81.54 153.6 26.69 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.21 -0.931 . . . . 0.0 110.127 -179.925 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.478 ' O ' ' HG ' ' A' ' 29' ' ' LEU . . . -68.27 -38.53 81.82 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.366 -0.834 . . . . 0.0 110.403 -179.775 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -69.25 -34.2 74.43 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.252 -0.905 . . . . 0.0 109.937 179.852 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.498 ' OE2' ' HA ' ' A' ' 18' ' ' ALA . 14.5 tt0 -65.5 -50.97 63.29 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.23 -0.919 . . . . 0.0 109.951 -179.98 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.733 HD12 ' C ' ' A' ' 29' ' ' LEU . 1.2 pp -67.3 -33.74 75.91 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.187 -0.945 . . . . 0.0 109.716 179.378 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.636 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 10.3 mtt-85 -63.73 -34.1 77.13 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.427 -0.796 . . . . 0.0 110.381 179.974 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.14 -16.33 29.78 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.205 -0.934 . . . . 0.0 111.255 -179.174 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.562 ' CG ' ' HA ' ' A' ' 29' ' ' LEU . 0.8 OUTLIER -99.51 -23.77 14.99 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.807 -1.183 . . . . 0.0 110.726 -179.667 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.652 HD22 ' HB3' ' A' ' 37' ' ' GLN . 4.3 mt -108.89 139.86 21.31 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.229 -0.919 . . . . 0.0 110.44 -179.994 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.492 ' HD2' HD23 ' A' ' 33' ' ' LEU . 37.5 Cg_exo -44.36 139.47 6.61 Favored 'Trans proline' 0 C--N 1.306 -1.693 0 O-C-N 123.962 1.506 . . . . 0.0 109.87 179.676 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.438 ' C ' ' O ' ' A' ' 34' ' ' PRO . 24.9 Cg_exo -39.92 -39.01 2.13 Favored 'Trans proline' 0 C--N 1.306 -1.693 0 O-C-N 124.027 1.541 . . . . 0.0 110.574 -179.563 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.16 -45.98 79.03 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.244 -0.91 . . . . 0.0 110.805 -179.891 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.652 ' HB3' HD22 ' A' ' 33' ' ' LEU . 98.3 mm-40 -69.64 -44.34 70.8 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.032 -1.043 . . . . 0.0 110.413 -179.664 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.636 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -58.16 -49.24 77.71 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.315 -0.866 . . . . 0.0 110.56 -179.553 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -58.97 -40.85 86.0 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.152 -0.967 . . . . 0.0 110.412 -179.887 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.29 -47.97 71.91 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.254 -0.904 . . . . 0.0 110.356 -179.88 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.573 ' HA ' ' CE1' ' A' ' 63' ' ' PHE . 48.1 m -63.02 -48.33 79.23 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.236 -0.915 . . . . 0.0 110.371 -179.863 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.644 ' CD1' HD21 ' A' ' 29' ' ' LEU . 12.4 mm -47.1 -19.3 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.303 -0.873 . . . . 0.0 111.225 -179.854 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.28 -24.12 30.04 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.969 -1.082 . . . . 0.0 111.527 -179.072 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.664 ' NH1' HD21 ' A' ' 67' ' ' LEU . 36.7 mtt180 -95.79 -69.91 0.73 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 120.862 -1.149 . . . . 0.0 110.862 -179.419 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.567 ' C ' ' O ' ' A' ' 44' ' ' ARG . 2.1 mtp -14.99 84.13 0.03 OUTLIER Pre-proline 0 N--CA 1.507 2.399 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -179.477 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.743 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 35.4 Cg_exo . . . . . 0 C--N 1.307 -1.64 0 O-C-N 124.053 1.554 . . . . 0.0 110.28 -179.923 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.332 0.587 . . . . 0.0 110.274 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 79.1 mt -121.06 157.44 30.04 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.195 -0.941 . . . . 0.0 109.962 179.813 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -104.54 112.07 25.0 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.209 -0.932 . . . . 0.0 110.527 -179.911 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.558 ' CD1' ' HB3' ' A' ' 14' ' ' PHE . 23.2 p90 -81.19 -19.43 43.33 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.298 -0.876 . . . . 0.0 109.353 179.483 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.427 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.86 -40.83 73.46 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.326 -0.859 . . . . 0.0 109.264 179.575 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.743 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -58.36 -32.31 68.45 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.328 -0.858 . . . . 0.0 108.981 179.083 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.887 ' O ' HD12 ' A' ' 67' ' ' LEU . 6.1 t80 -58.65 -45.45 89.3 Favored 'General case' 0 C--N 1.3 -1.558 0 CA-C-O 121.278 0.561 . . . . 0.0 110.219 179.607 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 81.2 p -72.44 -45.02 61.5 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.191 -0.943 . . . . 0.0 110.554 -179.78 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 47.2 t -68.42 -41.04 80.97 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.255 -0.903 . . . . 0.0 110.576 -179.642 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.25 -35.44 71.42 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.209 -0.932 . . . . 0.0 110.594 -179.683 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.887 HD12 ' O ' ' A' ' 63' ' ' PHE . 11.2 mt -74.94 -41.14 60.21 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.172 -0.955 . . . . 0.0 110.556 -179.705 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 . . . . . 0 N--CA 1.491 1.59 0 O-C-N 121.154 -0.966 . . . . 0.0 110.307 -179.783 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 121.284 0.564 . . . . 0.0 110.279 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.401 ' O ' HG23 ' B' ' 13' ' ' VAL . 0.0 OUTLIER -60.36 -44.05 95.95 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.302 -0.873 . . . . 0.0 110.241 -179.997 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.16 -35.95 74.42 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.195 -0.94 . . . . 0.0 110.067 179.993 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -65.42 -40.62 93.56 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.268 -0.895 . . . . 0.0 109.91 179.855 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . 0.418 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -64.17 -44.32 92.42 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.292 -0.88 . . . . 0.0 110.234 179.96 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.609 ' O ' HG23 ' B' ' 17' ' ' VAL . 47.5 t -62.25 -46.25 96.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.229 -0.919 . . . . 0.0 110.042 -179.914 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.49 -35.42 72.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.281 -0.887 . . . . 0.0 110.038 179.905 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 8.8 m -66.2 -42.87 88.22 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.267 -0.895 . . . . 0.0 109.97 179.737 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.761 ' O ' HG23 ' B' ' 20' ' ' VAL . 53.3 t -67.16 -43.3 88.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.21 -0.931 . . . . 0.0 110.103 179.907 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.609 HG23 ' O ' ' B' ' 13' ' ' VAL . 59.2 t -61.4 -44.92 99.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.354 -0.841 . . . . 0.0 110.315 -179.905 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.14 -43.54 94.92 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.222 -0.924 . . . . 0.0 110.213 179.865 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.37 -40.59 96.14 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.28 -0.887 . . . . 0.0 110.213 -179.898 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.761 HG23 ' O ' ' B' ' 16' ' ' VAL . 65.6 t -67.49 -42.52 87.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.153 -0.967 . . . . 0.0 110.101 179.993 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -63.17 -40.13 96.65 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.274 -0.891 . . . . 0.0 110.132 179.919 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -54.21 -49.96 68.2 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.288 -0.883 . . . . 0.0 109.846 179.908 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . 0.479 ' HB2' HD22 ' A' ' 67' ' ' LEU . . . -58.27 -42.41 86.47 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.192 -0.942 . . . . 0.0 109.795 179.632 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 5.0 ttp180 . . . . . 0 N--CA 1.49 1.535 0 O-C-N 121.303 -0.873 . . . . 0.0 109.99 179.837 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.1 m . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.262 0.553 . . . . 0.0 110.271 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.582 ' HA ' ' CZ ' ' A' ' 68' ' ' TYR . . . -65.22 -46.55 80.17 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.193 -0.942 . . . . 0.0 109.948 179.925 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.78 -36.54 69.98 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.28 -0.888 . . . . 0.0 109.831 179.485 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.57 -43.36 99.01 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.341 -0.849 . . . . 0.0 110.181 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.868 HG21 ' OH ' ' A' ' 68' ' ' TYR . 65.6 t -59.07 -44.87 92.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.09 -1.006 . . . . 0.0 109.777 179.732 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 44.4 mt -57.1 -49.72 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.404 -0.81 . . . . 0.0 109.465 179.574 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.78 -39.24 84.23 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.309 -0.869 . . . . 0.0 108.829 178.901 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.504 ' HB3' HG23 ' B' ' 16' ' ' VAL . 70.8 m -65.41 -40.54 93.52 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.465 -0.772 . . . . 0.0 109.099 178.898 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -66.82 -43.88 82.65 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.343 -0.848 . . . . 0.0 109.366 179.102 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -53.35 -41.21 65.58 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.353 -0.842 . . . . 0.0 109.153 179.049 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.526 HD12 ' HB2' ' B' ' 12' ' ' ALA . 49.3 mt -59.18 -45.09 93.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.426 -0.796 . . . . 0.0 109.687 179.326 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 13' ' ' SER . 15.4 mt -65.09 -41.83 94.63 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.185 -0.947 . . . . 0.0 109.41 179.386 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.5 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -71.12 -7.27 45.44 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.527 -0.733 . . . . 0.0 110.123 179.826 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.486 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 1.5 t 68.38 64.3 0.34 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.24 -0.912 . . . . 0.0 110.199 -179.971 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 58.2 66.35 1.12 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.257 -0.902 . . . . 0.0 110.312 179.969 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.5 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 64.5 mttt -153.15 143.22 15.31 Favored Pre-proline 0 N--CA 1.49 1.537 0 O-C-N 121.248 -0.908 . . . . 0.0 110.023 179.992 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -75.28 2.17 7.06 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 O-C-N 123.983 1.517 . . . . 0.0 110.156 179.703 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.431 ' CZ ' ' HD3' ' A' ' 21' ' ' LYS . 23.7 p90 -141.66 160.65 39.72 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.202 -0.936 . . . . 0.0 110.075 179.951 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.855 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -130.31 140.79 47.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.228 -0.92 . . . . 0.0 109.937 179.916 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.855 ' N ' HD13 ' A' ' 24' ' ' ILE . 1.1 mt -81.85 148.32 28.89 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.223 -0.923 . . . . 0.0 110.45 -179.733 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.77 -44.84 95.14 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.373 -0.829 . . . . 0.0 109.953 179.818 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -56.52 -36.28 69.02 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.276 -0.89 . . . . 0.0 109.869 179.744 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.517 ' O ' ' N ' ' A' ' 32' ' ' GLU . 0.6 OUTLIER -62.73 -42.22 99.56 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.416 -0.803 . . . . 0.0 109.681 179.742 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.743 HD13 ' HB3' ' A' ' 41' ' ' CYS . 17.5 mt -58.32 -34.2 70.33 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.272 -0.892 . . . . 0.0 109.532 179.634 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 9.6 mtm-85 -66.92 -38.68 86.65 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.343 -0.848 . . . . 0.0 109.828 179.597 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.76 -12.16 24.06 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.297 -0.877 . . . . 0.0 110.665 -179.754 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.517 ' N ' ' O ' ' A' ' 28' ' ' GLU . 11.3 mm-40 -96.76 -23.55 16.36 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.095 -1.003 . . . . 0.0 110.451 -179.819 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.598 ' CD2' HG22 ' B' ' 17' ' ' VAL . 1.4 mt -136.75 157.03 75.72 Favored Pre-proline 0 C--N 1.306 -1.317 0 O-C-N 121.166 -0.959 . . . . 0.0 110.102 -179.769 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.548 ' HD2' HD23 ' A' ' 33' ' ' LEU . 32.7 Cg_exo -46.25 171.21 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.735 0 O-C-N 123.861 1.453 . . . . 0.0 110.075 179.777 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_endo -64.77 -41.92 16.96 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 O-C-N 123.921 1.485 . . . . 0.0 110.305 -179.89 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.95 -40.89 91.73 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.34 -0.85 . . . . 0.0 110.548 -179.795 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.51 ' HG2' HG22 ' B' ' 17' ' ' VAL . 12.9 mp0 -69.33 -37.94 77.95 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.142 -0.974 . . . . 0.0 110.394 -179.739 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.79 -45.96 90.69 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.264 -0.898 . . . . 0.0 110.33 -179.94 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.463 ' O ' ' HB2' ' A' ' 43' ' ' LYS . 14.1 tt0 -66.1 -43.76 86.32 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.142 -0.974 . . . . 0.0 110.51 -179.873 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.8 -42.2 95.2 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.26 -0.9 . . . . 0.0 110.401 -179.766 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.743 ' HB3' HD13 ' A' ' 29' ' ' LEU . 31.1 m -63.09 -46.89 85.28 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.298 -0.876 . . . . 0.0 110.578 -179.666 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.644 ' CG1' HD12 ' A' ' 29' ' ' LEU . 74.5 mt -72.98 -13.72 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.126 -0.984 . . . . 0.0 110.519 -179.644 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 39' ' ' GLN . 0.1 OUTLIER -76.29 -21.19 56.56 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.163 -0.961 . . . . 0.0 110.461 -179.707 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.606 ' HB3' ' CG ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -113.0 -48.99 2.95 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.123 -0.986 . . . . 0.0 110.344 -180.0 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.523 ' HE1' ' CB ' ' A' ' 60' ' ' TYR . 2.0 ttm -34.62 96.77 0.11 Allowed Pre-proline 0 N--CA 1.494 1.764 0 O-C-N 121.695 -0.628 . . . . 0.0 111.071 -179.975 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.471 ' HD2' ' O ' ' A' ' 59' ' ' ASP . 27.1 Cg_exo . . . . . 0 C--N 1.305 -1.716 0 O-C-N 123.995 1.524 . . . . 0.0 110.026 179.765 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.649 ' C ' HD22 ' A' ' 58' ' ' LEU . . . . . . . . 0 N--CA 1.491 1.621 0 CA-C-O 121.34 0.59 . . . . 0.0 110.217 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.813 HD22 ' N ' ' A' ' 58' ' ' LEU . 2.3 mm? -116.2 160.19 20.75 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.305 -0.872 . . . . 0.0 109.936 179.996 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.486 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.6 OUTLIER -106.8 110.41 22.58 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.041 -1.037 . . . . 0.0 110.445 -179.98 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.624 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 17.2 p90 -75.91 -26.31 56.86 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.259 -0.9 . . . . 0.0 109.966 179.601 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.624 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.15 -39.59 72.54 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.327 -0.858 . . . . 0.0 110.023 -179.806 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.463 ' CB ' ' HG2' ' A' ' 46' ' ' PRO . . . -65.56 -39.55 91.81 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.177 -0.952 . . . . 0.0 109.831 179.667 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.606 ' CG ' ' HB3' ' A' ' 44' ' ' ARG . 2.0 t80 -71.9 -35.05 69.59 Favored 'General case' 0 C--N 1.298 -1.647 0 O-C-N 121.572 -0.705 . . . . 0.0 110.137 179.68 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.579 ' O ' ' CD2' ' A' ' 68' ' ' TYR . 17.4 m -56.19 -49.9 72.73 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.343 -0.848 . . . . 0.0 110.554 -179.692 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.5 p -55.65 -44.42 77.16 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.211 -0.931 . . . . 0.0 110.461 -179.754 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.16 -39.08 74.54 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.149 -0.97 . . . . 0.0 110.481 -179.802 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.513 ' CD2' ' HB2' ' B' ' 23' ' ' ALA . 18.3 mt -60.25 -38.52 83.72 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.188 -0.945 . . . . 0.0 110.292 -179.894 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.868 ' OH ' HG21 ' A' ' 10' ' ' VAL . 10.3 m-85 . . . . . 0 N--CA 1.489 1.52 0 O-C-N 121.315 -0.866 . . . . 0.0 110.215 -179.641 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 11.4 ptpt . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 121.321 0.581 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 15.8 ttmt -58.55 -41.87 86.6 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.221 -0.925 . . . . 0.0 110.161 -179.969 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.16 -35.74 77.94 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.235 -0.916 . . . . 0.0 110.011 179.927 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.86 -42.62 94.72 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.343 -0.848 . . . . 0.0 110.128 179.998 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . 0.526 ' HB2' HD12 ' A' ' 16' ' ' ILE . . . -63.17 -35.78 81.44 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.141 -0.974 . . . . 0.0 110.018 179.83 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.633 ' O ' HG23 ' B' ' 17' ' ' VAL . 72.8 t -61.61 -42.34 93.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.28 -0.887 . . . . 0.0 110.075 179.892 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.51 -44.26 93.16 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.309 -0.87 . . . . 0.0 110.234 179.955 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 37.0 m -64.57 -49.12 72.43 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.301 -0.875 . . . . 0.0 110.33 -180.0 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.571 HG11 HD11 ' A' ' 33' ' ' LEU . 86.2 t -60.99 -43.98 97.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.183 -0.948 . . . . 0.0 110.298 -179.966 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.633 HG23 ' O ' ' B' ' 13' ' ' VAL . 90.2 t -63.18 -47.17 93.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.327 -0.858 . . . . 0.0 110.2 -179.886 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.54 -43.25 75.65 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.25 -0.906 . . . . 0.0 110.165 -179.975 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.5 -44.09 83.53 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.309 -0.869 . . . . 0.0 110.161 179.989 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.41 HG23 ' O ' ' B' ' 16' ' ' VAL . 75.1 t -66.07 -44.96 91.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.226 -0.921 . . . . 0.0 110.192 179.956 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -57.16 -34.81 68.81 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.276 -0.89 . . . . 0.0 110.24 -179.96 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.9 tm0? -61.18 -49.83 75.62 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.2 -0.938 . . . . 0.0 110.162 -179.914 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . 0.513 ' HB2' ' CD2' ' A' ' 67' ' ' LEU . . . -60.81 -35.4 76.4 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.291 -0.881 . . . . 0.0 110.353 -179.922 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 21.5 ttp85 . . . . . 0 N--CA 1.493 1.684 0 O-C-N 121.15 -0.968 . . . . 0.0 110.487 179.979 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.928 HG22 ' CE2' ' A' ' 68' ' ' TYR . 3.3 m . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 121.191 0.52 . . . . 0.0 110.196 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -66.94 -45.53 77.53 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.22 -0.925 . . . . 0.0 109.823 179.774 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.524 ' HA ' HD12 ' A' ' 11' ' ' ILE . 1.9 tt0 -57.02 -36.65 70.69 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.32 -0.863 . . . . 0.0 109.883 179.694 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -61.38 -47.37 86.15 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.333 -0.854 . . . . 0.0 110.185 -179.853 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 41.6 t -58.26 -41.3 80.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.164 -0.96 . . . . 0.0 109.871 179.755 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.676 HG23 ' HE1' ' A' ' 60' ' ' TYR . 29.8 mt -63.33 -47.92 89.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.354 -0.841 . . . . 0.0 109.487 179.547 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.43 -39.01 75.32 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.334 -0.853 . . . . 0.0 108.722 179.018 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.57 ' HB3' HG23 ' B' ' 16' ' ' VAL . 10.6 m -66.91 -40.34 87.65 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 178.71 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.571 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 6.6 m-85 -68.28 -41.23 81.33 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.464 -0.772 . . . . 0.0 109.525 179.219 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -53.1 -44.26 67.49 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.348 -0.845 . . . . 0.0 109.456 179.363 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.608 HD13 ' HB2' ' B' ' 12' ' ' ALA . 48.3 mt -59.74 -43.6 91.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.479 -0.763 . . . . 0.0 109.882 179.467 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 13' ' ' SER . 48.3 mt -65.12 -41.75 94.57 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.289 -0.882 . . . . 0.0 109.949 179.792 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.601 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -83.75 13.97 4.32 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.456 -0.778 . . . . 0.0 110.337 -179.879 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 57.73 70.58 0.64 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.245 -0.91 . . . . 0.0 110.465 179.932 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.8 t70 44.99 54.96 6.51 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.332 -0.855 . . . . 0.0 110.514 179.777 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.552 ' HD2' ' CZ ' ' A' ' 23' ' ' TYR . 7.1 mttm -133.55 141.83 41.71 Favored Pre-proline 0 N--CA 1.491 1.575 0 O-C-N 121.143 -0.973 . . . . 0.0 109.901 179.89 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -68.13 -4.4 12.55 Favored 'Trans proline' 0 C--N 1.305 -1.729 0 O-C-N 124.02 1.537 . . . . 0.0 110.388 179.973 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.552 ' CZ ' ' HD2' ' A' ' 21' ' ' LYS . 51.8 p90 -139.18 157.41 45.98 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.213 -0.93 . . . . 0.0 110.306 -179.913 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.794 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -132.91 138.25 52.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.286 -0.884 . . . . 0.0 109.467 179.581 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.794 ' N ' HD13 ' A' ' 24' ' ' ILE . 1.0 OUTLIER -82.15 139.48 34.32 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.13 -0.981 . . . . 0.0 110.369 -179.48 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.451 ' O ' HD11 ' A' ' 42' ' ' ILE . . . -54.99 -35.22 64.11 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.39 -0.819 . . . . 0.0 110.175 179.945 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 87.6 mt-10 -61.12 -38.56 86.77 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.224 -0.922 . . . . 0.0 109.991 179.9 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.554 ' HB3' HD11 ' A' ' 24' ' ' ILE . 8.4 mt-10 -65.87 -40.48 91.69 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.329 -0.857 . . . . 0.0 109.565 179.627 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.517 HD12 HG12 ' A' ' 42' ' ' ILE . 63.6 mt -59.24 -34.03 71.72 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.433 -0.792 . . . . 0.0 109.476 179.446 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 27.8 mtp180 -68.48 -34.56 76.14 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.388 -0.82 . . . . 0.0 110.047 179.754 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.22 -31.48 13.47 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.3 -0.875 . . . . 0.0 110.499 -179.665 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -83.48 -23.36 32.23 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.074 -1.017 . . . . 0.0 110.431 -179.773 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.914 HD23 ' HD2' ' A' ' 34' ' ' PRO . 1.5 mt -129.85 147.84 67.1 Favored Pre-proline 0 N--CA 1.488 1.461 0 O-C-N 121.082 -1.011 . . . . 0.0 110.329 -179.749 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.914 ' HD2' HD23 ' A' ' 33' ' ' LEU . 1.0 OUTLIER -46.45 167.11 0.07 OUTLIER 'Trans proline' 0 C--N 1.305 -1.76 0 O-C-N 124.021 1.537 . . . . 0.0 110.095 179.665 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -62.44 -36.02 68.57 Favored 'Trans proline' 0 C--N 1.304 -1.794 0 O-C-N 124.03 1.542 . . . . 0.0 110.484 -179.768 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.521 ' OD1' ' N ' ' A' ' 37' ' ' GLN . 1.7 p30 -65.61 -46.4 79.46 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.25 -0.906 . . . . 0.0 110.462 -179.78 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.908 ' NE2' HG13 ' B' ' 17' ' ' VAL . 0.3 OUTLIER -69.45 -40.17 77.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.121 -0.987 . . . . 0.0 110.153 -179.962 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.418 ' O ' HG13 ' A' ' 42' ' ' ILE . . . -58.64 -48.14 82.02 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.289 -0.882 . . . . 0.0 110.185 179.917 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 66.7 tp60 -62.91 -47.52 82.9 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.266 -0.896 . . . . 0.0 110.14 179.888 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -66.21 -46.56 76.84 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.339 -0.851 . . . . 0.0 110.045 179.962 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 89.6 m -64.92 -45.97 83.61 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.356 -0.84 . . . . 0.0 110.332 -179.998 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.517 HG12 HD12 ' A' ' 29' ' ' LEU . 66.2 mt -68.73 -12.46 15.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.245 -0.909 . . . . 0.0 110.424 -179.853 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 19.7 tttm -83.12 -40.23 20.05 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.209 -0.932 . . . . 0.0 110.487 -179.783 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.511 ' O ' ' C ' ' A' ' 45' ' ' MET . 3.2 mtp85 -85.27 -61.61 1.73 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.204 -0.935 . . . . 0.0 110.55 -179.656 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.689 ' HE1' ' HB3' ' A' ' 60' ' ' TYR . 5.8 ttm -28.0 103.32 0.16 Allowed Pre-proline 0 N--CA 1.497 1.919 0 O-C-N 121.84 -0.537 . . . . 0.0 111.598 -179.886 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.545 ' O ' HD12 ' A' ' 58' ' ' LEU . 11.4 Cg_endo . . . . . 0 C--N 1.305 -1.713 0 O-C-N 124.058 1.557 . . . . 0.0 110.028 179.691 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.473 ' C ' HD22 ' A' ' 58' ' ' LEU . . . . . . . . 0 N--CA 1.494 1.749 0 CA-C-O 121.284 0.564 . . . . 0.0 110.032 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.851 HD22 ' N ' ' A' ' 58' ' ' LEU . 1.6 mm? -110.41 154.51 23.47 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.25 -0.906 . . . . 0.0 110.129 -179.846 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.491 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.4 OUTLIER -106.27 110.64 22.94 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.166 -0.959 . . . . 0.0 110.354 179.837 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.689 ' HB3' ' HE1' ' A' ' 45' ' ' MET . 17.4 p90 -72.56 -18.02 61.66 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.242 -0.911 . . . . 0.0 109.164 179.223 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.434 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.79 -35.47 66.33 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.451 -0.781 . . . . 0.0 109.104 179.571 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.493 ' HB3' ' CD ' ' A' ' 46' ' ' PRO . . . -60.15 -32.68 71.26 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.368 -0.832 . . . . 0.0 109.174 179.185 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.671 ' HE2' HG22 ' B' ' 20' ' ' VAL . 2.6 t80 -63.14 -48.79 76.96 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.785 -0.572 . . . . 0.0 110.203 179.756 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.453 ' O ' ' HB2' ' A' ' 68' ' ' TYR . 41.3 p -63.92 -45.74 87.91 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.216 -0.928 . . . . 0.0 110.401 -179.862 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 54.0 m -67.06 -39.25 86.86 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.236 -0.915 . . . . 0.0 110.285 -179.897 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.19 -43.86 69.89 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.231 -0.918 . . . . 0.0 110.35 -179.851 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.896 ' CD2' ' HB2' ' B' ' 23' ' ' ALA . 22.5 mt -73.6 -44.6 56.73 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.175 -0.953 . . . . 0.0 110.357 -179.868 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.928 ' CE2' HG22 ' A' ' 6' ' ' THR . 11.7 m-85 . . . . . 0 N--CA 1.491 1.583 0 O-C-N 121.222 -0.924 . . . . 0.0 110.286 -179.935 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 14.3 ptmt . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.164 0.507 . . . . 0.0 110.226 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.486 ' HA ' HG21 ' A' ' 16' ' ' ILE . 7.3 ttpt -65.2 -45.74 83.55 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.174 -0.954 . . . . 0.0 110.228 -179.879 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.45 -41.94 73.57 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.284 -0.885 . . . . 0.0 110.099 179.859 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -61.07 -41.28 96.34 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.231 -0.918 . . . . 0.0 110.115 179.872 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . 0.608 ' HB2' HD13 ' A' ' 16' ' ' ILE . . . -62.97 -36.43 83.45 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.309 -0.869 . . . . 0.0 110.142 179.94 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.646 ' O ' HG23 ' B' ' 17' ' ' VAL . 55.0 t -65.96 -45.12 91.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.255 -0.903 . . . . 0.0 110.163 179.758 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.04 -39.69 79.06 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.262 -0.899 . . . . 0.0 110.207 179.973 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 15.9 m -70.04 -40.79 74.95 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.317 -0.864 . . . . 0.0 110.21 179.916 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.57 HG23 ' HB3' ' A' ' 13' ' ' SER . 92.4 t -67.08 -45.47 86.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.265 -0.897 . . . . 0.0 110.247 179.986 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.908 HG13 ' NE2' ' A' ' 37' ' ' GLN . 55.0 t -62.77 -44.33 99.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.199 -0.938 . . . . 0.0 110.098 179.935 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.06 -39.19 77.85 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.311 -0.868 . . . . 0.0 110.236 -179.988 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.25 -40.77 86.29 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.194 -0.941 . . . . 0.0 110.221 -179.905 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.671 HG22 ' HE2' ' A' ' 63' ' ' PHE . 91.0 t -66.05 -41.04 88.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.293 -0.879 . . . . 0.0 110.355 -179.982 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 48.6 t0 -61.6 -31.86 71.95 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.245 -0.909 . . . . 0.0 110.247 -179.883 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -39.43 94.19 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.249 -0.907 . . . . 0.0 110.175 -179.9 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . 0.896 ' HB2' ' CD2' ' A' ' 67' ' ' LEU . . . -65.91 -38.35 88.48 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.188 -0.945 . . . . 0.0 110.334 -179.851 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.675 0 O-C-N 121.174 -0.954 . . . . 0.0 110.398 -179.867 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.213 0.53 . . . . 0.0 110.27 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.437 ' O ' HG13 ' A' ' 11' ' ' ILE . . . -62.01 -45.26 94.36 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.224 -0.923 . . . . 0.0 109.453 179.754 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -56.06 -36.59 68.23 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.437 -0.789 . . . . 0.0 109.682 179.333 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -61.96 -48.41 80.53 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.354 -0.841 . . . . 0.0 110.04 179.866 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 44.0 t -59.44 -46.42 92.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.339 -0.851 . . . . 0.0 109.673 179.695 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.773 HG23 ' HE1' ' A' ' 60' ' ' TYR . 44.7 mt -57.49 -48.49 82.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.293 -0.879 . . . . 0.0 109.431 179.536 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.76 -43.36 85.4 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.223 -0.923 . . . . 0.0 108.811 178.979 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.586 ' O ' ' HB1' ' B' ' 12' ' ' ALA . 6.7 p -63.07 -39.19 93.98 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 178.6 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -68.57 -41.21 80.02 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.512 -0.742 . . . . 0.0 109.576 179.112 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.638 ' NH2' ' CE2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -54.47 -42.61 70.88 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.276 -0.89 . . . . 0.0 109.62 179.486 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.86 HD12 ' HB2' ' B' ' 12' ' ' ALA . 38.0 mt -57.64 -45.05 86.5 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 O-C-N 121.155 -0.965 . . . . 0.0 108.72 179.032 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.464 HD13 ' HA ' ' A' ' 17' ' ' LEU . 4.1 mm? -65.97 -41.7 90.82 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.449 -0.782 . . . . 0.0 109.717 178.905 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.461 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -72.15 -11.96 60.97 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.475 -0.766 . . . . 0.0 110.091 -179.958 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.461 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 1.7 t 66.32 64.59 0.51 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.339 -0.851 . . . . 0.0 110.249 -179.987 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 51.45 62.36 2.75 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.213 -0.93 . . . . 0.0 110.377 179.902 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.525 ' O ' ' NE ' ' A' ' 15' ' ' ARG . 14.9 mttt -141.76 140.77 20.58 Favored Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.316 -0.865 . . . . 0.0 109.881 179.847 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.584 ' O ' ' CD1' ' A' ' 23' ' ' TYR . 18.5 Cg_endo -62.24 -10.65 19.09 Favored 'Trans proline' 0 C--N 1.303 -1.835 0 O-C-N 123.926 1.488 . . . . 0.0 110.178 179.938 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.584 ' CD1' ' O ' ' A' ' 22' ' ' PRO . 32.0 m-85 -143.06 -173.5 3.93 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.265 -0.897 . . . . 0.0 110.255 -179.974 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.7 tt -143.66 139.37 25.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.376 -0.828 . . . . 0.0 109.993 179.863 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.8 mt -80.17 143.35 33.91 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.276 -0.89 . . . . 0.0 109.95 -179.932 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.657 ' HB2' HD11 ' A' ' 58' ' ' LEU . . . -62.52 -36.49 82.75 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.38 -0.825 . . . . 0.0 110.606 -179.534 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -65.48 -36.44 83.88 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.134 -0.979 . . . . 0.0 110.128 -179.892 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.471 ' O ' ' CG ' ' A' ' 32' ' ' GLU . 28.8 mt-10 -69.1 -51.11 41.97 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.12 -0.988 . . . . 0.0 110.131 -179.876 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.738 HD12 ' C ' ' A' ' 29' ' ' LEU . 2.4 pp -67.62 -33.21 74.53 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.254 -0.904 . . . . 0.0 109.779 179.387 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 1.083 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 10.8 tpt180 -64.71 -34.84 79.26 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.261 -0.9 . . . . 0.0 110.526 -179.846 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.4 ttp85 -93.98 -9.05 38.21 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.218 -0.926 . . . . 0.0 110.63 -179.576 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.471 ' CG ' ' O ' ' A' ' 28' ' ' GLU . 8.0 mm-40 -100.13 -23.44 14.85 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.11 -0.994 . . . . 0.0 111.171 -179.313 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.638 HD22 ' HB3' ' A' ' 37' ' ' GLN . 0.3 OUTLIER -110.87 150.43 41.82 Favored Pre-proline 0 N--CA 1.489 1.486 0 O-C-N 120.907 -1.121 . . . . 0.0 110.3 -179.753 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.433 ' HG2' ' HB2' ' A' ' 37' ' ' GLN . 6.3 Cg_exo -47.36 144.44 9.73 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 O-C-N 124.031 1.542 . . . . 0.0 109.879 179.783 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.432 ' C ' ' O ' ' A' ' 34' ' ' PRO . 35.3 Cg_endo -38.1 -47.79 2.25 Favored 'Trans proline' 0 C--N 1.304 -1.78 0 O-C-N 124.192 1.628 . . . . 0.0 110.569 -179.72 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.409 ' OD1' ' HG2' ' A' ' 35' ' ' PRO . 2.4 m-20 -66.31 -47.02 74.9 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.24 -0.912 . . . . 0.0 111.185 -179.563 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.638 ' HB3' HD22 ' A' ' 33' ' ' LEU . 0.9 OUTLIER -69.82 -44.43 70.0 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.062 -1.024 . . . . 0.0 110.575 -179.42 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 1.083 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -59.16 -44.46 92.11 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.28 -0.888 . . . . 0.0 110.624 -179.534 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -66.09 -43.43 87.31 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.099 -1.001 . . . . 0.0 110.712 -179.643 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -61.31 -43.74 98.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.161 -0.962 . . . . 0.0 110.5 -179.805 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.457 ' O ' ' SD ' ' A' ' 45' ' ' MET . 79.1 m -58.09 -42.41 85.54 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.165 -0.959 . . . . 0.0 110.477 -179.771 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.644 HG13 HD11 ' A' ' 29' ' ' LEU . 36.4 mt -65.49 -21.82 29.88 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.14 -0.975 . . . . 0.0 110.362 -179.854 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.66 -34.5 23.02 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.18 -0.95 . . . . 0.0 110.817 -179.569 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.52 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 2.0 mmp_? -74.72 -69.45 0.46 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.107 -0.996 . . . . 0.0 110.589 -179.521 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.763 ' HE2' ' HB3' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -36.28 118.14 0.69 Allowed Pre-proline 0 N--CA 1.488 1.467 0 O-C-N 121.53 -0.731 . . . . 0.0 111.412 -179.756 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.689 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 9.3 Cg_endo . . . . . 0 C--N 1.304 -1.771 0 O-C-N 124.197 1.63 . . . . 0.0 109.342 179.117 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.358 0.599 . . . . 0.0 110.479 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.657 HD11 ' HB2' ' A' ' 26' ' ' ALA . 62.3 mt -124.88 159.75 30.41 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.298 -0.876 . . . . 0.0 109.613 179.499 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.454 ' C ' ' HG2' ' A' ' 45' ' ' MET . 3.7 m-20 -106.18 110.76 23.11 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.005 -1.06 . . . . 0.0 111.234 -179.52 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.773 ' HE1' HG23 ' A' ' 11' ' ' ILE . 39.7 p90 -81.49 -29.77 33.55 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.425 -0.797 . . . . 0.0 110.08 179.307 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.528 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.5 -36.65 66.92 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.283 -0.886 . . . . 0.0 109.522 -179.943 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.689 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -68.16 -35.81 78.65 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.344 -0.848 . . . . 0.0 109.862 179.539 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.52 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 2.6 t80 -72.05 -31.44 66.14 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.576 -0.703 . . . . 0.0 110.303 179.66 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 20.1 m -71.43 -48.5 49.2 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.285 -0.884 . . . . 0.0 110.409 -179.704 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.43 -43.28 97.89 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.199 -0.938 . . . . 0.0 110.37 -179.779 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -61.83 -40.78 96.48 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.196 -0.94 . . . . 0.0 110.404 -179.789 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.86 -40.03 75.39 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.152 -0.968 . . . . 0.0 110.346 -179.804 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 . . . . . 0 N--CA 1.491 1.616 0 O-C-N 121.127 -0.983 . . . . 0.0 110.263 -179.995 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 2.1 tptp . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.199 0.523 . . . . 0.0 110.264 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.448 ' CE ' ' OE1' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -59.96 -51.14 70.96 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.217 -0.927 . . . . 0.0 110.153 179.942 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.8 -35.54 68.85 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.216 -0.927 . . . . 0.0 110.059 179.935 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -62.84 -42.55 99.78 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.216 -0.928 . . . . 0.0 110.207 179.932 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . 0.86 ' HB2' HD12 ' A' ' 16' ' ' ILE . . . -67.04 -40.96 87.28 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.294 -0.879 . . . . 0.0 110.073 179.916 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.518 ' O ' HG23 ' B' ' 17' ' ' VAL . 75.1 t -61.24 -44.62 98.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.204 -0.935 . . . . 0.0 109.952 179.895 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.52 -44.33 89.5 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.19 -0.943 . . . . 0.0 110.053 179.809 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 54.3 m -63.55 -43.25 97.63 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.241 -0.912 . . . . 0.0 110.085 179.858 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.424 HG23 ' O ' ' B' ' 12' ' ' ALA . 76.7 t -64.22 -41.99 94.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.298 -0.876 . . . . 0.0 110.054 179.864 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.518 HG23 ' O ' ' B' ' 13' ' ' VAL . 77.6 t -61.04 -44.33 98.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.272 -0.892 . . . . 0.0 110.071 179.84 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.8 -45.97 92.33 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.162 -0.961 . . . . 0.0 110.034 179.939 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.32 -45.44 87.91 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.201 -0.937 . . . . 0.0 110.087 179.826 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 66.5 t -68.04 -40.52 83.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.231 -0.918 . . . . 0.0 110.191 179.937 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -61.87 -31.5 71.78 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.345 -0.847 . . . . 0.0 110.133 179.934 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -55.82 -50.93 69.19 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.26 -0.9 . . . . 0.0 110.078 -179.995 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.87 -39.66 90.01 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.199 -0.938 . . . . 0.0 110.091 179.785 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 10.6 ttp180 . . . . . 0 N--CA 1.492 1.646 0 O-C-N 121.406 -0.809 . . . . 0.0 110.128 179.857 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 27.8 m . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.347 0.594 . . . . 0.0 109.989 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.8 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -66.52 -45.78 78.39 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.282 -0.886 . . . . 0.0 109.793 179.644 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -54.69 -36.48 64.7 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.358 -0.838 . . . . 0.0 109.758 179.552 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -61.56 -40.08 93.44 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.34 -0.85 . . . . 0.0 110.047 179.995 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 88.3 t -58.2 -52.35 59.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.178 -0.951 . . . . 0.0 109.935 179.698 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 59.0 mt -55.47 -49.49 72.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.254 -0.904 . . . . 0.0 109.49 179.612 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.83 -40.38 79.91 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.315 -0.866 . . . . 0.0 108.876 179.119 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.401 ' O ' HD23 ' A' ' 17' ' ' LEU . 2.0 p -66.8 -37.78 85.2 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.418 -0.801 . . . . 0.0 109.122 178.941 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.495 ' CE1' ' HE1' ' A' ' 45' ' ' MET . 3.3 m-85 -68.27 -43.66 77.28 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.317 -0.864 . . . . 0.0 109.706 179.363 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.401 ' HD3' ' OH ' ' A' ' 60' ' ' TYR . 0.7 OUTLIER -53.35 -47.99 68.92 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.327 -0.858 . . . . 0.0 109.389 179.515 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.613 HG21 ' HA ' ' B' ' 9' ' ' LYS . 71.3 mt -59.09 -42.36 86.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.403 -0.811 . . . . 0.0 109.607 179.281 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.631 HD12 ' HB3' ' A' ' 32' ' ' GLU . 2.6 mm? -64.79 -39.13 93.09 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.414 -0.804 . . . . 0.0 109.982 179.727 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.746 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -82.95 10.58 7.59 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.319 -0.863 . . . . 0.0 110.249 -179.974 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 61.46 56.35 2.61 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.311 -0.868 . . . . 0.0 110.239 -179.948 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.6 t0 56.85 59.31 3.56 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.225 -0.922 . . . . 0.0 110.225 179.925 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' A' ' 18' ' ' ALA . 18.8 mttm -140.62 144.34 35.96 Favored Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.25 -0.906 . . . . 0.0 110.173 -179.975 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 21' ' ' LYS . 26.6 Cg_exo -75.03 1.06 8.17 Favored 'Trans proline' 0 C--N 1.304 -1.792 0 O-C-N 124.091 1.574 . . . . 0.0 109.998 179.562 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.455 ' CD1' ' O ' ' A' ' 23' ' ' TYR . 8.4 p90 -141.69 150.42 41.85 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.219 -0.925 . . . . 0.0 110.179 179.963 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.746 HG12 ' HB2' ' A' ' 18' ' ' ALA . 0.4 OUTLIER -121.38 144.09 31.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.188 -0.945 . . . . 0.0 110.002 -179.973 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.581 ' H ' HD13 ' A' ' 24' ' ' ILE . 4.4 mm? -85.73 145.24 27.35 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.22 -0.925 . . . . 0.0 110.302 -179.894 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.63 -45.43 94.11 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.279 -0.888 . . . . 0.0 110.181 179.894 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -61.42 -35.72 78.35 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.22 -0.925 . . . . 0.0 109.85 179.889 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -62.4 -47.2 85.17 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.264 -0.897 . . . . 0.0 109.075 179.329 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.584 HD11 HG21 ' A' ' 24' ' ' ILE . 41.8 mt -58.75 -33.46 70.29 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.424 -0.798 . . . . 0.0 109.229 178.971 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.495 ' HA ' ' CB ' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -65.73 -34.68 78.76 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.359 -0.838 . . . . 0.0 110.236 179.999 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -96.68 -31.93 12.44 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.086 -1.009 . . . . 0.0 110.832 -179.745 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.631 ' HB3' HD12 ' A' ' 17' ' ' LEU . 0.4 OUTLIER -76.02 -23.33 55.18 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.058 -1.026 . . . . 0.0 110.587 -179.726 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.683 HD23 ' HD2' ' A' ' 34' ' ' PRO . 0.2 OUTLIER -133.05 158.44 75.81 Favored Pre-proline 0 C--N 1.305 -1.334 0 O-C-N 121.096 -1.003 . . . . 0.0 110.403 -179.627 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.683 ' HD2' HD23 ' A' ' 33' ' ' LEU . 6.3 Cg_exo -50.58 134.02 39.12 Favored 'Trans proline' 0 C--N 1.305 -1.739 0 O-C-N 124.053 1.554 . . . . 0.0 110.056 179.769 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.42 ' C ' ' O ' ' A' ' 34' ' ' PRO . 33.9 Cg_endo -39.24 -35.23 0.66 Allowed 'Trans proline' 0 C--N 1.306 -1.701 0 O-C-N 124.133 1.596 . . . . 0.0 110.723 -179.636 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -65.31 -44.67 87.12 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.164 -0.96 . . . . 0.0 110.585 -179.73 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.517 ' CG ' ' HG2' ' A' ' 34' ' ' PRO . 28.6 mm100 -69.33 -38.11 78.03 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.157 -0.965 . . . . 0.0 110.549 -179.66 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.495 ' CB ' ' HA ' ' A' ' 30' ' ' ARG . . . -56.38 -42.55 78.06 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.212 -0.93 . . . . 0.0 110.549 -179.902 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 40.0 tt0 -64.27 -45.01 89.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.116 -0.99 . . . . 0.0 110.383 -179.759 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.09 -48.33 71.32 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.141 -0.974 . . . . 0.0 110.401 -179.86 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.456 ' O ' ' HG3' ' A' ' 45' ' ' MET . 54.8 m -65.75 -43.59 88.5 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.328 -0.857 . . . . 0.0 110.518 -179.846 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.454 ' CG1' ' O ' ' A' ' 38' ' ' ALA . 61.1 mt -60.26 -22.9 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.236 -0.915 . . . . 0.0 110.782 -179.56 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.96 -31.21 23.7 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.119 -0.988 . . . . 0.0 110.834 -179.509 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.561 ' HG3' ' CE1' ' A' ' 63' ' ' PHE . 0.2 OUTLIER -76.3 -65.15 0.96 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.224 -0.922 . . . . 0.0 110.589 -179.704 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.601 ' CE ' ' CB ' ' A' ' 60' ' ' TYR . 12.0 mtt -39.44 111.12 0.66 Allowed Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.379 -0.825 . . . . 0.0 110.863 -179.737 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.485 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 6.7 Cg_endo . . . . . 0 C--N 1.304 -1.775 0 O-C-N 124.018 1.536 . . . . 0.0 109.865 179.497 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.296 0.57 . . . . 0.0 110.151 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.535 ' HB3' ' CB ' ' A' ' 45' ' ' MET . 80.3 mt -104.11 155.72 18.47 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.211 -0.931 . . . . 0.0 110.266 179.974 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -98.97 111.14 23.62 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.249 -0.907 . . . . 0.0 110.546 -179.852 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.601 ' CB ' ' CE ' ' A' ' 45' ' ' MET . 31.7 p90 -76.22 -28.79 57.33 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.276 -0.89 . . . . 0.0 110.268 179.708 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.571 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.06 -41.41 75.02 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.233 -0.917 . . . . 0.0 110.135 -179.67 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.485 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -65.61 -35.56 81.17 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.238 -0.913 . . . . 0.0 109.791 179.823 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.566 ' O ' ' CD1' ' A' ' 63' ' ' PHE . 1.5 t80 -72.28 -36.34 68.95 Favored 'General case' 0 C--N 1.298 -1.659 0 O-C-N 121.607 -0.683 . . . . 0.0 110.242 179.807 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.567 ' O ' ' CE2' ' A' ' 68' ' ' TYR . 2.7 p -63.67 -49.85 71.59 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.211 -0.93 . . . . 0.0 110.455 -179.683 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.613 ' HA ' ' CD2' ' A' ' 68' ' ' TYR . 43.3 m -60.11 -47.56 85.39 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.168 -0.957 . . . . 0.0 110.264 -179.869 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -55.98 -36.68 68.15 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.189 -0.944 . . . . 0.0 110.204 -179.971 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.882 HD21 ' O ' ' B' ' 19' ' ' ALA . 0.2 OUTLIER -54.73 -32.54 59.84 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.288 -0.882 . . . . 0.0 110.232 -179.952 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.8 ' CE2' ' HB1' ' A' ' 7' ' ' ALA . 1.5 m-85 . . . . . 0 N--CA 1.491 1.605 0 O-C-N 121.238 -0.914 . . . . 0.0 110.205 -179.692 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 1.8 pttt . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.234 0.54 . . . . 0.0 110.185 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.613 ' HA ' HG21 ' A' ' 16' ' ' ILE . 0.4 OUTLIER -63.26 -48.88 76.3 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.249 -0.907 . . . . 0.0 110.172 -179.99 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.34 -39.42 69.99 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.198 -0.939 . . . . 0.0 110.009 179.91 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -63.45 -39.78 95.39 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.314 -0.867 . . . . 0.0 110.14 179.836 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.28 -42.39 99.3 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.181 -0.949 . . . . 0.0 109.95 -179.985 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.456 HG13 ' HG ' ' A' ' 33' ' ' LEU . 98.4 t -59.6 -40.4 82.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.164 -0.96 . . . . 0.0 109.712 179.5 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.41 -36.84 76.61 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.279 -0.888 . . . . 0.0 109.898 179.746 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 25.0 m -67.62 -42.77 81.85 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.275 -0.89 . . . . 0.0 110.14 179.914 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.807 ' O ' HG23 ' B' ' 20' ' ' VAL . 94.0 t -64.52 -40.42 88.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.299 -0.876 . . . . 0.0 110.28 179.968 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 67.8 t -63.07 -50.19 80.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.295 -0.878 . . . . 0.0 110.51 -179.684 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.33 -39.89 94.81 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.2 -0.938 . . . . 0.0 110.716 -179.598 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.882 ' O ' HD21 ' A' ' 67' ' ' LEU . . . -67.28 -41.57 85.26 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.187 -0.946 . . . . 0.0 110.613 -179.509 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.807 HG23 ' O ' ' B' ' 16' ' ' VAL . 63.7 t -67.45 -39.0 81.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.23 -0.919 . . . . 0.0 110.681 -179.526 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.02 -33.01 75.03 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.234 -0.916 . . . . 0.0 110.495 -179.744 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -56.3 -45.52 80.2 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.261 -0.899 . . . . 0.0 110.459 -179.702 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.87 -38.4 88.7 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.196 -0.94 . . . . 0.0 110.422 -179.768 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 8.4 ttt-85 . . . . . 0 N--CA 1.492 1.669 0 O-C-N 121.193 -0.942 . . . . 0.0 110.21 -179.867 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.29 0.567 . . . . 0.0 110.128 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -66.59 -44.51 81.98 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.279 -0.888 . . . . 0.0 109.703 179.627 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -55.74 -36.92 67.8 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.314 -0.866 . . . . 0.0 109.702 179.618 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.406 ' O ' ' OG ' ' A' ' 13' ' ' SER . 2.9 tt0 -62.12 -48.33 80.64 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.261 -0.899 . . . . 0.0 110.08 179.957 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.51 HG12 ' HD2' ' A' ' 14' ' ' PHE . 73.1 t -59.86 -46.83 93.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.159 -0.963 . . . . 0.0 109.89 179.864 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.75 HG23 ' HE1' ' A' ' 60' ' ' TYR . 79.0 mt -56.92 -48.34 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.366 -0.834 . . . . 0.0 109.607 179.586 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.425 ' O ' HG13 ' A' ' 16' ' ' ILE . . . -57.49 -39.55 76.7 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.316 -0.865 . . . . 0.0 109.095 179.172 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.501 ' HA ' ' HB1' ' B' ' 12' ' ' ALA . 1.1 m -68.79 -39.06 80.33 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.481 -0.762 . . . . 0.0 109.124 178.955 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.536 ' CG ' ' HB2' ' A' ' 60' ' ' TYR . 4.9 m-85 -68.55 -45.24 72.68 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.43 -0.794 . . . . 0.0 109.793 179.425 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.3 ttt-85 -53.02 -41.09 64.36 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.299 -0.876 . . . . 0.0 109.495 179.496 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.621 HD12 ' HB2' ' B' ' 12' ' ' ALA . 42.0 mt -63.47 -43.79 98.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.272 -0.892 . . . . 0.0 109.985 179.723 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.471 HD22 ' HB3' ' A' ' 32' ' ' GLU . 75.8 mt -62.98 -41.71 99.63 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.109 -0.995 . . . . 0.0 109.691 179.561 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.709 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -75.77 1.14 15.6 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.342 -0.849 . . . . 0.0 110.132 179.757 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.463 ' O ' ' CB ' ' A' ' 20' ' ' ASP . 0.1 OUTLIER 66.69 55.16 0.79 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.177 -0.952 . . . . 0.0 110.099 -179.897 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.463 ' CB ' ' O ' ' A' ' 19' ' ' SER . 13.6 t0 65.82 65.02 0.54 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.241 -0.912 . . . . 0.0 110.14 -179.97 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.625 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 26.8 mttt -148.79 143.76 17.52 Favored Pre-proline 0 N--CA 1.49 1.537 0 O-C-N 121.255 -0.903 . . . . 0.0 110.145 -179.968 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.546 ' O ' ' CD1' ' A' ' 23' ' ' TYR . 11.3 Cg_endo -73.32 -0.73 9.6 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 O-C-N 124.083 1.57 . . . . 0.0 110.068 179.495 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.546 ' CD1' ' O ' ' A' ' 22' ' ' PRO . 25.9 m-85 -139.98 158.85 43.41 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.247 -0.908 . . . . 0.0 109.842 179.863 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.77 HD13 ' H ' ' A' ' 25' ' ' LEU . 0.4 OUTLIER -124.39 150.77 29.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.115 -0.991 . . . . 0.0 109.942 179.984 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.77 ' H ' HD13 ' A' ' 24' ' ' ILE . 15.6 mt -92.74 145.61 24.28 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.067 -1.021 . . . . 0.0 110.26 -179.842 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.45 -45.39 80.84 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.221 -0.924 . . . . 0.0 110.278 -179.862 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -61.14 -35.7 77.79 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.208 -0.932 . . . . 0.0 109.917 179.871 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.557 ' HB3' HD11 ' A' ' 24' ' ' ILE . 21.9 mm-40 -60.15 -45.2 93.86 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.344 -0.847 . . . . 0.0 109.796 179.795 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.406 HD13 ' CB ' ' A' ' 41' ' ' CYS . 26.2 mt -63.15 -34.27 77.26 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.359 -0.838 . . . . 0.0 109.827 179.68 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.537 ' HA ' ' HB2' ' A' ' 38' ' ' ALA . 24.3 mtt-85 -68.88 -38.26 79.58 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.356 -0.84 . . . . 0.0 110.219 -179.927 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.5 -26.24 18.04 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.291 -0.881 . . . . 0.0 110.831 -179.568 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.471 ' HB3' HD22 ' A' ' 17' ' ' LEU . 75.4 mm-40 -89.88 -23.74 21.56 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.098 -1.001 . . . . 0.0 110.658 -179.69 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.773 HD21 HG23 ' B' ' 17' ' ' VAL . 1.3 mt -128.73 155.85 78.53 Favored Pre-proline 0 N--CA 1.488 1.451 0 O-C-N 121.19 -0.944 . . . . 0.0 110.056 -179.797 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.769 ' HD2' HD23 ' A' ' 33' ' ' LEU . 47.9 Cg_exo -52.56 144.4 41.86 Favored 'Trans proline' 0 C--N 1.304 -1.793 0 O-C-N 124.009 1.531 . . . . 0.0 110.302 179.972 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -41.87 -45.13 6.92 Favored 'Trans proline' 0 C--N 1.305 -1.744 0 O-C-N 124.003 1.528 . . . . 0.0 110.589 -179.842 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -58.36 -43.66 88.49 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.196 -0.94 . . . . 0.0 110.434 -179.771 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.688 ' HG3' HG22 ' B' ' 17' ' ' VAL . 75.3 mm-40 -68.97 -40.75 78.65 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.213 -0.929 . . . . 0.0 110.16 -179.959 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.537 ' HB2' ' HA ' ' A' ' 30' ' ' ARG . . . -56.54 -47.13 80.08 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.299 -0.876 . . . . 0.0 110.39 -179.956 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.2 tp60 -65.85 -46.72 77.43 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.159 -0.963 . . . . 0.0 110.252 -179.858 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -64.04 -48.01 77.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.28 -0.887 . . . . 0.0 110.209 -179.96 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.413 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 77.5 m -65.13 -47.7 76.19 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.219 -0.926 . . . . 0.0 110.159 -179.946 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 54.5 mt -58.34 -23.49 22.34 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.255 -0.903 . . . . 0.0 110.234 179.935 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.48 -41.31 16.7 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.242 -0.912 . . . . 0.0 110.33 -179.809 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.63 ' CB ' ' CD2' ' A' ' 63' ' ' PHE . 1.0 OUTLIER -64.11 -73.93 0.11 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.109 -0.994 . . . . 0.0 109.975 -179.916 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.594 ' CG ' ' HA ' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -38.47 117.21 0.96 Allowed Pre-proline 0 N--CA 1.488 1.427 0 O-C-N 121.382 -0.824 . . . . 0.0 111.473 179.847 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.424 ' HD2' ' HA ' ' A' ' 45' ' ' MET . 7.7 Cg_endo . . . . . 0 C--N 1.302 -1.871 0 O-C-N 123.829 1.436 . . . . 0.0 108.51 178.33 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.348 0.594 . . . . 0.0 110.207 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.59 HD11 HG22 ' A' ' 24' ' ' ILE . 0.6 OUTLIER -114.89 160.87 19.0 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.318 -0.864 . . . . 0.0 110.131 179.874 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -99.47 115.86 30.27 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.306 -0.871 . . . . 0.0 111.45 -179.17 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.75 ' HE1' HG23 ' A' ' 11' ' ' ILE . 9.1 p90 -78.43 -21.66 48.87 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.429 -0.794 . . . . 0.0 110.145 179.114 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.564 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.85 -33.11 64.23 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.212 -0.93 . . . . 0.0 109.753 179.973 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.434 ' O ' ' CB ' ' A' ' 66' ' ' ALA . . . -65.2 -32.36 74.0 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.284 -0.885 . . . . 0.0 109.486 179.451 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.63 ' CD2' ' CB ' ' A' ' 44' ' ' ARG . 5.9 t80 -65.89 -41.94 90.92 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.742 -0.599 . . . . 0.0 110.223 179.884 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 70.1 p -68.52 -49.58 58.54 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.269 -0.895 . . . . 0.0 110.37 -179.854 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.9 m -68.51 -35.5 77.58 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.273 -0.892 . . . . 0.0 110.381 -179.881 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.434 ' CB ' ' O ' ' A' ' 62' ' ' ALA . . . -67.08 -44.01 81.14 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.241 -0.912 . . . . 0.0 110.386 -179.838 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.549 ' CD1' ' HB2' ' B' ' 23' ' ' ALA . 3.6 mm? -68.39 -41.93 79.81 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.179 -0.951 . . . . 0.0 110.633 -179.745 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 . . . . . 0 N--CA 1.491 1.588 0 O-C-N 121.068 -1.02 . . . . 0.0 110.56 -179.759 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 4.0 tptp . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.266 0.555 . . . . 0.0 110.16 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.704 ' O ' HG23 ' B' ' 13' ' ' VAL . 7.7 ttmt -66.87 -37.51 84.56 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.251 -0.906 . . . . 0.0 110.184 179.993 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.65 -37.24 80.85 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.249 -0.907 . . . . 0.0 110.09 179.855 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -66.02 -41.77 90.52 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.295 -0.878 . . . . 0.0 109.97 179.895 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . 0.621 ' HB2' HD12 ' A' ' 16' ' ' ILE . . . -65.59 -40.03 92.24 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.402 -0.811 . . . . 0.0 109.958 179.752 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.704 HG23 ' O ' ' B' ' 9' ' ' LYS . 57.5 t -59.72 -44.83 94.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.352 -0.843 . . . . 0.0 110.077 179.751 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.62 -39.23 93.14 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.147 -0.971 . . . . 0.0 109.946 179.875 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.71 -47.61 80.41 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.357 -0.839 . . . . 0.0 110.07 179.864 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.681 ' O ' HG23 ' B' ' 20' ' ' VAL . 58.8 t -63.65 -45.51 97.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.285 -0.884 . . . . 0.0 110.028 179.884 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.773 HG23 HD21 ' A' ' 33' ' ' LEU . 24.2 t -60.74 -50.87 78.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.3 -0.875 . . . . 0.0 110.003 179.891 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.96 -40.91 67.24 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.271 -0.893 . . . . 0.0 110.091 179.815 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.79 -45.54 78.09 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.266 -0.896 . . . . 0.0 110.023 179.853 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.681 HG23 ' O ' ' B' ' 16' ' ' VAL . 42.5 t -67.21 -43.1 88.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.287 -0.883 . . . . 0.0 110.049 179.855 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -57.3 -37.38 72.35 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.278 -0.888 . . . . 0.0 110.053 179.966 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -49.03 76.89 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.29 -0.881 . . . . 0.0 110.143 -179.987 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . 0.549 ' HB2' ' CD1' ' A' ' 67' ' ' LEU . . . -59.04 -36.06 74.38 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.221 -0.924 . . . . 0.0 110.11 -179.927 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.534 0 O-C-N 121.319 -0.863 . . . . 0.0 110.08 179.849 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.512 ' CG2' ' CZ ' ' A' ' 68' ' ' TYR . 2.5 m . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.231 0.538 . . . . 0.0 110.304 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.38 -47.4 76.5 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.239 -0.913 . . . . 0.0 109.867 179.896 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -56.02 -35.54 66.95 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.402 -0.811 . . . . 0.0 109.993 179.626 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 16.7 tp60 -60.62 -38.94 86.4 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.191 -0.943 . . . . 0.0 109.841 -179.931 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.891 HG12 ' CD2' ' A' ' 14' ' ' PHE . 53.9 t -61.16 -41.03 87.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.162 -0.961 . . . . 0.0 109.192 179.242 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.469 HG23 ' HE1' ' A' ' 60' ' ' TYR . 11.9 mm -55.26 -49.78 69.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.351 -0.843 . . . . 0.0 109.615 179.452 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.83 -43.61 94.48 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.362 -0.836 . . . . 0.0 109.324 179.331 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.41 ' CB ' HG23 ' B' ' 16' ' ' VAL . 2.7 m -66.69 -40.56 88.57 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.383 -0.823 . . . . 0.0 109.314 179.215 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.891 ' CD2' HG12 ' A' ' 10' ' ' VAL . 1.2 m-85 -68.38 -40.92 81.24 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.333 -0.855 . . . . 0.0 109.587 179.323 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.08 -50.19 64.9 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.362 -0.836 . . . . 0.0 109.561 179.538 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 68.1 mt -60.06 -40.88 84.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.295 -0.878 . . . . 0.0 109.711 179.424 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.743 HD11 HG22 ' B' ' 13' ' ' VAL . 0.6 OUTLIER -65.06 -36.2 83.6 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.396 -0.815 . . . . 0.0 109.894 179.684 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.659 ' HB2' ' HB ' ' A' ' 24' ' ' ILE . . . -89.67 8.22 32.66 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.344 -0.847 . . . . 0.0 110.172 -179.912 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.474 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.4 OUTLIER 67.75 55.66 0.59 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.196 -0.94 . . . . 0.0 110.254 179.991 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.425 ' N ' ' OD1' ' A' ' 20' ' ' ASP . 5.8 m-20 52.28 56.67 7.39 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.285 -0.884 . . . . 0.0 110.397 179.733 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' A' ' 19' ' ' SER . 68.2 mttt -138.52 140.39 27.76 Favored Pre-proline 0 N--CA 1.49 1.551 0 O-C-N 121.19 -0.944 . . . . 0.0 109.951 179.777 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.61 -11.76 18.48 Favored 'Trans proline' 0 C--N 1.305 -1.749 0 O-C-N 124.051 1.553 . . . . 0.0 110.11 179.901 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.57 ' O ' ' HB1' ' A' ' 18' ' ' ALA . 47.8 p90 -135.46 171.25 14.71 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.264 -0.897 . . . . 0.0 110.05 179.805 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.659 ' HB ' ' HB2' ' A' ' 18' ' ' ALA . 8.9 tt -146.72 158.01 10.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.231 -0.918 . . . . 0.0 110.241 -179.917 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.5 mp -91.25 145.14 24.91 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.226 -0.921 . . . . 0.0 110.197 -179.939 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.538 ' HA ' ' CD2' ' A' ' 29' ' ' LEU . . . -59.7 -39.52 84.86 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.303 -0.873 . . . . 0.0 110.328 -179.955 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.73 -35.88 81.14 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.183 -0.948 . . . . 0.0 109.921 179.742 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -69.61 -51.17 37.52 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.338 -0.851 . . . . 0.0 109.554 179.65 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.745 HD12 ' C ' ' A' ' 29' ' ' LEU . 1.7 pp -67.75 -33.53 75.04 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.31 -0.869 . . . . 0.0 109.595 179.192 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.629 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -62.89 -34.47 77.48 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.352 -0.842 . . . . 0.0 110.132 179.79 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -83.68 -31.38 26.16 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.252 -0.905 . . . . 0.0 110.173 179.93 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -76.4 -23.6 54.03 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.266 -0.896 . . . . 0.0 110.287 -179.944 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.784 HD22 ' HB3' ' A' ' 37' ' ' GLN . 1.4 mt -112.92 151.3 43.96 Favored Pre-proline 0 C--N 1.305 -1.357 0 O-C-N 121.197 -0.939 . . . . 0.0 110.061 -179.929 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.462 ' CB ' ' HD2' ' A' ' 35' ' ' PRO . 35.2 Cg_exo -55.0 172.28 0.39 Allowed 'Trans proline' 0 C--N 1.304 -1.815 0 O-C-N 124.033 1.544 . . . . 0.0 110.232 179.946 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.462 ' HD2' ' CB ' ' A' ' 34' ' ' PRO . 30.8 Cg_endo -59.02 -45.8 26.14 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 123.952 1.501 . . . . 0.0 110.311 -179.83 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -66.3 -43.02 87.45 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.323 -0.861 . . . . 0.0 110.77 -179.807 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.784 ' HB3' HD22 ' A' ' 33' ' ' LEU . 4.1 mp0 -69.63 -42.64 74.05 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.156 -0.965 . . . . 0.0 110.381 -179.616 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.629 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -57.26 -48.66 78.29 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.297 -0.877 . . . . 0.0 110.36 -179.726 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 14.2 tm0? -66.82 -43.32 84.06 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.261 -0.899 . . . . 0.0 110.777 -179.78 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -64.91 -42.32 94.82 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.104 -0.997 . . . . 0.0 110.503 -179.521 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.492 ' O ' ' HG2' ' A' ' 45' ' ' MET . 73.6 m -65.22 -51.32 61.68 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.111 -0.993 . . . . 0.0 110.709 -179.687 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.533 HG13 HD11 ' A' ' 29' ' ' LEU . 50.6 mt -53.72 -23.6 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.181 -0.95 . . . . 0.0 110.757 -179.588 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.36 -19.14 31.89 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.117 -0.989 . . . . 0.0 110.649 -179.65 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.608 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 18.4 mmt180 -89.56 -69.99 0.69 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.228 -0.92 . . . . 0.0 110.834 -179.495 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.517 ' CB ' ' O ' ' A' ' 59' ' ' ASP . 9.4 ptp -46.89 110.02 1.18 Allowed Pre-proline 0 N--CA 1.488 1.464 0 O-C-N 121.136 -0.978 . . . . 0.0 110.639 -179.408 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.833 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 9.6 Cg_endo . . . . . 0 C--N 1.307 -1.622 0 O-C-N 124.132 1.596 . . . . 0.0 110.184 179.882 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.714 0 CA-C-O 121.388 0.614 . . . . 0.0 110.575 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.501 HD11 ' HB2' ' A' ' 26' ' ' ALA . 2.3 mt -129.88 160.39 33.67 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.374 -0.829 . . . . 0.0 109.81 179.582 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.517 ' O ' ' CB ' ' A' ' 45' ' ' MET . 1.3 t70 -110.39 110.76 21.66 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.063 -1.023 . . . . 0.0 110.673 -179.789 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.574 ' HB2' ' CD2' ' A' ' 14' ' ' PHE . 40.6 p90 -75.86 -24.24 55.73 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.211 -0.931 . . . . 0.0 109.33 179.231 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.429 ' HB3' ' OD2' ' A' ' 59' ' ' ASP . . . -62.54 -44.4 96.45 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.469 -0.769 . . . . 0.0 109.617 179.67 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.833 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -61.56 -32.81 72.91 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.254 -0.904 . . . . 0.0 109.917 179.682 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.642 ' HZ ' HG22 ' B' ' 20' ' ' VAL . 1.2 t80 -71.4 -39.78 70.94 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.52 -0.737 . . . . 0.0 110.241 179.881 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.476 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 3.6 t -61.05 -50.1 74.7 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.264 -0.898 . . . . 0.0 110.609 -179.69 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.43 -35.3 77.41 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.216 -0.928 . . . . 0.0 110.447 -179.783 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.0 -46.3 68.35 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.208 -0.933 . . . . 0.0 110.786 -179.542 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.761 HD11 ' CD2' ' A' ' 68' ' ' TYR . 2.5 pp -70.84 -33.01 70.21 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.097 -1.002 . . . . 0.0 110.752 -179.477 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.761 ' CD2' HD11 ' A' ' 67' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.26 -0.9 . . . . 0.0 110.391 179.975 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 121.24 0.543 . . . . 0.0 110.139 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.749 ' O ' HG23 ' B' ' 13' ' ' VAL . 1.5 tttp -62.26 -48.84 78.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.244 -0.91 . . . . 0.0 110.089 179.892 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.67 -45.55 77.71 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.329 -0.857 . . . . 0.0 110.213 179.881 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -63.45 -41.13 98.65 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.317 -0.864 . . . . 0.0 110.068 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.25 -33.7 76.07 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.309 -0.869 . . . . 0.0 110.167 -179.965 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.749 HG23 ' O ' ' B' ' 9' ' ' LYS . 58.6 t -64.36 -41.96 93.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.278 -0.889 . . . . 0.0 110.093 -179.973 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.04 -35.65 79.23 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.228 -0.92 . . . . 0.0 110.415 -179.974 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 28.7 m -62.31 -44.01 97.5 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.175 -0.953 . . . . 0.0 110.522 -179.862 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.41 HG23 ' CB ' ' A' ' 13' ' ' SER . 84.2 t -68.74 -42.54 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.201 -0.937 . . . . 0.0 110.578 -179.728 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.546 HG23 ' O ' ' B' ' 13' ' ' VAL . 89.9 t -58.28 -44.83 88.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.098 -1.001 . . . . 0.0 110.503 -179.86 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.91 -38.49 91.27 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.316 -0.865 . . . . 0.0 110.285 -179.823 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.99 -46.06 82.99 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.169 -0.957 . . . . 0.0 110.39 -179.935 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.642 HG22 ' HZ ' ' A' ' 63' ' ' PHE . 76.1 t -65.45 -42.33 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.239 -0.913 . . . . 0.0 110.309 -179.86 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -58.48 -41.62 85.68 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.25 -0.906 . . . . 0.0 110.202 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 3.5 tm0? -60.49 -47.84 84.38 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.219 -0.925 . . . . 0.0 110.005 -179.944 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.88 -35.09 80.01 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.296 -0.877 . . . . 0.0 110.195 179.875 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . 0.448 ' HG2' ' NH1' ' B' ' 24' ' ' ARG . 17.8 ttp85 . . . . . 0 N--CA 1.492 1.669 0 O-C-N 121.233 -0.917 . . . . 0.0 110.456 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.239 0.542 . . . . 0.0 110.207 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -76.91 0.42 21.03 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.238 -0.914 . . . . 0.0 110.214 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -152.0 149.93 29.42 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.262 -0.899 . . . . 0.0 110.172 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.407 ' O ' ' CB ' ' A' ' 5' ' ' ASP . 1.0 OUTLIER -164.84 124.9 1.94 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.171 -0.956 . . . . 0.0 110.264 -179.959 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.511 ' O ' ' N ' ' A' ' 7' ' ' ALA . 0.1 OUTLIER 175.46 33.81 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.236 -0.915 . . . . 0.0 110.176 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.517 HG22 ' CE2' ' A' ' 68' ' ' TYR . 1.6 m 63.16 -71.58 0.05 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.251 -0.906 . . . . 0.0 110.107 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.511 ' N ' ' O ' ' A' ' 5' ' ' ASP . . . -70.28 -44.23 68.81 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.074 -1.017 . . . . 0.0 109.476 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -62.02 -36.09 80.51 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.471 -0.768 . . . . 0.0 109.906 179.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -60.79 -43.08 98.58 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.33 -0.856 . . . . 0.0 110.097 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.518 HG12 ' HD2' ' A' ' 14' ' ' PHE . 62.0 t -66.06 -42.81 92.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.116 -0.99 . . . . 0.0 109.631 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.615 HG23 ' HE1' ' A' ' 60' ' ' TYR . 61.9 mt -61.45 -49.67 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.298 -0.876 . . . . 0.0 109.318 179.314 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.65 -39.09 92.79 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.377 -0.827 . . . . 0.0 109.228 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.2 m -68.18 -44.18 76.47 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.41 -0.806 . . . . 0.0 109.479 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.57 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 0.6 OUTLIER -65.7 -42.59 91.01 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.307 -0.87 . . . . 0.0 109.497 179.386 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.19 -42.91 70.22 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.343 -0.848 . . . . 0.0 109.416 179.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 17.0 mt -60.55 -44.85 97.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.35 -0.843 . . . . 0.0 109.583 179.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.859 HD12 ' HB3' ' A' ' 32' ' ' GLU . 2.5 mm? -65.09 -40.67 94.94 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.359 -0.838 . . . . 0.0 109.966 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.826 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -75.51 1.3 14.53 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.298 -0.876 . . . . 0.0 110.311 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.478 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.1 OUTLIER 67.0 69.18 0.4 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.209 -0.932 . . . . 0.0 110.303 179.866 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 47.04 56.21 7.07 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.243 -0.911 . . . . 0.0 110.28 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.538 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 18.5 mttp -134.34 143.49 47.12 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.16 -0.963 . . . . 0.0 110.023 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -73.83 -0.05 8.91 Favored 'Trans proline' 0 C--N 1.304 -1.815 0 O-C-N 124.04 1.547 . . . . 0.0 110.122 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.538 ' CZ ' ' HD3' ' A' ' 21' ' ' LYS . 23.1 p90 -145.94 163.18 35.96 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.237 -0.914 . . . . 0.0 110.22 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.826 HG12 ' HB2' ' A' ' 18' ' ' ALA . 0.3 OUTLIER -127.07 142.14 44.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.301 -0.874 . . . . 0.0 109.735 179.89 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.485 ' H ' HD13 ' A' ' 24' ' ' ILE . 44.1 mt -88.59 152.26 21.95 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.242 -0.911 . . . . 0.0 110.352 -179.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.26 -44.32 95.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.36 -0.837 . . . . 0.0 110.069 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -60.19 -34.97 74.35 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.365 -0.834 . . . . 0.0 110.242 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.466 ' HB3' HD11 ' A' ' 24' ' ' ILE . 9.0 mm-40 -61.87 -49.59 75.65 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.23 -0.919 . . . . 0.0 109.931 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.468 HD21 HG13 ' A' ' 24' ' ' ILE . 9.1 mt -59.53 -34.17 72.3 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.264 -0.898 . . . . 0.0 109.814 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.17 -42.26 93.86 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.329 -0.857 . . . . 0.0 110.174 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -91.33 -20.36 21.94 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.198 -0.938 . . . . 0.0 110.456 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.859 ' HB3' HD12 ' A' ' 17' ' ' LEU . 17.0 mm-40 -98.68 -23.76 15.32 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.08 -1.012 . . . . 0.0 110.409 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.432 HD22 ' HB3' ' A' ' 37' ' ' GLN . 0.3 OUTLIER -128.16 147.72 64.65 Favored Pre-proline 0 N--CA 1.487 1.393 0 O-C-N 121.165 -0.959 . . . . 0.0 110.066 179.962 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.497 ' O ' ' N ' ' A' ' 37' ' ' GLN . 5.9 Cg_exo -43.59 131.03 7.32 Favored 'Trans proline' 0 C--N 1.304 -1.782 0 O-C-N 123.89 1.469 . . . . 0.0 109.679 179.402 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.429 ' C ' ' O ' ' A' ' 34' ' ' PRO . 12.0 Cg_exo -36.8 -42.38 0.77 Allowed 'Trans proline' 0 C--N 1.306 -1.67 0 O-C-N 124.254 1.66 . . . . 0.0 110.619 -179.392 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -65.94 -36.64 83.89 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.352 -0.843 . . . . 0.0 110.857 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.665 ' HG3' HG11 ' B' ' 20' ' ' VAL . 1.8 mp0 -69.09 -44.5 72.35 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.064 -1.023 . . . . 0.0 110.784 -179.262 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.734 ' O ' HD12 ' A' ' 42' ' ' ILE . . . -58.66 -47.24 85.14 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.195 -0.94 . . . . 0.0 110.707 -179.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.4 tp60 -60.3 -49.43 77.63 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.227 -0.92 . . . . 0.0 110.995 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 51.6 t80 -61.84 -48.0 82.55 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.009 -1.057 . . . . 0.0 110.436 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.447 ' O ' ' SD ' ' A' ' 45' ' ' MET . 69.8 m -65.35 -49.51 69.08 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.256 -0.902 . . . . 0.0 110.64 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.734 HD12 ' O ' ' A' ' 38' ' ' ALA . 18.6 mt -44.45 -24.66 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.12 -0.988 . . . . 0.0 110.535 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -84.15 -41.28 17.22 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.173 -0.955 . . . . 0.0 110.743 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.532 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 1.5 mmt-85 -64.11 -72.62 0.14 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.12 -0.987 . . . . 0.0 110.59 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.468 ' CB ' ' O ' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -48.01 116.9 5.1 Favored Pre-proline 0 N--CA 1.489 1.475 0 O-C-N 121.14 -0.975 . . . . 0.0 110.394 -179.841 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.581 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 10.5 Cg_endo -59.55 -157.58 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.728 0 O-C-N 124.14 1.6 . . . . 0.0 110.45 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.601 ' O ' ' CD1' ' A' ' 48' ' ' TYR . . . -88.8 71.13 8.71 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.311 -0.868 . . . . 0.0 110.404 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.626 ' CE2' ' CB ' ' A' ' 53' ' ' SER . 27.0 p90 32.73 -156.46 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.017 0 CA-C-O 121.375 0.607 . . . . 0.0 111.337 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.536 ' N ' ' CD2' ' A' ' 48' ' ' TYR . 0.4 OUTLIER 169.35 72.34 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.142 -0.974 . . . . 0.0 110.249 -179.751 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.463 ' H ' ' HG ' ' A' ' 53' ' ' SER . . . -134.14 177.01 19.47 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.544 -1.423 . . . . 0.0 109.544 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -81.74 -53.73 0.04 OUTLIER 'Trans proline' 0 C--N 1.304 -1.767 0 O-C-N 124.005 1.529 . . . . 0.0 110.214 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.486 ' O ' ' O ' ' A' ' 53' ' ' SER . . . -96.24 35.77 4.2 Favored Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.437 -1.465 . . . . 0.0 109.437 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.626 ' CB ' ' CE2' ' A' ' 48' ' ' TYR . 69.1 m -53.71 -162.74 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.304 0 O-C-N 121.402 -1.058 . . . . 0.0 110.717 -179.6 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.82 ' CG2' ' HB2' ' A' ' 57' ' ' ALA . 10.5 m -136.0 172.16 7.57 Favored Pre-proline 0 N--CA 1.492 1.65 0 O-C-N 121.264 -0.897 . . . . 0.0 110.137 179.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -79.51 72.79 6.34 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 124.042 1.549 . . . . 0.0 110.17 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 130.68 50.96 0.1 Allowed Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.82 ' HB2' ' CG2' ' A' ' 54' ' ' VAL . . . -108.15 158.85 17.07 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.291 -1.123 . . . . 0.0 110.194 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.794 HD23 ' O ' ' A' ' 57' ' ' ALA . 25.1 mt -135.88 147.54 48.23 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.197 -0.94 . . . . 0.0 110.147 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.477 ' CG ' ' HA ' ' A' ' 48' ' ' TYR . 0.7 OUTLIER -103.37 111.83 24.43 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.19 -0.944 . . . . 0.0 110.291 179.916 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.615 ' HE1' HG23 ' A' ' 11' ' ' ILE . 8.0 p90 -81.66 -19.81 40.9 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.275 -0.89 . . . . 0.0 109.63 179.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.53 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -61.48 -40.76 95.73 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.415 -0.803 . . . . 0.0 109.853 179.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.581 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -66.53 -36.21 82.13 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.211 -0.931 . . . . 0.0 109.662 179.645 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.532 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 2.4 t80 -72.07 -34.75 68.95 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.722 -0.611 . . . . 0.0 110.18 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.3 p -60.91 -42.4 97.98 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.331 -0.856 . . . . 0.0 110.38 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 8.5 t -64.14 -36.86 85.43 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.218 -0.926 . . . . 0.0 110.486 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.489 ' HA ' ' O ' ' A' ' 69' ' ' GLY . . . -67.7 -41.0 84.28 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.211 -0.931 . . . . 0.0 110.473 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.5 -44.07 89.32 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.208 -0.933 . . . . 0.0 110.187 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.517 ' CE2' HG22 ' A' ' 6' ' ' THR . 39.4 m-85 -99.38 13.68 32.35 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.237 -0.914 . . . . 0.0 110.473 -179.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.489 ' O ' ' HA ' ' A' ' 66' ' ' ALA . . . -174.77 102.11 0.17 Allowed Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.766 -1.334 . . . . 0.0 109.766 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.445 ' O ' ' CB ' ' A' ' 71' ' ' SER . 0.1 OUTLIER -131.61 107.9 9.15 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.257 -1.143 . . . . 0.0 110.117 179.798 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.567 ' O ' HD23 ' A' ' 73' ' ' LEU . 0.3 OUTLIER 65.47 146.69 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.261 -0.9 . . . . 0.0 110.207 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -78.33 138.01 38.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.285 -0.884 . . . . 0.0 110.222 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.567 HD23 ' O ' ' A' ' 71' ' ' SER . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.626 0 O-C-N 121.276 -0.89 . . . . 0.0 110.226 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.281 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 5.6 tttt -75.12 -43.69 51.29 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.264 -1.139 . . . . 0.0 110.072 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 14.5 tttt -67.86 -46.71 70.96 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.297 -0.877 . . . . 0.0 110.148 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.1 -41.08 71.18 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.259 -0.901 . . . . 0.0 109.816 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -60.55 -40.3 91.09 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.299 -0.876 . . . . 0.0 109.71 179.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . 0.538 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -63.19 -42.12 99.28 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.425 -0.797 . . . . 0.0 110.028 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.777 ' O ' HG23 ' B' ' 17' ' ' VAL . 46.6 t -61.28 -40.59 86.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.212 -0.93 . . . . 0.0 109.703 179.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.0 -39.24 77.78 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.259 -0.901 . . . . 0.0 109.499 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.7 m -68.82 -47.21 66.63 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.384 -0.822 . . . . 0.0 109.576 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.622 ' O ' HG23 ' B' ' 20' ' ' VAL . 26.4 t -63.46 -45.54 97.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.316 -0.865 . . . . 0.0 109.595 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.777 HG23 ' O ' ' B' ' 13' ' ' VAL . 49.4 t -62.45 -49.68 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.263 -0.898 . . . . 0.0 109.437 179.283 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.1 -43.07 77.74 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.363 -0.836 . . . . 0.0 109.924 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.18 -36.75 82.45 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.278 -0.888 . . . . 0.0 109.906 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.665 HG11 ' HG3' ' A' ' 37' ' ' GLN . 55.4 t -65.29 -41.43 91.39 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 121.187 -0.946 . . . . 0.0 109.713 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.3 -31.66 72.29 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.349 -0.844 . . . . 0.0 110.129 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.25 -51.23 70.84 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.232 -0.917 . . . . 0.0 110.087 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.26 -34.36 77.83 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.223 -0.923 . . . . 0.0 109.858 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.3 ttt180 -63.78 -36.46 83.96 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.405 -0.809 . . . . 0.0 110.474 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -53.61 -22.23 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 O-C-N 121.134 -0.979 . . . . 0.0 109.911 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -87.07 18.49 3.58 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.55 -0.719 . . . . 0.0 110.385 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . 0.461 ' O ' ' O ' ' B' ' 28' ' ' PRO . 0.0 OUTLIER -108.73 114.63 58.51 Favored Pre-proline 0 N--CA 1.492 1.629 0 O-C-N 121.281 -0.887 . . . . 0.0 110.049 179.88 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . 0.461 ' O ' ' O ' ' B' ' 27' ' ' GLU . 18.7 Cg_endo -54.51 -163.74 0.01 OUTLIER 'Trans proline' 0 C--N 1.303 -1.819 0 O-C-N 124.12 1.59 . . . . 0.0 110.431 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.588 0 O-C-N 121.28 -0.888 . . . . 0.0 110.325 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 38.0 tpp . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.187 0.518 . . . . 0.0 110.17 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -173.15 127.22 0.45 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.212 -0.93 . . . . 0.0 110.205 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -140.38 176.85 8.43 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.253 -0.904 . . . . 0.0 110.232 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.424 ' O ' ' OD1' ' A' ' 5' ' ' ASP . 12.7 t -81.97 -179.51 7.42 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.321 -0.862 . . . . 0.0 110.21 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.424 ' OD1' ' O ' ' A' ' 4' ' ' THR . 0.1 OUTLIER 176.6 170.36 0.47 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.251 -0.906 . . . . 0.0 110.388 179.972 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.676 HG21 ' CE1' ' A' ' 68' ' ' TYR . 0.6 OUTLIER -52.97 -50.3 64.4 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.379 -0.825 . . . . 0.0 110.245 -179.971 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.33 -47.45 76.48 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.287 -0.883 . . . . 0.0 109.866 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -54.59 -36.34 64.31 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.382 -0.824 . . . . 0.0 109.828 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.415 ' O ' ' OG ' ' A' ' 13' ' ' SER . 4.2 tp60 -61.63 -48.05 82.63 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.322 -0.861 . . . . 0.0 110.151 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.477 HG12 ' CD2' ' A' ' 14' ' ' PHE . 12.6 t -64.3 -43.08 97.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.139 -0.975 . . . . 0.0 109.9 179.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 30.6 mt -62.0 -48.31 89.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 121.273 -0.892 . . . . 0.0 109.621 179.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.51 -41.01 79.95 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.223 -0.923 . . . . 0.0 109.006 179.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.449 ' HB3' HG23 ' B' ' 16' ' ' VAL . 3.7 m -68.16 -39.09 82.68 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.431 -0.793 . . . . 0.0 109.371 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.499 ' CG ' ' HB2' ' A' ' 60' ' ' TYR . 2.6 m-85 -68.58 -45.35 72.29 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.386 -0.822 . . . . 0.0 109.73 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 11.3 tpp85 -53.72 -41.18 66.74 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.345 -0.847 . . . . 0.0 109.55 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 42.5 mt -62.37 -44.54 99.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.401 -0.812 . . . . 0.0 109.922 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.661 HD22 ' HB3' ' A' ' 32' ' ' GLU . 56.8 mt -64.84 -41.75 95.48 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.344 -0.848 . . . . 0.0 109.861 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.677 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -67.86 -7.88 31.74 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.304 -0.872 . . . . 0.0 110.106 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.8 t 62.43 68.79 0.64 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.268 -0.895 . . . . 0.0 110.302 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 58.36 53.79 6.12 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.245 -0.909 . . . . 0.0 110.189 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.677 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 18.8 mtmt -141.9 143.36 28.23 Favored Pre-proline 0 N--CA 1.489 1.51 0 O-C-N 121.209 -0.932 . . . . 0.0 110.078 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -78.58 5.39 5.59 Favored 'Trans proline' 0 C--N 1.304 -1.787 0 O-C-N 124.078 1.568 . . . . 0.0 109.96 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.475 ' CD1' ' N ' ' A' ' 23' ' ' TYR . 28.9 p90 -145.3 159.83 42.43 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.279 -0.888 . . . . 0.0 109.963 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.817 HD12 HD23 ' A' ' 29' ' ' LEU . 0.3 OUTLIER -126.71 143.21 40.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.154 -0.966 . . . . 0.0 109.882 179.816 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.455 ' H ' HD13 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -100.66 150.64 22.53 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.29 -0.881 . . . . 0.0 110.407 -179.756 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.0 -33.12 66.83 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.283 -0.886 . . . . 0.0 109.74 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -61.53 -40.07 93.32 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.335 -0.853 . . . . 0.0 109.67 179.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.503 ' HB3' HD11 ' A' ' 24' ' ' ILE . 0.6 OUTLIER -68.56 -48.44 64.27 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.389 -0.819 . . . . 0.0 109.794 179.568 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.956 ' CD1' HD12 ' A' ' 33' ' ' LEU . 4.3 mm? -60.78 -34.24 74.2 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.198 -0.939 . . . . 0.0 109.738 179.612 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.0 mmm-85 -68.96 -34.72 75.8 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.36 -0.837 . . . . 0.0 110.109 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.64 -14.6 27.92 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.344 -0.847 . . . . 0.0 110.579 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.661 ' HB3' HD22 ' A' ' 17' ' ' LEU . 21.1 mm-40 -106.7 -23.53 12.4 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.078 -1.014 . . . . 0.0 110.693 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.956 HD12 ' CD1' ' A' ' 29' ' ' LEU . 6.4 mt -122.61 164.6 25.6 Favored Pre-proline 0 N--CA 1.488 1.431 0 O-C-N 121.073 -1.017 . . . . 0.0 110.249 -179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.442 ' CD ' HD23 ' A' ' 33' ' ' LEU . 33.8 Cg_exo -66.11 144.81 76.95 Favored 'Trans proline' 0 C--N 1.305 -1.761 0 O-C-N 124.036 1.545 . . . . 0.0 109.908 179.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.433 ' C ' ' O ' ' A' ' 34' ' ' PRO . 19.4 Cg_endo -40.48 -44.96 4.44 Favored 'Trans proline' 0 C--N 1.304 -1.802 0 O-C-N 124.032 1.543 . . . . 0.0 110.414 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.72 -37.49 86.57 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.244 -0.91 . . . . 0.0 110.729 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.522 ' HG2' HG22 ' B' ' 17' ' ' VAL . 0.0 OUTLIER -69.26 -45.83 68.76 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.137 -0.977 . . . . 0.0 110.554 -179.579 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.55 -44.21 96.39 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.156 -0.965 . . . . 0.0 110.582 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.9 tp60 -66.1 -46.53 77.3 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.096 -1.003 . . . . 0.0 110.473 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -63.28 -45.99 88.87 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.239 -0.913 . . . . 0.0 110.342 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.45 ' SG ' ' O ' ' A' ' 37' ' ' GLN . 74.9 m -60.93 -44.34 97.34 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.253 -0.904 . . . . 0.0 110.54 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 25.5 mt -53.88 -24.2 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.2 -0.937 . . . . 0.0 110.305 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.9 tttm -81.06 -19.43 43.79 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.127 -0.983 . . . . 0.0 110.227 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.591 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 26.4 mmt180 -92.24 -68.5 0.79 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.277 -0.889 . . . . 0.0 110.304 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.469 ' HB2' ' O ' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -55.55 109.6 1.73 Allowed Pre-proline 0 N--CA 1.489 1.489 0 O-C-N 121.186 -0.946 . . . . 0.0 110.324 179.907 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.622 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 19.7 Cg_exo -66.63 -159.11 0.04 OUTLIER 'Trans proline' 0 C--N 1.304 -1.791 0 O-C-N 124.076 1.566 . . . . 0.0 110.217 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.27 152.8 43.79 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.27 -0.894 . . . . 0.0 110.42 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.655 ' CE2' ' HB2' ' A' ' 53' ' ' SER . 0.0 OUTLIER -58.68 -177.93 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.351 -0.843 . . . . 0.0 110.735 179.962 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 89.7 p -157.89 39.7 0.27 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.234 -0.916 . . . . 0.0 110.347 -179.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -91.08 -162.93 38.49 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.424 -1.47 . . . . 0.0 109.424 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo -93.49 -50.24 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.736 0 O-C-N 124.069 1.563 . . . . 0.0 110.061 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.523 ' O ' ' C ' ' A' ' 53' ' ' SER . . . -112.96 -42.26 0.94 Allowed Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.655 ' HB2' ' CE2' ' A' ' 48' ' ' TYR . 0.7 OUTLIER 25.98 -143.25 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.311 0 CA-C-O 121.518 0.675 . . . . 0.0 111.642 179.537 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.568 HG13 ' C ' ' A' ' 53' ' ' SER . 24.5 m -153.32 157.22 32.88 Favored Pre-proline 0 C--N 1.294 -1.814 0 O-C-N 121.491 -0.755 . . . . 0.0 110.567 -179.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -68.18 123.51 10.69 Favored 'Trans proline' 0 C--N 1.306 -1.683 0 O-C-N 124.152 1.607 . . . . 0.0 110.223 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 111.02 -20.5 23.91 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.22 140.45 58.74 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.31 -1.112 . . . . 0.0 110.284 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.1 mt -121.66 160.15 25.05 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.24 -0.912 . . . . 0.0 110.015 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.529 ' OD2' ' HB2' ' A' ' 62' ' ' ALA . 6.2 t0 -97.6 111.61 23.81 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.252 -0.905 . . . . 0.0 110.349 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.605 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 11.2 p90 -79.6 -23.42 42.69 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.27 -0.894 . . . . 0.0 109.279 179.354 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.605 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -60.01 -42.96 95.41 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.395 -0.816 . . . . 0.0 109.657 179.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.622 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -60.79 -32.83 72.16 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.247 -0.908 . . . . 0.0 109.868 179.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.591 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 1.3 t80 -71.63 -36.77 70.86 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.687 -0.633 . . . . 0.0 110.372 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.2 m -61.47 -38.89 88.89 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.147 -0.971 . . . . 0.0 110.457 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.455 ' O ' ' O ' ' A' ' 69' ' ' GLY . 44.8 p -68.37 -42.36 79.26 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.205 -0.934 . . . . 0.0 110.418 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -63.65 -38.11 89.87 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.216 -0.928 . . . . 0.0 110.619 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.77 -42.3 88.65 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.146 -0.971 . . . . 0.0 110.529 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.676 ' CE1' HG21 ' A' ' 6' ' ' THR . 28.3 m-85 -97.78 -34.23 10.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.181 -0.949 . . . . 0.0 110.431 -179.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.455 ' O ' ' O ' ' A' ' 65' ' ' SER . . . 133.66 -124.54 3.68 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.433 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 36.3 tt0 50.72 60.19 4.05 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.199 -1.177 . . . . 0.0 110.198 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.0 t -145.23 114.34 6.99 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.212 -0.93 . . . . 0.0 110.179 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -84.03 127.17 33.7 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.213 -0.929 . . . . 0.0 110.239 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.2 mp . . . . . 0 N--CA 1.491 1.62 0 O-C-N 121.241 -0.912 . . . . 0.0 110.24 -179.942 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.47 -52.6 60.71 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.242 -1.152 . . . . 0.0 110.176 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.95 -48.49 71.16 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.276 -0.89 . . . . 0.0 110.035 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.15 -37.43 66.95 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.28 -0.887 . . . . 0.0 109.883 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -66.23 -40.2 90.09 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.274 -0.891 . . . . 0.0 109.804 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.42 -43.78 98.01 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.259 -0.901 . . . . 0.0 109.649 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.502 ' O ' HG23 ' B' ' 17' ' ' VAL . 76.6 t -58.78 -40.34 79.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.193 -0.942 . . . . 0.0 109.485 179.293 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.06 -38.85 92.82 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.46 -0.775 . . . . 0.0 109.966 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 57.2 m -69.12 -45.53 69.95 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.396 -0.815 . . . . 0.0 110.172 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.72 HG11 HD11 ' A' ' 33' ' ' LEU . 70.3 t -62.47 -46.95 95.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.214 -0.928 . . . . 0.0 109.983 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.522 HG22 ' HG2' ' A' ' 37' ' ' GLN . 77.3 t -60.56 -49.15 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.182 -0.949 . . . . 0.0 110.009 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.5 -39.39 76.38 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.303 -0.873 . . . . 0.0 110.107 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.86 -45.39 78.32 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.309 -0.869 . . . . 0.0 110.116 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 53.3 t -61.85 -41.68 91.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.306 -0.871 . . . . 0.0 110.132 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.07 -38.51 91.48 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.299 -0.875 . . . . 0.0 110.169 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.45 ' HA ' HG12 ' B' ' 25' ' ' VAL . 1.7 tt0 -55.83 -41.35 74.14 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.193 -0.942 . . . . 0.0 110.295 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.5 -42.53 95.76 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.214 -0.929 . . . . 0.0 110.282 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.2 mmm-85 -70.39 -49.12 52.34 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.3 -0.875 . . . . 0.0 110.317 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . 0.45 HG12 ' HA ' ' B' ' 22' ' ' GLN . 3.5 p -66.86 -24.86 33.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.35 -0.844 . . . . 0.0 110.532 -179.614 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.408 ' HB3' ' O ' ' B' ' 25' ' ' VAL . 20.8 ttt-85 60.58 66.42 0.93 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.471 -0.768 . . . . 0.0 110.215 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -106.44 130.93 22.17 Favored Pre-proline 0 N--CA 1.493 1.682 0 O-C-N 121.198 -0.939 . . . . 0.0 110.249 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -80.06 163.54 22.82 Favored 'Trans proline' 0 C--N 1.307 -1.638 0 O-C-N 124.046 1.55 . . . . 0.0 110.369 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.565 0 O-C-N 121.188 -0.945 . . . . 0.0 110.175 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.478 ' O ' ' HB3' ' A' ' 2' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.203 0.525 . . . . 0.0 110.186 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.478 ' HB3' ' O ' ' A' ' 1' ' ' MET . . . 57.28 175.95 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.284 -0.885 . . . . 0.0 110.175 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.441 ' HB3' ' OE2' ' A' ' 8' ' ' GLU . 0.1 OUTLIER -178.62 150.94 0.55 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.187 -0.946 . . . . 0.0 110.284 179.992 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.432 ' O ' ' CB ' ' A' ' 5' ' ' ASP . 4.9 t -169.99 150.64 3.85 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.222 -0.924 . . . . 0.0 110.138 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.432 ' CB ' ' O ' ' A' ' 4' ' ' THR . 0.1 OUTLIER 173.58 -179.72 0.09 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.188 -0.945 . . . . 0.0 110.276 -179.943 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.453 ' HB ' ' CZ ' ' A' ' 68' ' ' TYR . 9.5 p -67.89 -61.54 1.82 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.304 -0.873 . . . . 0.0 110.1 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.02 -44.82 83.22 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.201 -0.937 . . . . 0.0 109.431 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.74 ' HA ' HD12 ' A' ' 11' ' ' ILE . 18.0 tt0 -60.49 -36.2 77.74 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.407 -0.808 . . . . 0.0 109.591 179.314 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -61.8 -48.56 80.07 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.3 -0.875 . . . . 0.0 110.322 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.788 HG12 ' CD2' ' A' ' 14' ' ' PHE . 46.6 t -58.54 -41.22 81.32 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.08 -1.012 . . . . 0.0 109.589 179.574 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.74 HD12 ' HA ' ' A' ' 8' ' ' GLU . 64.8 mt -61.3 -45.66 98.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.412 -0.805 . . . . 0.0 109.472 179.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.22 -47.2 83.51 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.32 -0.863 . . . . 0.0 109.144 179.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.468 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 14.2 m -62.92 -39.26 94.03 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.284 -0.885 . . . . 0.0 109.009 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.788 ' CD2' HG12 ' A' ' 10' ' ' VAL . 1.2 m-85 -66.98 -43.29 83.38 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.434 -0.791 . . . . 0.0 109.41 179.23 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.554 ' CD ' ' HA ' ' A' ' 20' ' ' ASP . 0.0 OUTLIER -53.18 -43.11 66.85 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.29 -0.881 . . . . 0.0 109.009 179.184 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.59 HD12 ' HB2' ' B' ' 12' ' ' ALA . 39.7 mt -58.89 -44.81 91.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.463 -0.773 . . . . 0.0 109.432 179.117 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 13' ' ' SER . 33.2 mt -65.05 -41.99 94.66 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.232 -0.917 . . . . 0.0 109.779 179.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.685 ' HB1' ' O ' ' A' ' 23' ' ' TYR . . . -76.33 -2.07 29.9 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.421 -0.799 . . . . 0.0 110.195 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.455 ' O ' ' C ' ' A' ' 20' ' ' ASP . 0.4 OUTLIER 64.93 77.37 0.31 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.317 -0.864 . . . . 0.0 110.328 179.783 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.554 ' HA ' ' CD ' ' A' ' 15' ' ' ARG . 4.6 p-10 37.44 45.36 0.56 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.593 -0.692 . . . . 0.0 110.517 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 18' ' ' ALA . 10.7 mmtt -122.08 144.89 42.5 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.351 -0.843 . . . . 0.0 110.116 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -65.5 -8.2 18.4 Favored 'Trans proline' 0 C--N 1.304 -1.783 0 O-C-N 124.218 1.641 . . . . 0.0 110.209 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.685 ' O ' ' HB1' ' A' ' 18' ' ' ALA . 19.5 p90 -143.85 167.53 22.1 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.315 -0.866 . . . . 0.0 110.288 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.754 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -123.19 140.66 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.303 -0.873 . . . . 0.0 109.767 179.797 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.754 ' N ' HD13 ' A' ' 24' ' ' ILE . 3.3 mp -81.47 149.96 28.51 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.142 -0.974 . . . . 0.0 110.216 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.511 ' HA ' HD11 ' A' ' 42' ' ' ILE . . . -61.47 -40.03 93.06 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.368 -0.832 . . . . 0.0 110.268 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -63.59 -36.28 83.29 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.219 -0.926 . . . . 0.0 109.899 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.553 ' HB3' HD11 ' A' ' 24' ' ' ILE . 2.6 mm-40 -60.62 -37.53 81.73 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.248 -0.907 . . . . 0.0 109.3 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.713 HD12 ' CD1' ' A' ' 42' ' ' ILE . 22.9 mt -66.53 -36.33 82.42 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.394 -0.816 . . . . 0.0 109.606 179.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.0 mtt85 -68.81 -34.53 75.68 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.331 -0.856 . . . . 0.0 110.116 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.402 ' NH1' ' HG2' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -93.9 -18.67 21.71 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.293 -0.88 . . . . 0.0 110.773 -179.499 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.47 ' CG ' ' O ' ' A' ' 28' ' ' GLU . 12.6 mm-40 -99.55 -23.61 15.03 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.025 -1.047 . . . . 0.0 110.745 -179.616 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.797 HD11 HG11 ' B' ' 16' ' ' VAL . 2.3 mt -128.63 141.83 42.86 Favored Pre-proline 0 N--CA 1.488 1.475 0 O-C-N 121.055 -1.028 . . . . 0.0 110.12 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.592 ' HD2' HD23 ' A' ' 33' ' ' LEU . 31.6 Cg_exo -43.58 130.91 7.28 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.825 1.434 . . . . 0.0 109.634 179.51 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.458 ' C ' ' O ' ' A' ' 34' ' ' PRO . 32.3 Cg_exo -35.18 -38.95 0.2 Allowed 'Trans proline' 0 C--N 1.308 -1.598 0 O-C-N 124.274 1.671 . . . . 0.0 110.904 -179.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.15 -43.9 85.7 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.35 -0.843 . . . . 0.0 110.954 -179.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.71 ' HB3' HD22 ' A' ' 33' ' ' LEU . 2.5 mp0 -70.02 -42.02 73.52 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.081 -1.012 . . . . 0.0 110.99 -179.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.496 ' O ' HG12 ' A' ' 42' ' ' ILE . . . -55.87 -45.83 78.44 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.245 -0.909 . . . . 0.0 110.662 -179.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -54.53 -46.86 73.64 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.111 -0.993 . . . . 0.0 110.68 -179.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -63.16 -47.01 84.48 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.094 -1.004 . . . . 0.0 110.551 -179.638 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.486 ' O ' ' HG2' ' A' ' 45' ' ' MET . 84.3 m -65.33 -48.36 73.3 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.15 -0.969 . . . . 0.0 110.681 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.713 ' CD1' HD12 ' A' ' 29' ' ' LEU . 15.9 mm -47.58 -31.06 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.127 -0.983 . . . . 0.0 110.876 -179.529 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 10.2 tttt -85.01 -36.7 21.11 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.105 -0.997 . . . . 0.0 110.374 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.569 ' HG3' ' CE1' ' A' ' 63' ' ' PHE . 9.3 mmp_? -60.13 -73.42 0.09 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.34 -0.85 . . . . 0.0 110.271 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.668 ' HE2' ' HA ' ' A' ' 60' ' ' TYR . 21.2 ptp -56.73 138.97 77.24 Favored Pre-proline 0 N--CA 1.488 1.453 0 O-C-N 121.213 -0.929 . . . . 0.0 110.301 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.517 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 20.5 Cg_endo -88.25 -170.19 0.5 Allowed 'Trans proline' 0 C--N 1.306 -1.694 0 O-C-N 123.963 1.507 . . . . 0.0 110.504 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -77.0 131.78 38.64 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.216 -0.928 . . . . 0.0 110.176 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.448 ' O ' ' OG ' ' A' ' 53' ' ' SER . 20.2 t80 -72.12 92.83 1.37 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.275 -0.89 . . . . 0.0 110.159 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -104.07 73.33 1.14 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.203 -0.936 . . . . 0.0 110.357 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.437 ' O ' ' N ' ' A' ' 52' ' ' GLY . . . -101.45 -161.57 27.15 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -68.8 60.27 1.21 Allowed 'Trans proline' 0 C--N 1.307 -1.656 0 O-C-N 123.898 1.473 . . . . 0.0 110.197 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.453 ' O ' ' HB3' ' A' ' 53' ' ' SER . . . 138.51 -86.85 0.21 Allowed Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.453 ' HB3' ' O ' ' A' ' 52' ' ' GLY . 10.8 t 56.06 -179.25 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.34 0 O-C-N 121.244 -1.151 . . . . 0.0 110.257 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 34.4 m -138.35 154.04 73.37 Favored Pre-proline 0 C--N 1.294 -1.833 0 O-C-N 121.762 -0.587 . . . . 0.0 110.119 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -59.55 117.99 4.8 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 124.132 1.596 . . . . 0.0 110.307 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 103.73 17.92 15.58 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -102.34 125.77 49.15 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.171 -1.194 . . . . 0.0 110.335 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.403 ' HA ' ' O ' ' A' ' 46' ' ' PRO . 1.2 mp -114.95 159.54 20.61 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.306 -0.871 . . . . 0.0 109.725 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.483 ' O ' ' HB2' ' A' ' 45' ' ' MET . 4.9 m-20 -108.39 110.61 22.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.024 -1.048 . . . . 0.0 110.479 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.668 ' HA ' ' HE2' ' A' ' 45' ' ' MET . 15.0 p90 -73.35 -26.7 61.13 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.336 -0.852 . . . . 0.0 110.14 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.558 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.13 -36.36 68.16 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.273 -0.892 . . . . 0.0 109.983 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.517 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -68.12 -34.41 76.33 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.248 -0.907 . . . . 0.0 109.885 179.616 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.569 ' CE1' ' HG3' ' A' ' 44' ' ' ARG . 2.7 t80 -71.77 -33.44 68.61 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.591 -0.693 . . . . 0.0 110.246 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.7 p -58.26 -48.19 81.2 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.302 -0.874 . . . . 0.0 110.383 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.403 ' O ' ' N ' ' A' ' 69' ' ' GLY . 3.3 t -68.55 -38.65 80.97 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.223 -0.923 . . . . 0.0 110.324 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.16 -31.03 71.63 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.235 -0.916 . . . . 0.0 110.367 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.605 HD21 ' HB2' ' B' ' 23' ' ' ALA . 0.5 OUTLIER -69.25 -43.27 74.31 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.243 -0.911 . . . . 0.0 110.326 -179.823 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.453 ' CZ ' ' HB ' ' A' ' 6' ' ' THR . 29.5 m-85 -91.81 -25.32 19.05 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.185 -0.947 . . . . 0.0 110.236 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.403 ' N ' ' O ' ' A' ' 65' ' ' SER . . . 65.35 109.96 0.01 OUTLIER Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.435 ' O ' ' CB ' ' A' ' 71' ' ' SER . 3.7 tp10 -155.65 49.59 0.53 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.237 -1.155 . . . . 0.0 110.231 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.435 ' CB ' ' O ' ' A' ' 70' ' ' GLU . 0.9 OUTLIER 65.43 105.33 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.171 -0.956 . . . . 0.0 110.183 -179.962 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -61.47 114.49 3.26 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.254 -0.904 . . . . 0.0 110.263 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.59 0 O-C-N 121.255 -0.903 . . . . 0.0 110.251 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.253 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -107.36 -52.3 2.78 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.211 -1.17 . . . . 0.0 110.231 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.418 ' HA ' HG21 ' A' ' 16' ' ' ILE . 8.6 ttpt -58.19 -47.29 83.87 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.183 -0.948 . . . . 0.0 110.101 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.69 -37.8 74.11 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.197 -0.939 . . . . 0.0 110.128 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -63.65 -40.21 96.28 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.183 -0.948 . . . . 0.0 110.217 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . 0.59 ' HB2' HD12 ' A' ' 16' ' ' ILE . . . -62.43 -43.07 99.69 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.284 -0.885 . . . . 0.0 110.036 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 87.4 t -62.71 -40.36 88.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.176 -0.952 . . . . 0.0 109.753 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.64 -36.3 82.38 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.421 -0.799 . . . . 0.0 110.182 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 34.8 m -69.85 -40.22 75.92 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.269 -0.894 . . . . 0.0 110.252 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.797 HG11 HD11 ' A' ' 33' ' ' LEU . 57.6 t -69.01 -41.74 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.254 -0.904 . . . . 0.0 110.243 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 18.6 t -60.9 -44.41 97.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.286 -0.884 . . . . 0.0 110.101 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.35 -44.77 93.89 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.235 -0.915 . . . . 0.0 110.197 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.93 -45.76 87.78 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.237 -0.914 . . . . 0.0 110.082 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.57 HG23 ' O ' ' B' ' 16' ' ' VAL . 88.3 t -61.45 -47.23 94.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.349 -0.844 . . . . 0.0 110.16 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.54 ' HA ' ' HD3' ' B' ' 24' ' ' ARG . 15.0 t70 -55.72 -31.89 62.88 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.124 -0.985 . . . . 0.0 109.709 179.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -64.35 -36.49 84.3 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.422 -0.799 . . . . 0.0 110.353 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.605 ' HB2' HD21 ' A' ' 67' ' ' LEU . . . -60.33 -40.38 90.42 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.33 -0.856 . . . . 0.0 110.451 -179.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . 0.54 ' HD3' ' HA ' ' B' ' 21' ' ' ASP . 0.2 OUTLIER -69.89 -47.27 63.19 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.082 -1.011 . . . . 0.0 109.726 179.903 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 55.2 t -52.45 -20.44 2.04 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.433 0 O-C-N 121.572 -0.705 . . . . 0.0 110.442 -179.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 2.8 ttp180 -79.36 12.67 2.29 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.361 -0.837 . . . . 0.0 110.996 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . 0.448 ' O ' ' N ' ' B' ' 29' ' ' ARG . 34.0 tt0 -102.96 136.68 19.2 Favored Pre-proline 0 N--CA 1.49 1.559 0 O-C-N 121.203 -0.936 . . . . 0.0 109.944 179.658 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' B' ' 27' ' ' GLU . 32.5 Cg_exo -62.45 79.83 0.1 Allowed 'Trans proline' 0 C--N 1.304 -1.786 0 O-C-N 124.015 1.534 . . . . 0.0 110.308 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . 0.448 ' N ' ' O ' ' B' ' 27' ' ' GLU . 9.3 mmm180 . . . . . 0 N--CA 1.491 1.584 0 O-C-N 121.285 -0.884 . . . . 0.0 110.254 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.7 mpp? . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.253 0.549 . . . . 0.0 110.219 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -153.76 93.24 1.64 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.261 -0.9 . . . . 0.0 110.199 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -128.0 -171.23 2.4 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.211 -0.931 . . . . 0.0 110.208 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 44.5 p -115.32 -173.7 2.37 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.266 -0.896 . . . . 0.0 110.16 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.49 ' O ' ' N ' ' A' ' 7' ' ' ALA . 53.4 m-20 -144.51 -49.4 0.27 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.293 -0.88 . . . . 0.0 110.282 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.452 ' CB ' ' O ' ' A' ' 5' ' ' ASP . 1.2 m 66.19 -61.5 0.29 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.27 -0.893 . . . . 0.0 110.171 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.49 ' N ' ' O ' ' A' ' 5' ' ' ASP . . . -62.74 -40.39 97.07 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.267 -0.896 . . . . 0.0 109.264 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -54.31 -34.44 60.96 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.541 -0.724 . . . . 0.0 109.459 179.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -60.08 -40.86 91.02 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.428 -0.795 . . . . 0.0 110.213 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.63 HG12 ' HD2' ' A' ' 14' ' ' PHE . 96.3 t -58.16 -42.42 83.2 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.052 -1.03 . . . . 0.0 109.453 179.514 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.528 HG23 ' HE1' ' A' ' 60' ' ' TYR . 75.3 mt -62.42 -49.29 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.394 -0.816 . . . . 0.0 109.368 179.292 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.09 -46.68 87.66 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.425 -0.797 . . . . 0.0 109.259 179.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 45.4 m -63.35 -40.41 97.2 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.339 -0.851 . . . . 0.0 109.223 179.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.63 ' HD2' HG12 ' A' ' 10' ' ' VAL . 1.6 m-85 -68.5 -41.2 80.38 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.396 -0.815 . . . . 0.0 109.569 179.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.18 -45.95 68.73 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.287 -0.883 . . . . 0.0 109.425 179.477 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.423 HG21 ' HA ' ' B' ' 9' ' ' LYS . 9.6 mt -58.24 -44.58 88.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.314 -0.866 . . . . 0.0 109.286 179.361 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.441 HD21 HD12 ' A' ' 33' ' ' LEU . 4.5 mp -64.97 -39.0 92.82 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.374 -0.829 . . . . 0.0 109.796 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.624 ' HB2' ' HB ' ' A' ' 24' ' ' ILE . . . -81.62 9.66 7.3 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.327 -0.858 . . . . 0.0 110.254 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 60.72 50.02 5.84 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.155 -0.966 . . . . 0.0 110.278 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.1 t70 59.38 58.76 2.88 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.334 -0.854 . . . . 0.0 110.43 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.9 mttp -139.68 141.67 28.82 Favored Pre-proline 0 N--CA 1.49 1.541 0 O-C-N 121.299 -0.876 . . . . 0.0 109.9 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -61.64 -11.79 21.97 Favored 'Trans proline' 0 C--N 1.304 -1.778 0 O-C-N 124.076 1.566 . . . . 0.0 109.913 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 43.4 p90 -138.92 167.45 22.0 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.35 -0.844 . . . . 0.0 110.094 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.67 HD13 ' CD2' ' A' ' 29' ' ' LEU . 9.2 tt -144.67 158.78 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.267 -0.896 . . . . 0.0 110.214 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.536 ' CD2' HG21 ' A' ' 54' ' ' VAL . 16.1 mt -88.14 141.36 28.62 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.277 -0.89 . . . . 0.0 110.099 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.556 ' HB2' ' CD1' ' A' ' 58' ' ' LEU . . . -58.57 -33.7 70.24 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.247 -0.908 . . . . 0.0 110.343 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -62.71 -38.81 91.93 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.205 -0.935 . . . . 0.0 110.134 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -58.59 -40.76 84.07 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.215 -0.928 . . . . 0.0 109.489 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.67 ' CD2' HD13 ' A' ' 24' ' ' ILE . 2.1 mm? -59.37 -36.06 75.06 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.319 -0.863 . . . . 0.0 109.6 179.432 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 44.0 mtt180 -69.14 -34.72 75.45 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.381 -0.824 . . . . 0.0 110.506 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.0 ttt180 -87.26 -18.01 31.21 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.289 -0.882 . . . . 0.0 111.032 -179.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -101.73 -23.66 14.19 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.98 -1.075 . . . . 0.0 110.967 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.501 ' CD2' ' HB3' ' A' ' 37' ' ' GLN . 0.1 OUTLIER -126.93 164.87 32.39 Favored Pre-proline 0 C--N 1.303 -1.455 0 O-C-N 121.019 -1.05 . . . . 0.0 110.365 -179.805 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.465 ' HD2' HD23 ' A' ' 33' ' ' LEU . 30.9 Cg_exo -58.08 138.57 86.61 Favored 'Trans proline' 0 C--N 1.302 -1.904 0 O-C-N 124.173 1.617 . . . . 0.0 109.882 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.422 ' C ' ' O ' ' A' ' 34' ' ' PRO . 16.0 Cg_exo -40.11 -40.67 2.86 Favored 'Trans proline' 0 C--N 1.303 -1.817 0 O-C-N 124.052 1.554 . . . . 0.0 110.438 -179.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.426 ' OD1' ' CD ' ' A' ' 37' ' ' GLN . 1.4 p30 -65.94 -41.77 90.86 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.242 -0.911 . . . . 0.0 110.896 -179.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.501 ' HB3' ' CD2' ' A' ' 33' ' ' LEU . 0.4 OUTLIER -69.35 -39.51 78.08 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.021 -1.049 . . . . 0.0 110.763 -179.382 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.628 ' O ' HD12 ' A' ' 42' ' ' ILE . . . -61.32 -43.53 98.71 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.135 -0.978 . . . . 0.0 110.871 -179.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -64.22 -47.67 78.81 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.064 -1.023 . . . . 0.0 110.818 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.61 -43.15 97.73 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.126 -0.984 . . . . 0.0 110.511 -179.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.447 ' O ' ' HG2' ' A' ' 45' ' ' MET . 72.7 m -65.05 -49.64 69.33 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.257 -0.902 . . . . 0.0 110.579 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.628 HD12 ' O ' ' A' ' 38' ' ' ALA . 27.5 mt -61.44 -17.6 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.156 -0.965 . . . . 0.0 110.279 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -84.64 -19.67 32.55 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.103 -0.998 . . . . 0.0 110.293 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.435 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 5.1 mmt85 -88.99 -69.69 0.69 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.179 -0.95 . . . . 0.0 110.096 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.488 ' HE2' ' CA ' ' A' ' 60' ' ' TYR . 13.7 ptp -45.65 135.35 6.1 Favored Pre-proline 0 N--CA 1.488 1.43 0 O-C-N 121.243 -0.911 . . . . 0.0 110.248 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 45' ' ' MET . 23.0 Cg_exo -85.24 -146.69 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.75 0 O-C-N 123.968 1.509 . . . . 0.0 110.308 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -93.62 131.78 38.58 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.232 -0.917 . . . . 0.0 110.294 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.0 t80 -48.21 -65.94 0.48 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.242 -0.911 . . . . 0.0 110.037 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -133.26 41.87 3.07 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.172 -0.955 . . . . 0.0 110.244 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.88 -174.42 48.9 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.621 -1.391 . . . . 0.0 109.621 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -70.72 62.85 2.33 Favored 'Trans proline' 0 C--N 1.305 -1.76 0 O-C-N 124.047 1.551 . . . . 0.0 110.299 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.468 ' O ' ' O ' ' A' ' 53' ' ' SER . . . -134.3 -48.52 0.09 OUTLIER Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.631 -1.387 . . . . 0.0 109.631 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.468 ' O ' ' O ' ' A' ' 52' ' ' GLY . 1.5 t -56.76 -152.07 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.268 0 O-C-N 121.279 -1.13 . . . . 0.0 110.879 -179.543 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 1.09 HG22 ' HB2' ' A' ' 57' ' ' ALA . 16.9 m -60.88 -168.12 0.02 OUTLIER Pre-proline 0 N--CA 1.491 1.599 0 O-C-N 121.246 -0.909 . . . . 0.0 110.212 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -92.02 34.69 0.26 Allowed 'Trans proline' 0 C--N 1.305 -1.723 0 O-C-N 123.999 1.526 . . . . 0.0 110.367 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.623 ' H ' HG23 ' A' ' 54' ' ' VAL . . . 167.26 38.88 0.02 OUTLIER Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.661 -1.376 . . . . 0.0 109.661 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 1.09 ' HB2' HG22 ' A' ' 54' ' ' VAL . . . -84.53 116.89 23.37 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.246 -1.149 . . . . 0.0 110.091 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.556 ' CD1' ' HB2' ' A' ' 26' ' ' ALA . 1.5 mt -119.42 159.93 23.28 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.21 -0.931 . . . . 0.0 110.337 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.439 ' O ' ' HB2' ' A' ' 45' ' ' MET . 3.4 m-20 -114.44 113.58 24.68 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.29 -0.881 . . . . 0.0 110.047 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.528 ' HE1' HG23 ' A' ' 11' ' ' ILE . 18.7 p90 -77.7 -22.08 51.02 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.247 -0.908 . . . . 0.0 110.205 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.446 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.26 -36.54 68.68 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.244 -0.91 . . . . 0.0 109.958 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.02 -34.68 76.96 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.277 -0.889 . . . . 0.0 109.865 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.451 ' O ' ' HB2' ' A' ' 67' ' ' LEU . 3.3 t80 -72.06 -29.2 63.9 Favored 'General case' 0 C--N 1.298 -1.674 0 O-C-N 121.578 -0.701 . . . . 0.0 109.938 179.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.2 p -65.39 -46.73 78.93 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.355 -0.841 . . . . 0.0 110.115 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 47.5 m -66.36 -43.82 84.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.338 -0.851 . . . . 0.0 109.994 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -64.95 -31.91 73.38 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.341 -0.849 . . . . 0.0 110.154 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.861 HD21 ' HB2' ' B' ' 23' ' ' ALA . 0.5 OUTLIER -63.4 -41.06 98.73 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.215 -0.928 . . . . 0.0 110.248 -179.966 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.424 ' OH ' HG22 ' A' ' 6' ' ' THR . 35.0 m-85 -97.19 -9.1 28.46 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.289 -0.882 . . . . 0.0 110.369 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -155.25 91.67 0.12 Allowed Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -83.6 91.41 7.43 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.335 -1.097 . . . . 0.0 110.3 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.1 p -148.0 -42.94 0.16 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.257 -0.902 . . . . 0.0 110.147 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.91 140.7 29.17 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.211 -0.931 . . . . 0.0 110.2 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.797 HD22 ' C ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 O-C-N 121.157 -0.964 . . . . 0.0 110.458 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.303 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 8.2 mmtt -96.76 -52.64 3.83 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.298 -1.119 . . . . 0.0 110.295 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.423 ' HA ' HG21 ' A' ' 16' ' ' ILE . 3.0 tttt -63.67 -33.51 75.79 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.271 -0.893 . . . . 0.0 110.213 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.53 -42.73 99.71 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.258 -0.901 . . . . 0.0 110.14 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -61.16 -41.03 96.04 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.214 -0.929 . . . . 0.0 110.085 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.51 -45.21 91.72 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.287 -0.883 . . . . 0.0 110.189 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.465 HG13 ' HG ' ' A' ' 33' ' ' LEU . 71.3 t -60.82 -42.47 92.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.297 -0.877 . . . . 0.0 110.207 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.1 -38.71 80.16 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.249 -0.907 . . . . 0.0 110.182 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 65.3 m -66.49 -38.51 87.44 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.27 -0.894 . . . . 0.0 110.075 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.925 ' O ' HG23 ' B' ' 20' ' ' VAL . 74.0 t -69.91 -46.48 73.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.332 -0.855 . . . . 0.0 110.18 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 80.2 t -58.35 -46.55 89.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.278 -0.889 . . . . 0.0 110.093 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.34 -43.68 98.26 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.268 -0.895 . . . . 0.0 110.071 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.02 -45.63 84.71 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.277 -0.89 . . . . 0.0 110.174 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.925 HG23 ' O ' ' B' ' 16' ' ' VAL . 43.2 t -59.21 -45.32 92.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.328 -0.858 . . . . 0.0 110.165 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.902 ' O ' HG23 ' B' ' 25' ' ' VAL . 12.8 t70 -60.52 -32.92 71.93 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.274 -0.891 . . . . 0.0 110.238 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -66.82 -40.82 88.16 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.206 -0.934 . . . . 0.0 110.478 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.861 ' HB2' HD21 ' A' ' 67' ' ' LEU . . . -65.98 -42.65 89.56 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.247 -0.908 . . . . 0.0 110.961 -179.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . 0.571 ' HG3' ' N ' ' B' ' 25' ' ' VAL . 3.0 ptp180 -69.76 -31.3 69.18 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.048 -1.032 . . . . 0.0 110.76 -179.505 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . 0.902 HG23 ' O ' ' B' ' 21' ' ' ASP . 84.7 t -67.37 -25.16 32.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 120.852 -1.155 . . . . 0.0 109.995 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -106.6 18.96 21.19 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.589 -0.694 . . . . 0.0 109.724 179.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -103.59 128.92 26.38 Favored Pre-proline 0 N--CA 1.491 1.592 0 O-C-N 121.433 -0.792 . . . . 0.0 110.161 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -76.77 67.99 7.24 Favored 'Trans proline' 0 C--N 1.304 -1.773 0 O-C-N 124.104 1.581 . . . . 0.0 110.26 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? . . . . . 0 N--CA 1.492 1.633 0 O-C-N 121.258 -0.901 . . . . 0.0 110.112 179.978 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.272 0.558 . . . . 0.0 110.31 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -94.61 177.21 6.0 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.273 -0.892 . . . . 0.0 110.157 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.454 ' O ' ' O ' ' A' ' 4' ' ' THR . 1.8 m-20 -160.38 -38.2 0.05 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.281 -0.887 . . . . 0.0 110.179 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.454 ' O ' ' O ' ' A' ' 3' ' ' ASP . 0.5 OUTLIER 49.06 98.65 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.265 -0.897 . . . . 0.0 110.228 179.983 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.536 ' HB3' ' CB ' ' A' ' 8' ' ' GLU . 0.4 OUTLIER -163.73 144.39 8.75 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.194 -0.941 . . . . 0.0 110.253 -179.892 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.1 m -44.76 -62.85 1.06 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.198 -0.939 . . . . 0.0 110.213 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.82 -44.53 85.34 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.22 -0.925 . . . . 0.0 109.582 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.536 ' CB ' ' HB3' ' A' ' 5' ' ' ASP . 29.1 tp10 -54.56 -35.93 63.81 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.384 -0.822 . . . . 0.0 109.889 179.396 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -60.91 -43.02 99.16 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.376 -0.828 . . . . 0.0 110.26 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.486 HG12 ' HD2' ' A' ' 14' ' ' PHE . 45.0 t -59.98 -49.76 82.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.148 -0.97 . . . . 0.0 109.915 179.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 46.2 mt -55.08 -49.15 74.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.322 -0.861 . . . . 0.0 109.44 179.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.29 -43.26 83.02 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.297 -0.877 . . . . 0.0 109.096 179.123 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.2 m -66.7 -38.92 87.72 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.374 -0.829 . . . . 0.0 109.308 179.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.596 ' HB3' ' CE1' ' A' ' 60' ' ' TYR . 1.2 m-85 -67.83 -40.79 83.71 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.311 -0.868 . . . . 0.0 109.412 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -55.47 -48.9 73.8 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.315 -0.865 . . . . 0.0 109.526 179.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 37.7 mt -57.99 -42.2 82.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.391 -0.818 . . . . 0.0 109.917 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.505 ' CD1' ' HB3' ' A' ' 32' ' ' GLU . 2.7 mm? -65.09 -41.63 94.81 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.337 -0.852 . . . . 0.0 110.074 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.796 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -78.76 0.24 27.65 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.41 -0.806 . . . . 0.0 110.151 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.493 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 68.65 60.43 0.37 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.332 -0.855 . . . . 0.0 110.502 179.801 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.9 t70 59.04 52.34 6.38 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.202 -0.936 . . . . 0.0 110.42 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.5 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 32.8 mmtt -134.64 143.1 45.1 Favored Pre-proline 0 N--CA 1.489 1.503 0 O-C-N 121.198 -0.939 . . . . 0.0 110.07 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_endo -72.49 -1.68 10.62 Favored 'Trans proline' 0 C--N 1.305 -1.722 0 O-C-N 124.032 1.543 . . . . 0.0 109.988 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 46.9 p90 -143.92 164.38 30.73 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.276 -0.89 . . . . 0.0 110.142 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.796 HG12 ' HB2' ' A' ' 18' ' ' ALA . 0.4 OUTLIER -129.08 149.44 33.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.211 -0.931 . . . . 0.0 110.034 -179.816 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.671 ' H ' HD13 ' A' ' 24' ' ' ILE . 0.3 OUTLIER -91.68 143.95 26.02 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.225 -0.922 . . . . 0.0 110.205 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.47 -45.44 84.81 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.29 -0.881 . . . . 0.0 110.268 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -59.42 -36.0 75.05 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.323 -0.861 . . . . 0.0 110.395 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.425 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 4.7 tt0 -65.17 -42.82 93.3 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.298 -0.876 . . . . 0.0 110.166 -179.775 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.58 HD11 HG21 ' A' ' 24' ' ' ILE . 25.3 mt -64.01 -35.7 81.58 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.201 -0.937 . . . . 0.0 109.914 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.4 ttm-85 -67.99 -34.8 77.23 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.417 -0.802 . . . . 0.0 110.104 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 22.7 ttt-85 -90.84 -26.21 19.51 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.346 -0.846 . . . . 0.0 110.661 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.505 ' HB3' ' CD1' ' A' ' 17' ' ' LEU . 3.5 mm-40 -92.33 -23.58 19.21 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.226 -0.921 . . . . 0.0 111.235 -179.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.679 HD22 ' HB3' ' A' ' 37' ' ' GLN . 0.3 OUTLIER -124.26 164.78 27.88 Favored Pre-proline 0 N--CA 1.49 1.563 0 O-C-N 120.899 -1.126 . . . . 0.0 110.526 -179.562 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.662 ' HD2' HD23 ' A' ' 33' ' ' LEU . 34.3 Cg_exo -63.44 145.46 92.37 Favored 'Trans proline' 0 C--N 1.307 -1.652 0 O-C-N 124.072 1.564 . . . . 0.0 110.178 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -43.87 -35.75 7.32 Favored 'Trans proline' 0 C--N 1.302 -1.876 0 O-C-N 124.081 1.569 . . . . 0.0 110.472 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.97 -47.38 74.79 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.089 -1.007 . . . . 0.0 110.725 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.73 ' HG2' HG22 ' B' ' 17' ' ' VAL . 1.4 mp0 -69.81 -42.96 72.99 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.112 -0.993 . . . . 0.0 110.455 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.466 ' O ' ' CG1' ' A' ' 42' ' ' ILE . . . -56.64 -44.13 80.96 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.248 -0.908 . . . . 0.0 110.476 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -63.38 -49.12 75.1 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.185 -0.947 . . . . 0.0 110.321 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -66.44 -47.93 71.59 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.232 -0.918 . . . . 0.0 110.2 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.403 ' SG ' HG21 ' B' ' 20' ' ' VAL . 71.1 m -63.95 -43.6 95.36 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.207 -0.933 . . . . 0.0 110.147 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.466 ' CG1' ' O ' ' A' ' 38' ' ' ALA . 48.6 mt -61.4 -24.01 32.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.246 -0.908 . . . . 0.0 109.998 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.62 -41.94 15.87 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.212 -0.93 . . . . 0.0 110.224 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.593 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 2.4 mmp_? -66.99 -64.3 0.88 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.193 -0.942 . . . . 0.0 110.106 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.623 ' HE1' ' HB3' ' A' ' 60' ' ' TYR . 1.9 ttm -36.04 101.59 0.22 Allowed Pre-proline 0 N--CA 1.494 1.743 0 O-C-N 121.581 -0.699 . . . . 0.0 111.029 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.434 ' HD3' ' O ' ' A' ' 44' ' ' ARG . 12.7 Cg_endo -68.37 -166.01 0.14 Allowed 'Trans proline' 0 C--N 1.305 -1.746 0 O-C-N 124.0 1.526 . . . . 0.0 109.781 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -81.82 136.37 35.39 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.161 -0.962 . . . . 0.0 110.093 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -85.36 -8.24 58.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.245 -0.909 . . . . 0.0 110.258 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 178.35 177.14 0.45 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.258 -0.902 . . . . 0.0 110.212 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -128.18 -61.23 0.12 Allowed Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -83.9 -4.36 10.54 Favored 'Trans proline' 0 C--N 1.305 -1.757 0 O-C-N 124.128 1.594 . . . . 0.0 110.2 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.457 ' O ' ' HB3' ' A' ' 53' ' ' SER . . . -124.47 -155.98 9.3 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.62 ' OG ' ' HB3' ' A' ' 57' ' ' ALA . 9.0 t 56.6 -177.72 0.05 Allowed 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.318 -1.107 . . . . 0.0 110.197 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.634 HG22 ' HB2' ' A' ' 57' ' ' ALA . 17.2 m -108.58 176.4 1.6 Allowed Pre-proline 0 C--N 1.295 -1.781 0 O-C-N 121.667 -0.645 . . . . 0.0 110.154 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_exo -77.01 65.48 7.78 Favored 'Trans proline' 0 C--N 1.305 -1.711 0 O-C-N 123.963 1.507 . . . . 0.0 110.46 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 150.19 41.09 0.03 OUTLIER Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.769 -1.332 . . . . 0.0 109.769 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.634 ' HB2' HG22 ' A' ' 54' ' ' VAL . . . -120.87 120.05 34.42 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.164 -1.197 . . . . 0.0 110.15 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.431 ' HB3' ' HG2' ' A' ' 45' ' ' MET . 58.3 mt -122.11 156.75 32.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.253 -0.904 . . . . 0.0 110.159 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.509 ' OD1' ' HB3' ' A' ' 61' ' ' ALA . 7.3 t70 -103.91 110.98 23.32 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.135 -0.978 . . . . 0.0 110.583 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.623 ' HB3' ' HE1' ' A' ' 45' ' ' MET . 20.5 p90 -71.36 -25.93 62.59 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.208 -0.933 . . . . 0.0 109.09 179.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.581 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.16 -41.48 75.49 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.493 -0.755 . . . . 0.0 109.563 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.471 ' HB2' ' OD2' ' A' ' 59' ' ' ASP . . . -62.1 -37.5 85.3 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.301 -0.875 . . . . 0.0 109.611 179.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.593 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 2.6 t80 -71.87 -38.87 69.96 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.643 -0.661 . . . . 0.0 110.008 179.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.7 p -60.11 -47.13 87.18 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.339 -0.851 . . . . 0.0 110.294 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.427 ' C ' ' HB3' ' A' ' 70' ' ' GLU . 0.2 OUTLIER -65.41 -35.73 81.8 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.328 -0.858 . . . . 0.0 110.227 -179.814 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.01 -32.74 59.54 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.289 -0.882 . . . . 0.0 110.179 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.775 HD21 ' HB2' ' B' ' 23' ' ' ALA . 0.4 OUTLIER -55.16 -38.0 67.72 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.204 -0.935 . . . . 0.0 110.278 179.962 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -95.22 -35.18 11.94 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.197 -0.939 . . . . 0.0 110.357 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 157.01 96.58 0.12 Allowed Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.454 ' CD ' ' N ' ' A' ' 71' ' ' SER . 12.4 tm-20 -174.73 160.13 2.93 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.262 -1.14 . . . . 0.0 110.205 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.454 ' N ' ' CD ' ' A' ' 70' ' ' GLU . 81.5 p -146.47 90.95 1.98 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.223 -0.923 . . . . 0.0 110.242 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -68.41 141.85 55.57 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.221 -0.925 . . . . 0.0 110.16 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.489 ' CD1' ' O ' ' A' ' 73' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 O-C-N 121.381 -0.824 . . . . 0.0 110.201 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.239 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.07 -20.27 63.23 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.275 -1.133 . . . . 0.0 110.261 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.727 ' O ' HG23 ' B' ' 13' ' ' VAL . 7.5 ttmt -68.14 -33.14 73.94 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.246 -0.909 . . . . 0.0 110.188 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.7 96.96 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.255 -0.903 . . . . 0.0 110.072 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -63.5 -40.48 97.18 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.201 -0.937 . . . . 0.0 110.03 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . 0.606 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -66.7 -43.53 84.12 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.285 -0.885 . . . . 0.0 110.032 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.727 HG23 ' O ' ' B' ' 9' ' ' LYS . 59.3 t -63.08 -44.14 99.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.433 -0.792 . . . . 0.0 110.108 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.05 -41.61 92.68 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.268 -0.895 . . . . 0.0 109.921 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 99.9 m -62.6 -42.91 99.85 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.211 -0.931 . . . . 0.0 109.932 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.671 ' O ' HG23 ' B' ' 20' ' ' VAL . 56.7 t -65.17 -45.34 94.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.389 -0.819 . . . . 0.0 109.974 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.73 HG22 ' HG2' ' A' ' 37' ' ' GLN . 76.1 t -60.28 -47.01 94.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.302 -0.874 . . . . 0.0 109.883 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.3 -42.83 82.5 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.288 -0.882 . . . . 0.0 110.04 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.25 -40.63 86.27 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.348 -0.845 . . . . 0.0 109.859 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.671 HG23 ' O ' ' B' ' 16' ' ' VAL . 98.6 t -64.9 -47.28 88.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.308 -0.87 . . . . 0.0 110.113 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 54.2 t0 -64.9 -32.51 74.26 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.262 -0.899 . . . . 0.0 110.087 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.578 ' O ' HG12 ' B' ' 25' ' ' VAL . 2.8 tp-100 -58.21 -48.32 80.71 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.233 -0.917 . . . . 0.0 110.123 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.775 ' HB2' HD21 ' A' ' 67' ' ' LEU . . . -60.92 -38.89 87.36 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.318 -0.864 . . . . 0.0 110.37 -179.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 -68.22 -32.3 72.42 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.169 -0.957 . . . . 0.0 110.318 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . 0.578 HG12 ' O ' ' B' ' 22' ' ' GLN . 0.3 OUTLIER -65.35 -20.55 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.293 -0.88 . . . . 0.0 110.281 -179.834 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 62.9 mtp85 -83.82 28.06 0.61 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.417 -0.802 . . . . 0.0 110.788 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.57 138.94 20.38 Favored Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 120.989 -1.069 . . . . 0.0 110.226 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -63.87 92.34 0.17 Allowed 'Trans proline' 0 C--N 1.306 -1.7 0 O-C-N 123.943 1.496 . . . . 0.0 110.369 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.657 0 O-C-N 121.262 -0.899 . . . . 0.0 110.212 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 mtp . . . . . 0 N--CA 1.491 1.625 0 CA-C-O 121.225 0.535 . . . . 0.0 110.204 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -123.04 46.77 2.1 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.249 -0.907 . . . . 0.0 110.207 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.487 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 20.1 p-10 -152.62 98.6 2.38 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.223 -0.923 . . . . 0.0 110.197 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 10.2 t -166.96 -170.13 1.47 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.203 -0.936 . . . . 0.0 110.301 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 48.32 -172.18 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.248 -0.907 . . . . 0.0 110.224 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.2 p -113.69 -53.56 2.68 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.239 -0.913 . . . . 0.0 110.17 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.73 -48.83 73.16 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.208 -0.932 . . . . 0.0 109.874 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.689 ' HA ' HD12 ' A' ' 11' ' ' ILE . 0.9 OUTLIER -54.75 -36.16 64.52 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.402 -0.811 . . . . 0.0 110.055 179.643 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -61.19 -43.98 98.02 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.272 -0.892 . . . . 0.0 110.226 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.541 HG12 ' HD2' ' A' ' 14' ' ' PHE . 73.2 t -58.07 -45.64 88.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.14 -0.975 . . . . 0.0 109.686 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.689 HD12 ' HA ' ' A' ' 8' ' ' GLU . 36.8 mt -58.05 -47.2 87.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.404 -0.81 . . . . 0.0 109.335 179.389 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.56 -44.01 84.92 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.324 -0.86 . . . . 0.0 108.907 179.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.515 ' HA ' ' HB1' ' B' ' 12' ' ' ALA . 46.5 m -65.23 -40.13 93.66 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.373 -0.829 . . . . 0.0 108.976 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.541 ' HD2' HG12 ' A' ' 10' ' ' VAL . 3.1 m-85 -68.53 -41.34 80.05 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.432 -0.793 . . . . 0.0 109.509 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.0 ttt180 -53.5 -45.37 69.64 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.39 -0.819 . . . . 0.0 109.547 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.489 HD12 ' HB2' ' B' ' 12' ' ' ALA . 56.0 mt -61.53 -42.98 96.07 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 O-C-N 121.285 -0.884 . . . . 0.0 109.784 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.418 HD11 HG22 ' B' ' 13' ' ' VAL . 2.7 mp -63.68 -40.47 96.9 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.34 -0.85 . . . . 0.0 109.9 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.433 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -79.53 4.72 14.93 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.377 -0.827 . . . . 0.0 110.218 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.433 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.4 OUTLIER 65.21 58.91 0.85 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.219 -0.926 . . . . 0.0 110.243 -179.986 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 54.51 63.99 1.97 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.263 -0.898 . . . . 0.0 110.345 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.1 mttp -144.86 143.12 19.87 Favored Pre-proline 0 N--CA 1.49 1.542 0 O-C-N 121.266 -0.896 . . . . 0.0 110.007 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -69.89 -4.41 14.05 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 O-C-N 124.037 1.546 . . . . 0.0 110.082 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 50.1 p90 -138.66 165.39 27.04 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.276 -0.89 . . . . 0.0 109.873 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.621 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -139.86 138.53 38.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.165 -0.959 . . . . 0.0 110.277 -179.773 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.646 HD23 ' HB2' ' A' ' 27' ' ' GLU . 5.4 tp -80.3 147.98 30.92 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.281 -0.887 . . . . 0.0 109.911 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.648 ' HB1' ' CD1' ' A' ' 42' ' ' ILE . . . -62.05 -26.85 68.5 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.233 -0.917 . . . . 0.0 110.143 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.646 ' HB2' HD23 ' A' ' 25' ' ' LEU . 4.9 mp0 -70.56 -36.21 73.51 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.334 -0.854 . . . . 0.0 110.318 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.503 ' HB2' HD11 ' A' ' 24' ' ' ILE . 10.6 mt-10 -67.91 -50.18 57.66 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.232 -0.917 . . . . 0.0 110.254 -179.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.745 HD12 ' C ' ' A' ' 29' ' ' LEU . 1.2 pp -66.54 -33.81 76.5 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.196 -0.94 . . . . 0.0 109.703 179.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.572 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -62.37 -35.73 80.05 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.36 -0.838 . . . . 0.0 109.977 179.908 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.82 -8.53 30.82 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.416 -0.802 . . . . 0.0 110.472 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -98.38 -23.27 15.67 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.1 -1.0 . . . . 0.0 110.673 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.729 HD11 HG11 ' B' ' 16' ' ' VAL . 2.9 mt -120.07 155.77 55.27 Favored Pre-proline 0 N--CA 1.488 1.453 0 O-C-N 121.159 -0.963 . . . . 0.0 110.464 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.492 ' HD2' HD23 ' A' ' 33' ' ' LEU . 51.4 Cg_exo -54.92 144.06 69.22 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 O-C-N 124.022 1.538 . . . . 0.0 110.271 179.702 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.409 ' C ' ' O ' ' A' ' 34' ' ' PRO . 26.5 Cg_endo -39.81 -42.41 3.04 Favored 'Trans proline' 0 C--N 1.304 -1.788 0 O-C-N 124.104 1.581 . . . . 0.0 110.59 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.07 -46.88 76.15 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.293 -0.88 . . . . 0.0 111.102 -179.433 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.827 ' NE2' HG13 ' B' ' 17' ' ' VAL . 33.3 mm-40 -69.53 -41.42 76.01 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.021 -1.05 . . . . 0.0 110.741 -179.291 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.572 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -56.08 -42.01 76.02 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.165 -0.96 . . . . 0.0 110.678 -179.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -60.11 -47.9 83.97 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.11 -0.994 . . . . 0.0 110.743 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -58.56 -44.23 89.65 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.189 -0.945 . . . . 0.0 110.559 -179.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 72.0 m -65.26 -42.54 93.14 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.173 -0.954 . . . . 0.0 110.358 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.648 ' CD1' ' HB1' ' A' ' 26' ' ' ALA . 1.1 mm -67.67 -21.64 27.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 O-C-N 121.259 -0.901 . . . . 0.0 110.474 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.81 -30.28 28.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.272 -0.892 . . . . 0.0 111.068 -179.303 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.553 ' HG2' ' CE1' ' A' ' 63' ' ' PHE . 1.1 mpt_? -94.32 -64.14 1.11 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.982 -1.074 . . . . 0.0 111.082 -179.229 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.562 ' CE ' ' HB3' ' A' ' 60' ' ' TYR . 5.5 ttm -30.0 112.15 0.29 Allowed Pre-proline 0 N--CA 1.497 1.886 0 O-C-N 121.796 -0.565 . . . . 0.0 111.305 -179.615 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.484 ' O ' HD23 ' A' ' 58' ' ' LEU . 18.9 Cg_endo -81.77 -158.17 0.09 OUTLIER 'Trans proline' 0 C--N 1.308 -1.595 0 O-C-N 124.232 1.648 . . . . 0.0 110.395 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -79.23 143.04 35.71 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.174 -0.954 . . . . 0.0 110.314 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.613 ' CE2' ' HB2' ' A' ' 53' ' ' SER . 0.6 OUTLIER -58.77 -32.49 69.33 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.247 -0.908 . . . . 0.0 110.163 179.992 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 176.45 -49.5 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.155 -0.966 . . . . 0.0 110.189 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.429 ' HA3' ' HD3' ' A' ' 51' ' ' PRO . . . 152.29 -109.28 0.41 Allowed Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.357 -1.497 . . . . 0.0 109.357 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.429 ' HD3' ' HA3' ' A' ' 50' ' ' GLY . 6.4 Cg_exo -67.7 -14.5 42.04 Favored 'Trans proline' 0 C--N 1.307 -1.637 0 O-C-N 123.906 1.477 . . . . 0.0 109.958 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.428 ' O ' ' C ' ' A' ' 53' ' ' SER . . . -64.23 168.29 25.62 Favored Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.613 ' HB2' ' CE2' ' A' ' 48' ' ' TYR . 9.1 t 40.68 -142.52 0.06 Allowed 'General case' 0 C--N 1.306 -1.316 0 O-C-N 121.448 -1.03 . . . . 0.0 110.301 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 21.5 m -124.73 179.49 1.09 Allowed Pre-proline 0 C--N 1.294 -1.816 0 O-C-N 121.741 -0.6 . . . . 0.0 110.12 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -71.31 108.68 2.41 Favored 'Trans proline' 0 C--N 1.305 -1.747 0 O-C-N 123.915 1.482 . . . . 0.0 110.362 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 131.39 -20.68 4.65 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.444 -1.462 . . . . 0.0 109.444 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.34 126.06 26.2 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.243 -1.151 . . . . 0.0 110.251 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.484 HD23 ' O ' ' A' ' 46' ' ' PRO . 1.4 mt -124.17 160.33 28.1 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.322 -0.861 . . . . 0.0 110.054 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.472 ' C ' ' HG3' ' A' ' 45' ' ' MET . 2.1 m-20 -113.91 112.03 22.68 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.144 -0.973 . . . . 0.0 110.694 -179.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.562 ' HB3' ' CE ' ' A' ' 45' ' ' MET . 14.2 p90 -73.67 -21.16 60.35 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.402 -0.811 . . . . 0.0 109.784 179.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.533 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.64 -36.73 67.34 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.36 -0.838 . . . . 0.0 109.466 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.45 -36.37 78.91 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.352 -0.842 . . . . 0.0 109.424 179.271 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.553 ' CE1' ' HG2' ' A' ' 44' ' ' ARG . 6.5 t80 -71.83 -35.42 69.9 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.787 -0.571 . . . . 0.0 110.06 179.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 32.1 t -58.35 -47.51 83.54 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.249 -0.907 . . . . 0.0 109.974 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 11.2 m -62.62 -36.9 84.26 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.197 -0.939 . . . . 0.0 109.901 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.487 ' HA ' ' O ' ' A' ' 69' ' ' GLY . . . -60.63 -37.84 82.78 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.261 -0.899 . . . . 0.0 109.959 179.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.96 -42.7 90.52 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.27 -0.894 . . . . 0.0 110.123 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -98.61 4.98 48.11 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.204 -0.935 . . . . 0.0 110.27 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.487 ' O ' ' HA ' ' A' ' 66' ' ' ALA . . . -174.43 98.81 0.13 Allowed Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -111.94 106.44 15.14 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.26 -1.141 . . . . 0.0 110.282 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 43.7 t -121.45 166.56 13.95 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.298 -0.876 . . . . 0.0 109.994 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -105.26 140.23 38.72 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.242 -0.912 . . . . 0.0 110.238 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.2 pp . . . . . 0 N--CA 1.491 1.62 0 O-C-N 121.247 -0.908 . . . . 0.0 110.211 179.979 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.279 0 N-CA-C 109.569 -1.413 . . . . 0.0 109.569 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 31.7 mttp -89.45 -37.41 14.81 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.232 -1.158 . . . . 0.0 110.131 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.463 ' O ' HG23 ' B' ' 13' ' ' VAL . 5.4 ttpt -57.95 -49.48 76.64 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.245 -0.909 . . . . 0.0 110.121 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.88 -38.27 78.44 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.322 -0.861 . . . . 0.0 110.116 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -64.85 -40.71 95.59 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.25 -0.906 . . . . 0.0 110.102 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . 0.515 ' HB1' ' HA ' ' A' ' 13' ' ' SER . . . -66.43 -41.9 88.48 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.251 -0.906 . . . . 0.0 110.136 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.463 HG23 ' O ' ' B' ' 9' ' ' LYS . 93.2 t -61.4 -42.18 92.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.204 -0.935 . . . . 0.0 110.135 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.75 -40.87 96.65 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.262 -0.899 . . . . 0.0 110.172 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 14.6 m -62.79 -48.91 77.1 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.272 -0.892 . . . . 0.0 110.082 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.729 HG11 HD11 ' A' ' 33' ' ' LEU . 80.4 t -60.38 -47.23 93.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.25 -0.906 . . . . 0.0 110.084 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.827 HG13 ' NE2' ' A' ' 37' ' ' GLN . 58.2 t -60.58 -48.26 89.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.25 -0.906 . . . . 0.0 110.119 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.2 -44.09 92.25 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.224 -0.922 . . . . 0.0 109.943 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.23 -44.87 78.42 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.361 -0.837 . . . . 0.0 109.934 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.597 HG23 ' O ' ' B' ' 16' ' ' VAL . 99.5 t -67.26 -43.58 88.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.248 -0.907 . . . . 0.0 110.107 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.446 ' O ' HG23 ' B' ' 25' ' ' VAL . 17.2 t70 -57.57 -35.8 70.84 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.282 -0.886 . . . . 0.0 110.116 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -55.03 -45.17 75.17 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.295 -0.878 . . . . 0.0 110.106 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.86 -37.32 85.85 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.347 -0.845 . . . . 0.0 110.192 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -61.12 -41.98 97.7 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.281 -0.887 . . . . 0.0 110.108 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . 0.446 HG23 ' O ' ' B' ' 21' ' ' ASP . 72.4 t -56.49 -21.34 12.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.265 -0.897 . . . . 0.0 110.078 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -113.71 30.03 7.55 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.475 -0.765 . . . . 0.0 110.094 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . 0.445 ' HA ' ' HD3' ' B' ' 28' ' ' PRO . 24.5 pt-20 -73.13 148.75 89.1 Favored Pre-proline 0 N--CA 1.49 1.567 0 O-C-N 121.287 -0.883 . . . . 0.0 110.145 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' B' ' 27' ' ' GLU . 24.2 Cg_exo -62.23 -18.88 64.71 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 O-C-N 123.979 1.515 . . . . 0.0 110.074 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 3.1 mmt85 . . . . . 0 N--CA 1.491 1.583 0 O-C-N 121.314 -0.866 . . . . 0.0 110.161 179.991 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.4 ptp . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.221 0.534 . . . . 0.0 110.218 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -140.41 23.14 2.35 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.174 -0.954 . . . . 0.0 110.258 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -128.23 -31.9 2.29 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.243 -0.911 . . . . 0.0 110.185 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 50.89 68.18 0.82 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.276 -0.89 . . . . 0.0 110.182 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.5 ' O ' ' N ' ' A' ' 7' ' ' ALA . 62.8 m-20 -93.52 -9.97 36.47 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.335 -0.853 . . . . 0.0 110.19 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.446 ' CB ' ' O ' ' A' ' 5' ' ' ASP . 1.3 m 67.21 -57.61 0.43 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.225 -0.922 . . . . 0.0 110.264 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.5 ' N ' ' O ' ' A' ' 5' ' ' ASP . . . -60.99 -46.89 88.91 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.271 -0.893 . . . . 0.0 109.843 179.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.846 ' HA ' HD12 ' A' ' 11' ' ' ILE . 1.8 tt0 -54.28 -36.56 63.77 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.308 -0.87 . . . . 0.0 109.536 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 10.5 tp60 -62.44 -46.34 88.97 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.328 -0.858 . . . . 0.0 109.949 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.58 HG12 ' CD2' ' A' ' 14' ' ' PHE . 38.4 t -58.7 -41.48 82.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.342 -0.849 . . . . 0.0 109.963 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.846 HD12 ' HA ' ' A' ' 8' ' ' GLU . 51.0 mt -57.92 -49.58 80.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.328 -0.858 . . . . 0.0 109.427 179.531 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.91 -38.33 75.66 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 119.573 -0.851 . . . . 0.0 108.873 178.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.1 m -68.0 -40.55 83.0 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.486 -0.759 . . . . 0.0 109.294 179.048 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.58 ' CD2' HG12 ' A' ' 10' ' ' VAL . 4.1 m-85 -68.23 -41.35 81.36 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.303 -0.873 . . . . 0.0 109.649 179.467 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -54.43 -44.82 72.77 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.284 -0.885 . . . . 0.0 109.452 179.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.415 HG21 ' HA ' ' B' ' 9' ' ' LYS . 46.4 mt -62.22 -40.97 89.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.343 -0.848 . . . . 0.0 109.83 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.407 HD13 ' HA ' ' A' ' 17' ' ' LEU . 2.9 mm? -64.74 -41.69 95.74 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.218 -0.926 . . . . 0.0 109.829 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.7 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -81.76 4.24 22.77 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.323 -0.86 . . . . 0.0 110.201 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.456 ' HB3' ' O ' ' A' ' 18' ' ' ALA . 4.9 t 65.09 64.45 0.63 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.199 -0.938 . . . . 0.0 110.278 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 54.94 60.12 3.66 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.267 -0.896 . . . . 0.0 110.368 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.573 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 18.1 mttm -141.66 142.95 27.44 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.3 -0.875 . . . . 0.0 110.01 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -76.07 2.69 6.86 Favored 'Trans proline' 0 C--N 1.304 -1.803 0 O-C-N 124.147 1.604 . . . . 0.0 110.178 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.573 ' CZ ' ' HD3' ' A' ' 21' ' ' LYS . 32.9 p90 -143.7 155.08 44.09 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.307 -0.871 . . . . 0.0 110.107 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.832 HD12 HD23 ' A' ' 29' ' ' LEU . 0.4 OUTLIER -129.18 147.88 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.268 -0.895 . . . . 0.0 110.016 -179.871 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.765 ' H ' HD13 ' A' ' 24' ' ' ILE . 8.0 mp -92.14 146.37 23.78 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.134 -0.979 . . . . 0.0 110.431 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.14 -43.02 99.53 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.345 -0.847 . . . . 0.0 110.304 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -56.28 -39.6 72.92 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.252 -0.905 . . . . 0.0 109.834 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.45 ' HG3' ' OE1' ' A' ' 32' ' ' GLU . 0.7 OUTLIER -63.66 -45.44 90.17 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.427 -0.796 . . . . 0.0 109.523 179.724 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.832 HD23 HD12 ' A' ' 24' ' ' ILE . 3.1 mm? -58.32 -34.29 70.43 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.392 -0.818 . . . . 0.0 109.72 179.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 28.1 mtp180 -69.1 -34.78 75.64 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.354 -0.842 . . . . 0.0 110.652 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 10.1 ttt180 -93.88 -25.57 17.26 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.127 -0.983 . . . . 0.0 111.085 -179.176 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.45 ' OE1' ' HG3' ' A' ' 28' ' ' GLU . 2.7 mp0 -90.91 -23.34 20.52 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.0 -1.063 . . . . 0.0 111.197 -179.162 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.783 HD23 ' HD2' ' A' ' 34' ' ' PRO . 0.3 OUTLIER -128.61 160.86 60.59 Favored Pre-proline 0 N--CA 1.489 1.492 0 O-C-N 120.94 -1.1 . . . . 0.0 110.559 -179.606 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.783 ' HD2' HD23 ' A' ' 33' ' ' LEU . 28.0 Cg_exo -58.77 144.12 98.49 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 O-C-N 124.035 1.545 . . . . 0.0 110.241 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -46.64 -30.6 9.12 Favored 'Trans proline' 0 C--N 1.304 -1.78 0 O-C-N 124.093 1.575 . . . . 0.0 110.43 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -65.75 -47.37 75.48 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.22 -0.925 . . . . 0.0 110.556 -179.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.621 ' HG2' HG22 ' B' ' 17' ' ' VAL . 2.0 mp0 -69.66 -38.32 77.05 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.197 -0.94 . . . . 0.0 110.254 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.22 -44.03 79.16 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.319 -0.863 . . . . 0.0 110.293 -179.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -64.88 -45.09 87.46 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.254 -0.904 . . . . 0.0 110.317 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -65.6 -47.21 76.48 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.166 -0.959 . . . . 0.0 110.39 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 62.8 m -65.36 -42.74 92.46 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.242 -0.911 . . . . 0.0 110.502 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 68.6 mt -71.68 -16.26 18.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.238 -0.914 . . . . 0.0 110.535 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.9 tptt -84.64 -17.55 38.25 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.221 -0.924 . . . . 0.0 110.263 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.609 ' HB2' ' CD2' ' A' ' 63' ' ' PHE . 4.9 mtt85 -105.13 -66.54 0.97 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.321 -0.862 . . . . 0.0 110.563 -179.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.536 ' HE2' ' HA ' ' A' ' 60' ' ' TYR . 3.1 ttm -26.35 108.98 0.2 Allowed Pre-proline 0 N--CA 1.499 1.985 0 O-C-N 121.877 -0.515 . . . . 0.0 111.495 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.484 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 10.8 Cg_endo -79.29 -167.74 0.54 Allowed 'Trans proline' 0 C--N 1.307 -1.646 0 O-C-N 123.971 1.511 . . . . 0.0 110.227 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.439 ' O ' ' C ' ' A' ' 48' ' ' TYR . . . -86.6 121.82 29.66 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.247 -0.908 . . . . 0.0 110.477 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.626 ' CD1' ' O ' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -41.32 136.87 1.57 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.279 -0.888 . . . . 0.0 110.561 179.683 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.8 m -81.32 -99.24 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.933 -1.104 . . . . 0.0 110.22 -179.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.633 ' N ' ' CD ' ' A' ' 51' ' ' PRO . . . -125.58 38.92 2.16 Favored Glycine 0 N--CA 1.488 2.149 0 C-N-CA 119.559 -1.305 . . . . 0.0 110.635 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.633 ' CD ' ' N ' ' A' ' 50' ' ' GLY . 68.2 Cg_endo -90.13 20.31 1.05 Allowed 'Trans proline' 0 C--N 1.313 -1.292 0 O-C-N 123.407 1.214 . . . . 0.0 109.769 179.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.418 ' O ' ' O ' ' A' ' 53' ' ' SER . . . 92.05 -119.34 5.75 Favored Glycine 0 N--CA 1.489 2.189 0 N-CA-C 109.145 -1.582 . . . . 0.0 109.145 -179.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.559 ' OG ' ' CD2' ' A' ' 48' ' ' TYR . 0.3 OUTLIER 47.14 -172.92 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.156 -1.203 . . . . 0.0 110.352 179.9 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.545 ' N ' ' OG ' ' A' ' 53' ' ' SER . 13.0 m -136.2 168.85 15.33 Favored Pre-proline 0 C--N 1.292 -1.9 0 C-N-CA 120.444 -0.503 . . . . 0.0 110.375 -179.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.475 ' HD2' ' HB ' ' A' ' 54' ' ' VAL . 9.2 Cg_endo -56.09 136.65 76.08 Favored 'Trans proline' 0 C--N 1.306 -1.668 0 O-C-N 124.075 1.566 . . . . 0.0 110.207 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 104.7 -17.4 46.04 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.359 -1.497 . . . . 0.0 109.359 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.435 ' HB1' ' HB2' ' A' ' 23' ' ' TYR . . . -92.29 120.69 33.08 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.292 -1.123 . . . . 0.0 110.12 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.805 HD22 ' N ' ' A' ' 58' ' ' LEU . 3.0 mm? -92.89 160.54 14.86 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.289 -0.882 . . . . 0.0 109.965 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.533 ' N ' ' HG2' ' A' ' 45' ' ' MET . 0.7 OUTLIER -105.89 110.16 22.36 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.09 -1.006 . . . . 0.0 110.741 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.554 ' CD1' ' CB ' ' A' ' 14' ' ' PHE . 28.6 p90 -77.49 -19.26 56.16 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.93 -42.59 76.36 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.126 -0.984 . . . . 0.0 108.474 178.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.484 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -61.92 -31.96 72.32 Favored 'General case' 0 N--CA 1.488 1.444 0 CA-C-O 121.931 0.872 . . . . 0.0 108.961 178.451 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.891 ' CE1' HD12 ' A' ' 67' ' ' LEU . 25.7 t80 -60.59 -41.98 95.8 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.792 -0.567 . . . . 0.0 110.412 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.404 ' OG ' ' N ' ' A' ' 65' ' ' SER . 6.2 p -63.1 -50.68 69.56 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.147 -0.971 . . . . 0.0 110.456 -179.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.404 ' N ' ' OG ' ' A' ' 64' ' ' SER . 16.0 m -69.54 -35.68 75.67 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.145 -0.972 . . . . 0.0 110.43 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.36 -39.56 81.77 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.35 -0.844 . . . . 0.0 110.872 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.891 HD12 ' CE1' ' A' ' 63' ' ' PHE . 1.3 mt -75.09 -44.06 49.49 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.079 -1.013 . . . . 0.0 110.485 -179.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -96.22 14.06 25.36 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.2 -0.938 . . . . 0.0 110.397 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.408 ' O ' ' C ' ' A' ' 70' ' ' GLU . . . -87.54 -97.35 0.9 Allowed Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 179.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.408 ' C ' ' O ' ' A' ' 69' ' ' GLY . 2.0 tt0 42.18 38.65 1.17 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.388 -1.066 . . . . 0.0 110.439 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.2 m -90.23 107.67 19.28 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.295 -0.878 . . . . 0.0 110.06 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -69.4 135.62 50.54 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.308 -0.87 . . . . 0.0 110.274 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.69 ' C ' HD12 ' A' ' 73' ' ' LEU . 1.1 pp . . . . . 0 N--CA 1.491 1.624 0 O-C-N 121.269 -0.894 . . . . 0.0 110.309 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.252 0 N-CA-C 109.499 -1.441 . . . . 0.0 109.499 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.89 -34.77 5.0 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.231 -1.158 . . . . 0.0 110.095 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.415 ' HA ' HG21 ' A' ' 16' ' ' ILE . 0.1 OUTLIER -66.06 -40.14 90.67 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.256 -0.903 . . . . 0.0 110.194 179.839 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.43 -43.98 79.96 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.323 -0.861 . . . . 0.0 110.113 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -60.33 -40.85 92.11 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.285 -0.884 . . . . 0.0 110.093 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.86 -45.23 82.93 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.303 -0.873 . . . . 0.0 110.14 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.857 ' O ' HG23 ' B' ' 17' ' ' VAL . 76.5 t -57.77 -42.44 81.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.292 -0.88 . . . . 0.0 110.121 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.97 -40.13 96.78 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.246 -0.909 . . . . 0.0 110.132 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 42.8 m -63.87 -43.74 95.18 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.227 -0.921 . . . . 0.0 110.16 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.574 ' O ' HG23 ' B' ' 20' ' ' VAL . 66.2 t -65.97 -43.61 92.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.263 -0.898 . . . . 0.0 110.096 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.857 HG23 ' O ' ' B' ' 13' ' ' VAL . 31.9 t -63.77 -45.83 96.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.294 -0.879 . . . . 0.0 110.111 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.13 -37.07 83.74 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.258 -0.901 . . . . 0.0 110.041 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.99 -42.68 89.5 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.301 -0.874 . . . . 0.0 110.178 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.574 HG23 ' O ' ' B' ' 16' ' ' VAL . 69.3 t -65.42 -40.73 89.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.252 -0.905 . . . . 0.0 110.141 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.474 ' O ' HG23 ' B' ' 25' ' ' VAL . 0.3 OUTLIER -64.75 -35.98 82.81 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.379 -0.825 . . . . 0.0 110.089 179.984 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.2 -43.62 95.78 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.402 -0.811 . . . . 0.0 110.186 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.92 -35.25 80.56 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.23 -0.919 . . . . 0.0 110.474 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 5.4 ttt180 -68.32 -46.44 70.22 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.124 -0.985 . . . . 0.0 110.359 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . 0.474 HG23 ' O ' ' B' ' 21' ' ' ASP . 60.7 t -60.91 -21.79 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.209 -0.932 . . . . 0.0 110.282 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 2.1 tpt85 52.14 58.57 5.29 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.405 -0.809 . . . . 0.0 110.25 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -101.33 131.12 23.5 Favored Pre-proline 0 N--CA 1.493 1.707 0 O-C-N 121.285 -0.885 . . . . 0.0 110.273 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -61.99 -157.08 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.733 0 O-C-N 123.988 1.52 . . . . 0.0 110.227 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 5.2 ptt-85 . . . . . 0 N--CA 1.492 1.64 0 O-C-N 121.231 -0.918 . . . . 0.0 110.29 179.935 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.5 mtp . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 121.327 0.584 . . . . 0.0 110.241 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -138.39 70.25 1.38 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.205 -0.934 . . . . 0.0 110.265 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 51.4 -153.54 0.18 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.213 -0.929 . . . . 0.0 110.172 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -120.33 178.73 4.54 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.235 -0.916 . . . . 0.0 110.184 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.507 ' O ' ' N ' ' A' ' 7' ' ' ALA . 1.3 t0 -155.99 48.63 0.5 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.186 -0.946 . . . . 0.0 110.336 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.835 HG22 ' OH ' ' A' ' 68' ' ' TYR . 1.7 m 65.09 -66.6 0.14 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.264 -0.897 . . . . 0.0 110.23 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.507 ' N ' ' O ' ' A' ' 5' ' ' ASP . . . -63.85 -47.56 80.24 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.226 -0.921 . . . . 0.0 109.814 179.726 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -54.45 -36.05 63.67 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.31 -0.869 . . . . 0.0 109.797 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -61.66 -37.6 84.63 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.346 -0.847 . . . . 0.0 110.285 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.497 HG12 ' CD2' ' A' ' 14' ' ' PHE . 17.0 t -58.15 -50.55 77.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.172 -0.955 . . . . 0.0 109.646 179.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 23.4 mt -55.01 -49.95 67.13 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 121.276 -0.89 . . . . 0.0 109.153 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.07 -39.31 78.22 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.352 -0.843 . . . . 0.0 108.739 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.46 ' HA ' ' HB1' ' B' ' 12' ' ' ALA . 72.5 m -66.84 -41.11 87.95 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.46 -0.775 . . . . 0.0 109.087 179.023 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.585 ' HB3' ' CE2' ' A' ' 60' ' ' TYR . 5.1 m-85 -67.24 -41.42 85.67 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.368 -0.832 . . . . 0.0 109.322 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.7 ttt-85 -54.52 -44.62 72.91 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.427 -0.796 . . . . 0.0 109.632 179.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.631 HD12 ' HB2' ' B' ' 12' ' ' ALA . 44.3 mt -60.93 -44.65 98.41 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.368 -0.832 . . . . 0.0 109.953 179.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.492 HD21 HG23 ' B' ' 13' ' ' VAL . 3.2 mm? -64.41 -39.78 94.5 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.224 -0.923 . . . . 0.0 109.84 179.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.504 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -77.09 -4.26 43.47 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.306 -0.871 . . . . 0.0 110.044 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.463 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 66.93 63.34 0.47 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.266 -0.896 . . . . 0.0 110.359 179.895 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 55.59 62.16 2.55 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.276 -0.89 . . . . 0.0 110.432 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.504 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 19.3 mttt -144.73 143.89 22.72 Favored Pre-proline 0 N--CA 1.49 1.563 0 O-C-N 121.329 -0.857 . . . . 0.0 109.887 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -73.72 -0.25 9.13 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 O-C-N 123.938 1.494 . . . . 0.0 110.094 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 13.6 p90 -146.38 155.66 42.76 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.286 -0.884 . . . . 0.0 110.283 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.656 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -124.18 142.22 41.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.427 -0.795 . . . . 0.0 109.754 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.656 ' N ' HD13 ' A' ' 24' ' ' ILE . 3.8 mp -80.23 136.54 36.48 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.136 -0.977 . . . . 0.0 110.003 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.32 -41.02 96.33 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.268 -0.895 . . . . 0.0 109.912 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.15 -42.77 77.49 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.38 -0.825 . . . . 0.0 109.541 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.449 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 64.0 tt0 -69.41 -42.39 75.13 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.501 -0.749 . . . . 0.0 109.648 179.541 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.663 HD21 ' CB ' ' A' ' 41' ' ' CYS . 1.2 tp -62.56 -41.4 98.89 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.412 -0.805 . . . . 0.0 108.92 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.936 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -62.43 -33.65 75.22 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.652 -0.655 . . . . 0.0 110.257 179.619 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.3 ttm180 -96.72 -24.8 15.79 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.355 -0.841 . . . . 0.0 111.504 -179.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.449 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 7.7 mm-40 -80.06 -21.55 43.3 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.815 -1.178 . . . . 0.0 111.073 -179.088 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.535 HD23 ' HD3' ' A' ' 34' ' ' PRO . 7.3 mt -116.72 169.65 6.96 Favored Pre-proline 0 C--N 1.303 -1.426 0 O-C-N 120.939 -1.101 . . . . 0.0 111.164 -179.076 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.558 ' CB ' ' HD2' ' A' ' 35' ' ' PRO . 35.3 Cg_exo -58.41 -149.39 0.01 OUTLIER 'Trans proline' 0 C--N 1.307 -1.62 0 O-C-N 124.225 1.645 . . . . 0.0 109.984 179.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.558 ' HD2' ' CB ' ' A' ' 34' ' ' PRO . 10.8 Cg_endo -96.24 -44.19 0.02 OUTLIER 'Trans proline' 0 C--N 1.308 -1.603 0 O-C-N 123.647 1.34 . . . . 0.0 110.451 179.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.2 -41.17 90.57 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.309 -0.869 . . . . 0.0 111.096 -179.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.774 ' HG2' HG22 ' B' ' 17' ' ' VAL . 10.7 mp0 -69.68 -44.82 69.67 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.061 -1.024 . . . . 0.0 111.011 -179.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.936 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -62.58 -46.76 86.85 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.306 -0.871 . . . . 0.0 110.769 -179.391 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 15.0 tm0? -65.86 -43.99 86.79 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.177 -0.952 . . . . 0.0 111.067 -179.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -65.51 -42.39 92.1 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.065 -1.022 . . . . 0.0 110.631 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.663 ' CB ' HD21 ' A' ' 29' ' ' LEU . 34.9 m -58.08 -50.51 73.2 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.189 -0.944 . . . . 0.0 110.548 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.438 HD12 ' O ' ' A' ' 38' ' ' ALA . 0.5 OUTLIER -58.4 -22.36 19.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.107 -0.995 . . . . 0.0 110.131 -179.924 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -82.15 -15.41 53.43 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.136 -0.978 . . . . 0.0 110.609 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.55 ' HG3' ' CE1' ' A' ' 63' ' ' PHE . 0.8 OUTLIER -113.68 -60.03 1.94 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.033 -1.042 . . . . 0.0 110.682 -179.818 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.564 ' CE ' ' HB3' ' A' ' 60' ' ' TYR . 3.0 ttm -35.3 100.37 0.19 Allowed Pre-proline 0 N--CA 1.495 1.804 0 O-C-N 121.547 -0.72 . . . . 0.0 111.085 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.504 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 18.7 Cg_exo -71.59 -168.09 0.33 Allowed 'Trans proline' 0 C--N 1.305 -1.757 0 O-C-N 124.099 1.578 . . . . 0.0 110.073 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.21 146.49 43.3 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.249 -0.907 . . . . 0.0 110.127 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.576 ' CE2' ' CB ' ' A' ' 53' ' ' SER . 0.1 OUTLIER -53.56 -177.54 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.223 -0.923 . . . . 0.0 110.429 -179.917 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -162.29 77.65 0.49 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.246 -0.909 . . . . 0.0 110.102 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -172.79 158.09 27.84 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -70.04 114.43 3.75 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 124.009 1.531 . . . . 0.0 110.368 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.508 ' O ' ' HB2' ' A' ' 53' ' ' SER . . . 101.58 133.21 8.01 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.673 -1.371 . . . . 0.0 109.673 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.576 ' CB ' ' CE2' ' A' ' 48' ' ' TYR . 45.2 t 178.23 -152.1 0.02 OUTLIER 'General case' 0 C--N 1.307 -1.251 0 O-C-N 121.454 -1.027 . . . . 0.0 110.054 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.451 ' HB ' ' HD2' ' A' ' 55' ' ' PRO . 33.5 m -146.57 171.65 6.15 Favored Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.232 -0.917 . . . . 0.0 110.208 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.451 ' HD2' ' HB ' ' A' ' 54' ' ' VAL . 19.7 Cg_endo -72.86 74.31 2.88 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 O-C-N 123.945 1.498 . . . . 0.0 110.207 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 141.64 44.23 0.06 OUTLIER Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.359 -1.496 . . . . 0.0 109.359 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.667 ' C ' HD22 ' A' ' 58' ' ' LEU . . . -106.36 112.72 25.86 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.183 -1.186 . . . . 0.0 110.361 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.786 HD22 ' N ' ' A' ' 58' ' ' LEU . 3.3 mm? -105.94 160.29 15.38 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.25 -0.907 . . . . 0.0 109.511 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.483 ' C ' ' HG3' ' A' ' 45' ' ' MET . 1.7 m-20 -113.71 111.02 21.12 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.111 -0.993 . . . . 0.0 111.055 -179.365 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.585 ' CE2' ' HB3' ' A' ' 14' ' ' PHE . 15.6 p90 -76.35 -22.76 54.49 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.376 -0.828 . . . . 0.0 109.901 179.422 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.55 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.79 -38.91 70.56 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.341 -0.849 . . . . 0.0 109.632 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.504 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -68.3 -34.68 76.6 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.208 -0.932 . . . . 0.0 109.424 179.376 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.55 ' CE1' ' HG3' ' A' ' 44' ' ' ARG . 4.4 t80 -72.0 -35.84 69.57 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.655 -0.653 . . . . 0.0 110.044 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.5 p -60.83 -49.88 75.71 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.234 -0.916 . . . . 0.0 110.333 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 66.0 p -64.98 -43.84 91.28 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.162 -0.962 . . . . 0.0 110.218 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.48 -31.63 69.52 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.305 -0.872 . . . . 0.0 110.216 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.572 ' CD2' ' HB2' ' B' ' 23' ' ' ALA . 0.6 OUTLIER -65.61 -36.97 85.27 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.203 -0.935 . . . . 0.0 110.202 -179.926 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.835 ' OH ' HG22 ' A' ' 6' ' ' THR . 11.1 m-85 -86.77 -21.43 26.54 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.291 -0.881 . . . . 0.0 110.203 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -132.64 116.34 1.77 Allowed Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.554 -1.419 . . . . 0.0 109.554 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -74.02 -61.62 1.79 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.185 -1.185 . . . . 0.0 110.218 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -174.11 -60.64 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.226 -0.921 . . . . 0.0 110.199 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -83.23 115.32 21.9 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.177 -0.952 . . . . 0.0 110.213 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.661 0 O-C-N 121.273 -0.892 . . . . 0.0 110.188 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.256 0 N-CA-C 109.571 -1.411 . . . . 0.0 109.571 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.74 -48.86 4.35 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.194 -1.18 . . . . 0.0 110.17 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.76 -45.3 94.5 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.164 -0.96 . . . . 0.0 110.15 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.9 -35.72 69.3 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.232 -0.917 . . . . 0.0 110.042 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -65.26 -45.49 84.34 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.259 -0.901 . . . . 0.0 110.126 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . 0.631 ' HB2' HD12 ' A' ' 16' ' ' ILE . . . -62.91 -39.16 93.72 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.248 -0.907 . . . . 0.0 110.106 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.771 ' O ' HG23 ' B' ' 17' ' ' VAL . 25.1 t -62.45 -42.73 96.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.357 -0.839 . . . . 0.0 110.154 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.7 -40.24 83.06 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.264 -0.898 . . . . 0.0 110.097 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.3 m -62.36 -48.19 80.88 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.32 -0.863 . . . . 0.0 110.203 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.407 ' O ' HG23 ' B' ' 20' ' ' VAL . 46.7 t -64.07 -43.62 97.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.247 -0.908 . . . . 0.0 110.268 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.774 HG22 ' HG2' ' A' ' 37' ' ' GLN . 45.2 t -63.01 -49.31 84.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.244 -0.91 . . . . 0.0 110.317 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.34 -32.67 74.15 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.186 -0.946 . . . . 0.0 110.305 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.47 -44.88 77.53 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.198 -0.939 . . . . 0.0 110.411 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.407 HG23 ' O ' ' B' ' 16' ' ' VAL . 97.6 t -67.17 -42.52 88.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.237 -0.914 . . . . 0.0 110.361 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -65.14 -31.73 73.07 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.255 -0.903 . . . . 0.0 110.447 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.73 ' O ' HG12 ' B' ' 25' ' ' VAL . 6.1 tp60 -64.16 -49.54 71.7 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.173 -0.954 . . . . 0.0 110.573 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.572 ' HB2' ' CD2' ' A' ' 67' ' ' LEU . . . -65.19 -34.69 78.97 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.101 -0.999 . . . . 0.0 110.505 -179.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.7 ttp85 -66.65 -36.56 82.85 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.289 -0.882 . . . . 0.0 110.634 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . 0.73 HG12 ' O ' ' B' ' 22' ' ' GLN . 1.3 p -74.04 -21.18 17.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.049 -1.032 . . . . 0.0 110.304 -179.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 2.1 ttm180 51.18 57.9 6.12 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.402 -0.811 . . . . 0.0 110.215 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -101.84 126.3 34.34 Favored Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.359 -0.838 . . . . 0.0 110.171 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_exo -87.93 -46.7 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.633 0 O-C-N 123.982 1.517 . . . . 0.0 110.318 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 7.1 mtt-85 . . . . . 0 N--CA 1.493 1.683 0 O-C-N 121.299 -0.876 . . . . 0.0 110.232 179.925 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 121.254 0.549 . . . . 0.0 110.258 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -146.65 -86.62 0.1 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.265 -0.897 . . . . 0.0 110.251 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.41 ' O ' ' C ' ' A' ' 4' ' ' THR . 3.7 t0 51.67 -176.95 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.214 -0.929 . . . . 0.0 110.103 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.415 ' O ' ' CG ' ' A' ' 5' ' ' ASP . 0.0 OUTLIER 43.62 54.65 5.37 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.235 -0.916 . . . . 0.0 110.279 179.954 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.415 ' CG ' ' O ' ' A' ' 4' ' ' THR . 11.1 m-20 -165.29 136.17 3.88 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.219 -0.926 . . . . 0.0 110.406 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.64 ' CG2' ' CZ ' ' A' ' 68' ' ' TYR . 31.3 m -108.54 -71.12 0.77 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.24 -0.913 . . . . 0.0 109.985 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.7 -38.29 89.83 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.181 -0.949 . . . . 0.0 109.098 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -59.14 -35.05 72.81 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.585 -0.697 . . . . 0.0 109.57 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.408 ' O ' ' OG ' ' A' ' 13' ' ' SER . 1.8 tt0 -60.87 -44.29 97.25 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.338 -0.851 . . . . 0.0 110.311 -179.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.44 HG12 ' CD2' ' A' ' 14' ' ' PHE . 95.7 t -65.66 -41.46 90.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 120.978 -1.076 . . . . 0.0 109.846 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 75.2 mt -65.54 -47.47 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.273 -0.892 . . . . 0.0 109.448 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.76 -45.99 85.16 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.338 -0.851 . . . . 0.0 108.763 179.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.498 ' HB2' ' CG2' ' B' ' 16' ' ' VAL . 1.5 p -63.12 -42.98 99.63 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.416 -0.803 . . . . 0.0 108.949 178.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.44 ' CD2' HG12 ' A' ' 10' ' ' VAL . 1.1 m-85 -63.61 -41.8 98.28 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.319 -0.863 . . . . 0.0 109.266 179.2 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.625 ' NH2' ' CE2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -55.98 -41.49 74.86 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.482 -0.761 . . . . 0.0 109.321 179.14 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.642 HD12 ' HB2' ' B' ' 12' ' ' ALA . 77.1 mt -61.82 -45.08 99.47 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 O-C-N 121.355 -0.84 . . . . 0.0 109.953 179.545 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.447 HD22 ' HB3' ' A' ' 32' ' ' GLU . 19.9 mt -65.09 -41.31 95.12 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.183 -0.948 . . . . 0.0 110.092 179.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.492 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -73.52 -0.26 14.57 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.253 -0.905 . . . . 0.0 110.229 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.476 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 0.1 OUTLIER 56.71 54.59 7.13 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.216 -0.927 . . . . 0.0 110.381 179.834 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.476 ' HB2' ' O ' ' A' ' 19' ' ' SER . 0.8 OUTLIER 58.43 45.25 16.93 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.255 -0.903 . . . . 0.0 110.384 179.765 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.533 ' O ' ' NH2' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -113.15 145.78 33.86 Favored Pre-proline 0 N--CA 1.494 1.746 0 O-C-N 121.15 -0.969 . . . . 0.0 110.267 179.849 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.576 ' HG2' ' CE2' ' A' ' 23' ' ' TYR . 12.3 Cg_endo -61.25 -11.39 18.92 Favored 'Trans proline' 0 C--N 1.303 -1.838 0 O-C-N 123.971 1.511 . . . . 0.0 109.843 179.292 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.576 ' CE2' ' HG2' ' A' ' 22' ' ' PRO . 8.4 p90 -150.2 170.82 18.05 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.243 -0.911 . . . . 0.0 110.292 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.827 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.3 OUTLIER -123.11 145.09 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.329 -0.857 . . . . 0.0 109.878 179.906 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.827 ' N ' HD13 ' A' ' 24' ' ' ILE . 0.4 OUTLIER -94.44 146.75 23.86 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.157 -0.964 . . . . 0.0 110.281 -179.739 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.514 ' HB2' HD11 ' A' ' 58' ' ' LEU . . . -62.42 -34.49 76.87 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.214 -0.929 . . . . 0.0 110.009 179.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -70.43 -34.17 72.16 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.357 -0.84 . . . . 0.0 110.223 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.48 ' O ' ' HG2' ' A' ' 32' ' ' GLU . 1.5 tp10 -66.32 -50.94 61.94 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.334 -0.854 . . . . 0.0 110.297 -179.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.875 HD12 ' N ' ' A' ' 30' ' ' ARG . 4.4 pp -66.94 -33.57 75.86 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.086 -1.009 . . . . 0.0 109.081 179.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.875 ' N ' HD12 ' A' ' 29' ' ' LEU . 4.6 mtt-85 -55.82 -34.8 65.69 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.432 -0.793 . . . . 0.0 109.795 179.304 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -92.81 -18.68 22.57 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.366 -0.834 . . . . 0.0 110.373 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 28' ' ' GLU . 43.8 mm-40 -92.35 -23.32 19.28 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.122 -0.986 . . . . 0.0 110.53 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.605 HD22 ' HB3' ' A' ' 37' ' ' GLN . 0.5 OUTLIER -122.62 144.28 42.03 Favored Pre-proline 0 N--CA 1.487 1.388 0 O-C-N 121.158 -0.964 . . . . 0.0 110.342 -179.791 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.441 ' O ' ' C ' ' A' ' 35' ' ' PRO . 2.4 Cg_endo -46.42 136.54 15.34 Favored 'Trans proline' 0 C--N 1.305 -1.743 0 O-C-N 123.945 1.497 . . . . 0.0 109.67 179.545 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.441 ' C ' ' O ' ' A' ' 34' ' ' PRO . 26.5 Cg_exo -38.07 -37.75 0.66 Allowed 'Trans proline' 0 C--N 1.304 -1.78 0 O-C-N 124.112 1.585 . . . . 0.0 110.784 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -65.93 -47.64 74.04 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.242 -0.911 . . . . 0.0 110.862 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.605 ' HB3' HD22 ' A' ' 33' ' ' LEU . 2.2 mp0 -70.31 -45.55 66.02 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.176 -0.953 . . . . 0.0 110.714 -179.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.72 ' HB1' ' CD1' ' A' ' 29' ' ' LEU . . . -55.98 -44.74 78.83 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.279 -0.888 . . . . 0.0 110.663 -179.45 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.8 -40.29 79.55 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.238 -0.914 . . . . 0.0 110.664 -179.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.11 -45.43 85.17 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.159 -0.963 . . . . 0.0 110.573 -179.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.51 ' O ' ' HG2' ' A' ' 45' ' ' MET . 49.2 m -65.29 -51.44 60.69 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.178 -0.951 . . . . 0.0 110.731 -179.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.589 HD11 ' HG3' ' A' ' 30' ' ' ARG . 97.3 mt -45.26 -27.89 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.098 -1.001 . . . . 0.0 110.29 -179.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.8 tttp -86.14 -37.36 18.84 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.307 -0.871 . . . . 0.0 110.245 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.598 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 19.1 mmt180 -69.11 -76.47 0.09 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.358 -0.839 . . . . 0.0 110.75 -179.491 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.559 ' CB ' ' O ' ' A' ' 59' ' ' ASP . 2.8 ptp -39.42 102.73 0.26 Allowed Pre-proline 0 N--CA 1.493 1.675 0 O-C-N 121.417 -0.802 . . . . 0.0 110.41 -179.225 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.958 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 13.6 Cg_endo -59.8 -158.79 0.02 OUTLIER 'Trans proline' 0 C--N 1.307 -1.634 0 O-C-N 124.448 1.762 . . . . 0.0 110.986 -179.341 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.474 ' O ' ' O ' ' A' ' 48' ' ' TYR . . . -75.12 120.19 20.3 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.419 -0.801 . . . . 0.0 110.888 -179.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.474 ' O ' ' O ' ' A' ' 47' ' ' ALA . 24.2 p90 -41.32 166.76 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.478 -0.764 . . . . 0.0 110.68 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -174.99 63.91 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.308 -0.87 . . . . 0.0 110.133 179.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.414 ' O ' ' OG ' ' A' ' 53' ' ' SER . . . -137.82 -179.22 16.77 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -62.29 133.66 44.61 Favored 'Trans proline' 0 C--N 1.305 -1.757 0 O-C-N 123.997 1.525 . . . . 0.0 110.328 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.871 ' O ' HG13 ' A' ' 54' ' ' VAL . . . 84.65 5.26 86.82 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.46 ' C ' ' O ' ' A' ' 52' ' ' GLY . 0.0 OUTLIER -35.9 139.03 0.15 Allowed 'General case' 0 C--N 1.308 -1.224 0 O-C-N 121.697 -0.884 . . . . 0.0 111.045 -179.69 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.871 HG13 ' O ' ' A' ' 52' ' ' GLY . 27.4 m -143.15 165.78 23.92 Favored Pre-proline 0 C--N 1.296 -1.723 0 O-C-N 121.69 -0.631 . . . . 0.0 110.273 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -69.27 140.98 45.93 Favored 'Trans proline' 0 C--N 1.306 -1.669 0 O-C-N 123.929 1.489 . . . . 0.0 110.342 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 90.49 -11.85 70.13 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.437 ' O ' ' CD1' ' A' ' 48' ' ' TYR . . . -79.11 146.41 33.23 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.178 -1.19 . . . . 0.0 110.354 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.514 HD11 ' HB2' ' A' ' 26' ' ' ALA . 64.8 mt -132.7 153.48 51.1 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.277 -0.889 . . . . 0.0 109.666 179.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.559 ' O ' ' CB ' ' A' ' 45' ' ' MET . 12.6 t0 -86.98 109.62 19.5 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.033 -1.042 . . . . 0.0 110.326 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.625 ' CE2' ' NH2' ' A' ' 15' ' ' ARG . 26.1 p90 -83.57 -21.96 32.49 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.327 -0.858 . . . . 0.0 109.123 179.17 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.429 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -67.46 -37.72 83.36 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.454 -0.779 . . . . 0.0 109.548 179.472 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.958 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -63.66 -33.02 74.7 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.148 -0.97 . . . . 0.0 109.846 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.598 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 4.1 t80 -71.84 -34.48 69.32 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.503 -0.748 . . . . 0.0 110.163 179.699 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 33.7 p -66.44 -49.77 65.61 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.238 -0.914 . . . . 0.0 110.458 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.44 ' O ' ' N ' ' A' ' 69' ' ' GLY . 0.2 OUTLIER -64.74 -39.56 93.83 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.202 -0.936 . . . . 0.0 110.308 -179.974 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.88 -36.38 80.15 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.246 -0.909 . . . . 0.0 110.329 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.563 HD21 ' O ' ' B' ' 19' ' ' ALA . 0.4 OUTLIER -58.57 -42.25 87.55 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.162 -0.961 . . . . 0.0 110.251 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.64 ' CZ ' ' CG2' ' A' ' 6' ' ' THR . 10.5 m-85 -97.92 -23.74 15.69 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.316 -0.865 . . . . 0.0 110.218 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.44 ' N ' ' O ' ' A' ' 65' ' ' SER . . . -65.65 -129.03 0.01 OUTLIER Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -113.56 -170.13 1.64 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.192 -1.181 . . . . 0.0 110.205 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 60.1 p -79.99 -150.33 0.06 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.291 -0.881 . . . . 0.0 110.188 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -94.17 130.02 40.53 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.155 -0.965 . . . . 0.0 110.233 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.636 0 O-C-N 121.351 -0.843 . . . . 0.0 110.178 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' GLY . . . . . 0.518 ' O ' ' N ' ' B' ' 9' ' ' LYS . . . . . . . . 0 N--CA 1.49 2.234 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.452 ' CB ' ' O ' ' B' ' 7' ' ' GLY . 0.0 OUTLIER 66.28 -62.56 0.26 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.202 -1.176 . . . . 0.0 110.241 -179.89 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.557 ' HA ' HG21 ' A' ' 16' ' ' ILE . 0.6 OUTLIER -58.19 -44.54 88.12 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.166 -0.959 . . . . 0.0 110.051 179.859 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.98 -34.89 78.48 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.266 -0.897 . . . . 0.0 109.982 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -65.55 -40.41 92.83 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.259 -0.9 . . . . 0.0 109.924 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . 0.706 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -62.89 -39.38 94.3 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.322 -0.861 . . . . 0.0 109.871 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.841 ' O ' HG23 ' B' ' 17' ' ' VAL . 99.4 t -60.37 -41.59 87.86 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.349 -0.844 . . . . 0.0 109.883 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.78 -42.27 95.22 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.321 -0.862 . . . . 0.0 110.061 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 22.2 m -61.91 -46.07 90.96 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.215 -0.928 . . . . 0.0 110.061 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.706 HG23 ' O ' ' B' ' 12' ' ' ALA . 21.1 t -64.39 -41.76 93.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.228 -0.92 . . . . 0.0 110.014 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.841 HG23 ' O ' ' B' ' 13' ' ' VAL . 91.0 t -60.09 -46.23 94.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.275 -0.891 . . . . 0.0 110.136 179.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.17 -42.21 98.17 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.238 -0.913 . . . . 0.0 110.18 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.563 ' O ' HD21 ' A' ' 67' ' ' LEU . . . -65.37 -43.82 89.52 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.256 -0.902 . . . . 0.0 110.212 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.507 HG22 ' HZ ' ' A' ' 63' ' ' PHE . 55.7 t -67.46 -45.57 85.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.256 -0.902 . . . . 0.0 110.169 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.442 ' O ' HG23 ' B' ' 25' ' ' VAL . 9.3 t0 -57.25 -33.47 67.62 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.349 -0.844 . . . . 0.0 110.241 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.03 -45.88 90.22 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.248 -0.908 . . . . 0.0 110.211 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -58.51 -35.02 71.61 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.175 -0.953 . . . . 0.0 110.198 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 44.7 ttt180 -66.0 -35.26 80.08 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.218 -0.926 . . . . 0.0 110.185 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . 0.442 HG23 ' O ' ' B' ' 21' ' ' ASP . 78.0 t -60.91 -21.68 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.244 -0.91 . . . . 0.0 110.296 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 3.9 ttt180 63.08 69.25 0.59 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.48 -0.763 . . . . 0.0 110.121 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.8 139.15 85.68 Favored Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.363 -0.836 . . . . 0.0 110.202 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -75.84 70.21 5.93 Favored 'Trans proline' 0 C--N 1.305 -1.721 0 O-C-N 123.949 1.5 . . . . 0.0 110.29 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 O-C-N 121.166 -0.959 . . . . 0.0 110.29 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.191 0.519 . . . . 0.0 110.193 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -173.08 -81.29 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.221 -0.924 . . . . 0.0 110.242 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -140.91 177.09 8.29 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.218 -0.926 . . . . 0.0 110.276 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.6 m -130.16 164.54 24.25 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.289 -0.882 . . . . 0.0 110.134 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.506 ' O ' ' N ' ' A' ' 7' ' ' ALA . 0.2 OUTLIER -173.45 51.48 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.23 -0.919 . . . . 0.0 110.325 -179.968 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.994 HG22 ' CE2' ' A' ' 68' ' ' TYR . 1.9 m 64.59 -68.36 0.1 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.23 -0.919 . . . . 0.0 110.375 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.506 ' N ' ' O ' ' A' ' 5' ' ' ASP . . . -68.36 -39.6 81.76 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.258 -0.901 . . . . 0.0 109.831 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.62 ' HA ' HD12 ' A' ' 11' ' ' ILE . 5.8 tm-20 -67.39 -36.45 81.33 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.392 -0.817 . . . . 0.0 109.9 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 6.0 tp60 -61.29 -45.97 92.24 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.327 -0.858 . . . . 0.0 110.139 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.747 HG12 ' HD2' ' A' ' 14' ' ' PHE . 75.6 t -58.05 -44.88 88.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.24 -0.913 . . . . 0.0 110.071 179.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.62 HD12 ' HA ' ' A' ' 8' ' ' GLU . 73.1 mt -54.78 -48.51 73.12 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.239 -0.913 . . . . 0.0 109.716 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.74 -42.67 84.39 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.173 -0.954 . . . . 0.0 109.099 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.438 ' HB2' ' CG2' ' B' ' 16' ' ' VAL . 2.2 m -68.1 -39.75 82.77 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.496 -0.753 . . . . 0.0 109.356 179.134 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.747 ' HD2' HG12 ' A' ' 10' ' ' VAL . 2.4 m-85 -68.58 -42.09 78.73 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.307 -0.871 . . . . 0.0 109.528 179.293 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.3 ttt-85 -53.34 -46.78 69.63 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.284 -0.885 . . . . 0.0 109.42 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.604 HD12 ' HB2' ' B' ' 12' ' ' ALA . 37.8 mt -59.42 -42.54 87.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.352 -0.842 . . . . 0.0 109.571 179.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.663 HD11 ' CG2' ' B' ' 13' ' ' VAL . 4.4 mp -63.99 -41.55 97.47 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.358 -0.839 . . . . 0.0 109.806 179.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.632 ' HB1' ' O ' ' A' ' 23' ' ' TYR . . . -74.45 -2.81 27.19 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.342 -0.849 . . . . 0.0 110.141 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.43 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.3 OUTLIER 65.29 74.69 0.38 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.263 -0.898 . . . . 0.0 110.258 -179.921 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.8 t0 49.04 59.08 4.7 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.264 -0.897 . . . . 0.0 110.317 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.583 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 11.2 mttt -148.6 144.81 18.88 Favored Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.19 -0.944 . . . . 0.0 110.169 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -77.25 4.33 5.96 Favored 'Trans proline' 0 C--N 1.305 -1.748 0 O-C-N 124.063 1.559 . . . . 0.0 110.117 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.632 ' O ' ' HB1' ' A' ' 18' ' ' ALA . 48.8 p90 -148.99 175.34 11.39 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.208 -0.932 . . . . 0.0 110.319 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.6 tt -151.33 156.96 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.274 -0.891 . . . . 0.0 110.119 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.2 mp -89.26 149.05 23.25 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.264 -0.897 . . . . 0.0 110.258 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.502 ' O ' ' HG ' ' A' ' 29' ' ' LEU . . . -58.03 -34.79 70.45 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.27 -0.894 . . . . 0.0 110.028 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -70.76 -34.11 71.49 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.269 -0.894 . . . . 0.0 110.018 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.453 ' O ' ' CG ' ' A' ' 32' ' ' GLU . 3.8 tp10 -62.5 -50.97 69.27 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.3 -0.875 . . . . 0.0 110.513 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.769 HD12 ' C ' ' A' ' 29' ' ' LEU . 3.5 pp -66.98 -33.16 74.96 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.006 -1.059 . . . . 0.0 109.295 179.444 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.76 ' N ' HD12 ' A' ' 29' ' ' LEU . 3.2 ttt85 -58.18 -34.75 70.68 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.394 -0.816 . . . . 0.0 109.61 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.8 ttt180 -91.62 -29.85 16.67 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.433 -0.792 . . . . 0.0 110.196 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.453 ' CG ' ' O ' ' A' ' 28' ' ' GLU . 5.0 mm-40 -82.2 -23.56 35.39 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.174 -0.954 . . . . 0.0 110.26 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.755 HD23 ' HD2' ' A' ' 34' ' ' PRO . 6.5 mt -119.96 146.9 43.15 Favored Pre-proline 0 N--CA 1.489 1.476 0 O-C-N 121.257 -0.902 . . . . 0.0 110.094 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.755 ' HD2' HD23 ' A' ' 33' ' ' LEU . 1.1 Cg_endo -53.67 158.19 8.62 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 O-C-N 123.938 1.493 . . . . 0.0 110.284 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -50.54 -39.44 55.35 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 124.108 1.583 . . . . 0.0 110.69 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.97 -46.46 81.39 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.21 -0.932 . . . . 0.0 110.445 -179.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.574 ' CB ' HD22 ' A' ' 33' ' ' LEU . 58.5 mm-40 -69.66 -38.33 77.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.25 -0.906 . . . . 0.0 110.686 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.617 ' HA ' HD13 ' A' ' 29' ' ' LEU . . . -57.46 -42.12 81.91 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.203 -0.936 . . . . 0.0 110.798 -179.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.5 tp60 -60.69 -47.08 87.87 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.179 -0.951 . . . . 0.0 110.692 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -66.0 -43.87 86.49 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.21 -0.931 . . . . 0.0 110.586 -179.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.453 ' HB3' HD22 ' A' ' 29' ' ' LEU . 3.2 m -62.67 -42.91 99.88 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.223 -0.923 . . . . 0.0 111.005 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.73 HG13 HD21 ' A' ' 29' ' ' LEU . 68.6 mt -75.2 -12.35 14.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.067 -1.021 . . . . 0.0 110.524 -179.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.88 -16.07 49.01 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.23 -0.919 . . . . 0.0 111.129 -179.359 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.514 ' O ' ' C ' ' A' ' 45' ' ' MET . 1.1 mpp_? -117.26 -56.66 2.22 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.086 -1.009 . . . . 0.0 110.997 -179.479 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.539 ' HE2' ' HA ' ' A' ' 60' ' ' TYR . 3.9 ttm -29.48 94.52 0.06 OUTLIER Pre-proline 0 N--CA 1.498 1.964 0 O-C-N 121.691 -0.63 . . . . 0.0 111.531 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.471 ' N ' ' O ' ' A' ' 44' ' ' ARG . 11.5 Cg_endo -59.07 -174.6 0.08 OUTLIER 'Trans proline' 0 C--N 1.307 -1.641 0 O-C-N 124.121 1.59 . . . . 0.0 110.363 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.62 74.26 7.53 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.192 -0.942 . . . . 0.0 110.303 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.435 ' HA ' ' CG ' ' A' ' 59' ' ' ASP . 1.1 t80 42.6 -118.66 0.48 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.319 -0.863 . . . . 0.0 110.43 179.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -100.4 160.41 14.36 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.96 -1.087 . . . . 0.0 110.386 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.425 ' N ' ' CD ' ' A' ' 51' ' ' PRO . . . -70.3 -34.58 69.12 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.425 ' CD ' ' N ' ' A' ' 50' ' ' GLY . 44.8 Cg_endo -115.18 130.07 0.02 OUTLIER 'Trans proline' 0 C--N 1.306 -1.683 0 O-C-N 123.972 1.511 . . . . 0.0 110.257 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.44 ' O ' ' HB3' ' A' ' 53' ' ' SER . . . 93.17 -134.49 12.18 Favored Glycine 0 N--CA 1.489 2.202 0 N-CA-C 109.354 -1.498 . . . . 0.0 109.354 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.44 ' HB3' ' O ' ' A' ' 52' ' ' GLY . 11.0 t 55.81 -178.63 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.277 -1.131 . . . . 0.0 110.115 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.464 ' CG2' ' HB2' ' A' ' 57' ' ' ALA . 20.2 m -123.77 164.08 31.1 Favored Pre-proline 0 C--N 1.295 -1.765 0 O-C-N 121.72 -0.613 . . . . 0.0 110.098 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -75.24 55.35 4.04 Favored 'Trans proline' 0 C--N 1.305 -1.72 0 O-C-N 123.907 1.477 . . . . 0.0 110.381 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 170.82 35.01 0.03 OUTLIER Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.565 ' C ' HD22 ' A' ' 58' ' ' LEU . . . -134.51 128.69 33.87 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.225 -1.162 . . . . 0.0 110.227 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.849 HD22 ' N ' ' A' ' 58' ' ' LEU . 2.1 mm? -112.77 156.4 22.91 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.226 -0.921 . . . . 0.0 109.785 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.485 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.6 OUTLIER -111.53 110.46 20.89 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.068 -1.02 . . . . 0.0 110.441 -179.855 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.539 ' HA ' ' HE2' ' A' ' 45' ' ' MET . 18.4 p90 -75.02 -21.75 58.89 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.263 -0.898 . . . . 0.0 109.593 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.519 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.9 -39.15 71.17 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.295 -0.878 . . . . 0.0 109.457 179.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.47 -32.33 73.2 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.34 -0.85 . . . . 0.0 109.087 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.473 ' O ' ' HB3' ' A' ' 67' ' ' LEU . 2.0 t80 -61.78 -38.53 88.39 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-O 121.192 0.52 . . . . 0.0 110.35 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 25.1 m -56.79 -49.67 74.62 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.329 -0.857 . . . . 0.0 110.825 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.434 ' O ' ' HA3' ' A' ' 69' ' ' GLY . 14.0 m -66.18 -36.16 82.36 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.076 -1.015 . . . . 0.0 110.74 -179.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.88 -30.12 56.08 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.145 -0.972 . . . . 0.0 110.842 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.543 ' O ' HD12 ' A' ' 67' ' ' LEU . 0.3 OUTLIER -78.18 -46.77 19.64 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.066 -1.021 . . . . 0.0 109.945 -179.632 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.994 ' CE2' HG22 ' A' ' 6' ' ' THR . 12.4 m-85 -100.42 15.26 28.43 Favored 'General case' 0 N--CA 1.492 1.652 0 C-N-CA 119.939 -0.705 . . . . 0.0 110.463 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.434 ' HA3' ' O ' ' A' ' 65' ' ' SER . . . -92.67 51.57 2.64 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.519 -1.432 . . . . 0.0 109.519 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -131.64 -65.6 0.75 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.246 -1.149 . . . . 0.0 110.296 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.8 m -63.02 113.88 3.37 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.238 -0.914 . . . . 0.0 110.249 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -68.42 105.59 2.24 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.249 -0.907 . . . . 0.0 110.27 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.0 tp . . . . . 0 N--CA 1.491 1.577 0 O-C-N 121.252 -0.905 . . . . 0.0 110.204 179.965 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' GLY . . . . . 0.521 ' O ' ' N ' ' B' ' 9' ' ' LYS . . . . . . . . 0 N--CA 1.49 2.296 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.44 ' HE3' HD13 ' A' ' 16' ' ' ILE . 1.5 ttpt 66.22 -62.04 0.27 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.268 -1.137 . . . . 0.0 110.143 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.521 ' N ' ' O ' ' B' ' 7' ' ' GLY . 1.4 ttmt -58.75 -40.25 83.29 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.122 -0.986 . . . . 0.0 110.001 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.06 -35.43 80.21 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.24 -0.912 . . . . 0.0 109.888 179.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.6 tm-20 -65.96 -40.32 91.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.373 -0.83 . . . . 0.0 110.144 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . 0.604 ' HB2' HD12 ' A' ' 16' ' ' ILE . . . -62.54 -41.76 99.09 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.338 -0.851 . . . . 0.0 110.068 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.766 ' O ' HG23 ' B' ' 17' ' ' VAL . 58.1 t -63.36 -40.55 89.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.264 -0.897 . . . . 0.0 109.892 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.77 -39.04 87.33 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.369 -0.832 . . . . 0.0 110.276 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 23.7 m -66.15 -43.67 86.36 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.212 -0.93 . . . . 0.0 110.312 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.438 ' CG2' ' HB2' ' A' ' 13' ' ' SER . 61.5 t -67.53 -40.41 84.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.283 -0.886 . . . . 0.0 110.363 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.766 HG23 ' O ' ' B' ' 13' ' ' VAL . 98.8 t -58.14 -49.0 83.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.233 -0.917 . . . . 0.0 110.498 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.44 -38.83 92.4 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.24 -0.912 . . . . 0.0 110.276 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.45 -46.04 74.24 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.261 -0.9 . . . . 0.0 110.145 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.554 HG11 ' OE1' ' A' ' 37' ' ' GLN . 83.8 t -67.49 -45.92 84.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.291 -0.881 . . . . 0.0 110.091 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.401 ' HB2' ' O ' ' B' ' 17' ' ' VAL . 2.5 t70 -57.46 -38.23 74.13 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.204 -0.935 . . . . 0.0 110.194 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.27 -45.32 72.41 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.226 -0.921 . . . . 0.0 109.946 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.417 ' HB2' HD13 ' A' ' 67' ' ' LEU . . . -64.52 -38.81 92.32 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.372 -0.83 . . . . 0.0 109.84 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 22.1 ttt-85 -61.87 -35.72 79.14 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.232 -0.918 . . . . 0.0 109.928 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 78.0 t -76.5 -21.67 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.29 -0.881 . . . . 0.0 110.199 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.49 20.37 3.96 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.361 -0.837 . . . . 0.0 110.103 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . 0.482 ' HA ' ' HD3' ' B' ' 28' ' ' PRO . 28.8 tp10 -105.95 125.17 33.83 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.319 -0.863 . . . . 0.0 110.37 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' B' ' 27' ' ' GLU . 7.4 Cg_exo -59.11 -24.74 75.08 Favored 'Trans proline' 0 C--N 1.307 -1.616 0 O-C-N 123.993 1.523 . . . . 0.0 110.253 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 14.5 tpt85 . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.277 -0.89 . . . . 0.0 110.236 -179.836 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 ttt . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.241 0.544 . . . . 0.0 110.173 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 47.52 86.12 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.265 -0.897 . . . . 0.0 110.2 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.447 ' HB2' ' HG2' ' A' ' 8' ' ' GLU . 4.8 p-10 -125.86 -170.84 2.26 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.307 -0.871 . . . . 0.0 110.255 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.413 ' HB ' ' HB2' ' A' ' 8' ' ' GLU . 0.2 OUTLIER -122.05 -176.19 3.29 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.256 -0.902 . . . . 0.0 110.201 179.889 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.524 ' O ' ' N ' ' A' ' 7' ' ' ALA . 6.1 p-10 -121.49 156.14 33.43 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.231 -0.918 . . . . 0.0 110.272 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.548 ' CG2' ' CE1' ' A' ' 68' ' ' TYR . 3.4 m 64.08 -69.11 0.09 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.378 -0.826 . . . . 0.0 110.076 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.524 ' N ' ' O ' ' A' ' 5' ' ' ASP . . . -66.57 -44.43 82.29 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.243 -0.91 . . . . 0.0 109.64 179.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.447 ' HG2' ' HB2' ' A' ' 3' ' ' ASP . 14.9 tp10 -58.83 -36.52 74.65 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.482 -0.761 . . . . 0.0 109.914 179.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.49 -47.68 84.52 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.324 -0.86 . . . . 0.0 110.113 -179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.517 HG12 ' CD2' ' A' ' 14' ' ' PHE . 24.5 t -57.98 -51.18 73.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.289 -0.882 . . . . 0.0 109.784 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.404 HG23 ' HE1' ' A' ' 60' ' ' TYR . 16.5 mt -57.88 -49.7 80.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.392 -0.818 . . . . 0.0 109.621 179.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.91 -41.89 83.6 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.289 -0.882 . . . . 0.0 109.183 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 65.3 m -67.96 -37.09 81.14 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.392 -0.817 . . . . 0.0 109.33 179.177 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.591 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 2.1 m-85 -67.91 -44.14 77.61 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.31 -0.869 . . . . 0.0 109.644 179.452 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.68 -48.12 72.79 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.266 -0.896 . . . . 0.0 109.608 179.531 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 60.8 mt -60.33 -42.95 92.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.313 -0.867 . . . . 0.0 109.776 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.604 HD12 ' CD ' ' A' ' 32' ' ' GLU . 1.8 mm? -62.5 -40.54 97.03 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.32 -0.863 . . . . 0.0 109.915 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.486 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -82.9 7.62 14.87 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.394 -0.816 . . . . 0.0 110.295 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.486 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.8 OUTLIER 67.37 66.27 0.4 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.208 -0.933 . . . . 0.0 110.278 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.454 ' N ' ' OD1' ' A' ' 20' ' ' ASP . 1.0 OUTLIER 49.52 62.03 2.84 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.273 -0.892 . . . . 0.0 110.38 179.906 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.598 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 25.6 mttm -140.84 141.96 26.4 Favored Pre-proline 0 N--CA 1.488 1.454 0 O-C-N 121.235 -0.916 . . . . 0.0 110.074 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -72.02 -1.03 9.39 Favored 'Trans proline' 0 C--N 1.305 -1.748 0 O-C-N 124.059 1.558 . . . . 0.0 110.211 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.598 ' CZ ' ' HD3' ' A' ' 21' ' ' LYS . 39.6 p90 -142.07 162.39 35.61 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.287 -0.883 . . . . 0.0 110.035 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.832 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -128.1 140.6 48.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.151 -0.968 . . . . 0.0 110.238 -179.84 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.832 ' N ' HD13 ' A' ' 24' ' ' ILE . 1.1 mt -80.33 144.61 32.63 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.265 -0.897 . . . . 0.0 110.167 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.496 ' HA ' ' CD2' ' A' ' 29' ' ' LEU . . . -62.65 -36.54 83.16 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.338 -0.851 . . . . 0.0 110.296 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -68.25 -34.6 76.51 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.105 -0.997 . . . . 0.0 109.936 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.484 ' O ' ' CG ' ' A' ' 32' ' ' GLU . 62.2 mt-10 -65.88 -50.36 64.8 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.29 -0.881 . . . . 0.0 110.003 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.55 HD12 ' CB ' ' A' ' 38' ' ' ALA . 1.7 pp -67.2 -32.99 74.43 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.2 -0.938 . . . . 0.0 109.933 179.62 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.636 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 6.8 mtt180 -66.35 -34.16 77.35 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.28 -0.887 . . . . 0.0 110.639 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 31' ' ' ARG . 1.5 ttt180 -95.36 -25.54 16.25 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.176 -0.953 . . . . 0.0 111.614 -178.705 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.648 ' HG3' HD12 ' A' ' 33' ' ' LEU . 15.5 pt-20 -92.13 -24.16 19.19 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.815 -1.178 . . . . 0.0 111.204 -178.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.694 HD23 ' CB ' ' A' ' 37' ' ' GLN . 0.1 OUTLIER -108.63 141.89 24.27 Favored Pre-proline 0 N--CA 1.492 1.643 0 O-C-N 121.043 -1.035 . . . . 0.0 110.427 -179.972 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.423 ' O ' ' C ' ' A' ' 35' ' ' PRO . 23.1 Cg_exo -44.54 137.7 8.23 Favored 'Trans proline' 0 C--N 1.303 -1.818 0 O-C-N 124.2 1.632 . . . . 0.0 109.765 179.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.423 ' C ' ' O ' ' A' ' 34' ' ' PRO . 37.1 Cg_endo -39.6 -38.49 1.66 Allowed 'Trans proline' 0 C--N 1.305 -1.721 0 O-C-N 124.039 1.547 . . . . 0.0 110.378 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -66.21 -45.71 79.8 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.275 -0.89 . . . . 0.0 110.665 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.694 ' CB ' HD23 ' A' ' 33' ' ' LEU . 52.4 mm-40 -69.97 -42.56 73.0 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.171 -0.955 . . . . 0.0 110.797 -179.429 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.636 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -63.54 -48.76 76.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.107 -0.995 . . . . 0.0 110.521 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.9 tm0? -56.24 -43.08 78.31 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.196 -0.94 . . . . 0.0 110.499 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -66.27 -42.88 87.85 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.228 -0.92 . . . . 0.0 110.285 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 45' ' ' MET . 84.5 m -65.0 -50.93 64.38 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.273 -0.892 . . . . 0.0 110.446 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.539 ' CD1' HD21 ' A' ' 29' ' ' LEU . 19.0 mm -40.41 -32.07 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.291 -0.881 . . . . 0.0 110.325 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.48 -42.19 14.69 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.377 -0.827 . . . . 0.0 110.805 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.586 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 3.9 mmt180 -63.7 -74.71 0.09 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.205 -0.934 . . . . 0.0 110.499 -179.405 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.532 ' HE2' ' CA ' ' A' ' 60' ' ' TYR . 6.8 ptp -56.82 119.48 30.29 Favored Pre-proline 0 N--CA 1.489 1.479 0 O-C-N 121.05 -1.031 . . . . 0.0 110.2 -179.723 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 45' ' ' MET . 11.8 Cg_exo -78.36 -167.05 0.45 Allowed 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 123.972 1.511 . . . . 0.0 110.236 -179.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -84.56 139.67 31.95 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.17 -0.956 . . . . 0.0 110.111 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.437 ' CE2' ' HB2' ' A' ' 53' ' ' SER . 24.3 t80 -69.96 100.78 1.65 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.255 -0.903 . . . . 0.0 110.183 -179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.9 p -84.7 92.72 8.26 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.241 -0.912 . . . . 0.0 110.198 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -124.89 -164.48 11.9 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -83.49 -52.27 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 124.014 1.534 . . . . 0.0 110.16 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.401 ' O ' ' HB3' ' A' ' 53' ' ' SER . . . -100.35 -79.66 1.45 Allowed Glycine 0 N--CA 1.489 2.222 0 N-CA-C 109.359 -1.496 . . . . 0.0 109.359 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.437 ' HB2' ' CE2' ' A' ' 48' ' ' TYR . 10.1 t 54.38 -178.61 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.249 -1.147 . . . . 0.0 110.194 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.404 ' N ' ' OG ' ' A' ' 53' ' ' SER . 5.0 m -134.05 165.62 35.37 Favored Pre-proline 0 C--N 1.295 -1.763 0 O-C-N 121.741 -0.599 . . . . 0.0 110.205 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -70.05 103.63 1.24 Allowed 'Trans proline' 0 C--N 1.306 -1.71 0 O-C-N 123.991 1.522 . . . . 0.0 110.369 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.485 ' O ' ' CD2' ' A' ' 58' ' ' LEU . . . 121.69 15.94 4.29 Favored Glycine 0 N--CA 1.489 2.201 0 N-CA-C 109.724 -1.351 . . . . 0.0 109.724 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.69 ' C ' HD22 ' A' ' 58' ' ' LEU . . . -91.02 121.02 32.48 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.121 -1.223 . . . . 0.0 110.174 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.841 HD22 ' N ' ' A' ' 58' ' ' LEU . 2.5 mm? -116.62 159.61 21.92 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.307 -0.87 . . . . 0.0 110.08 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.453 ' O ' ' HB2' ' A' ' 45' ' ' MET . 88.1 m-20 -109.32 114.36 27.97 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.248 -0.907 . . . . 0.0 110.183 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.591 ' HB2' ' CD2' ' A' ' 14' ' ' PHE . 23.8 p90 -84.31 -24.85 29.67 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.246 -0.909 . . . . 0.0 110.094 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.501 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.26 -35.9 67.94 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.243 -0.911 . . . . 0.0 109.93 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.99 -33.0 73.8 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.289 -0.882 . . . . 0.0 109.972 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.586 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 1.8 t80 -71.66 -32.75 68.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.558 -0.714 . . . . 0.0 110.053 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.8 t -66.27 -47.31 74.08 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.279 -0.888 . . . . 0.0 110.325 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.483 ' O ' ' N ' ' A' ' 69' ' ' GLY . 2.7 t -65.51 -36.83 85.0 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.192 -0.943 . . . . 0.0 110.357 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -75.21 -28.81 60.1 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.185 -0.947 . . . . 0.0 110.272 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.824 HD21 ' HB1' ' B' ' 19' ' ' ALA . 0.4 OUTLIER -78.48 -45.25 22.54 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.214 -0.929 . . . . 0.0 109.584 179.966 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.548 ' CE1' ' CG2' ' A' ' 6' ' ' THR . 17.4 m-85 -93.38 -23.88 18.28 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.485 -0.76 . . . . 0.0 110.281 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.483 ' N ' ' O ' ' A' ' 65' ' ' SER . . . -91.17 56.74 3.23 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 53.87 176.46 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.262 -1.14 . . . . 0.0 110.156 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 37.7 p -132.87 115.3 15.09 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.292 -0.88 . . . . 0.0 110.231 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -71.28 138.68 49.57 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.248 -0.907 . . . . 0.0 110.29 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.434 ' HA ' HD22 ' A' ' 73' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 O-C-N 121.28 -0.887 . . . . 0.0 110.215 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.282 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 4.8 mttt -149.45 -45.32 0.14 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.283 -1.128 . . . . 0.0 110.086 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 14.1 ttmt -61.56 -49.56 76.18 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.269 -0.894 . . . . 0.0 110.083 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.15 -38.14 67.87 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.222 -0.924 . . . . 0.0 109.945 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -66.09 -40.06 90.51 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.286 -0.884 . . . . 0.0 109.814 179.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.7 -37.05 84.95 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.32 -0.863 . . . . 0.0 110.07 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.63 ' O ' HG23 ' B' ' 17' ' ' VAL . 76.6 t -62.49 -40.85 89.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.215 -0.928 . . . . 0.0 109.826 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.28 -38.07 82.44 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.345 -0.847 . . . . 0.0 109.999 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 56.3 m -62.93 -50.33 71.24 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.37 -0.831 . . . . 0.0 110.059 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 92.8 t -62.32 -43.91 98.6 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.318 -0.864 . . . . 0.0 110.053 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.63 HG23 ' O ' ' B' ' 13' ' ' VAL . 93.5 t -59.83 -45.24 95.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.256 -0.903 . . . . 0.0 110.038 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.47 -38.06 89.69 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.179 -0.951 . . . . 0.0 110.094 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.824 ' HB1' HD21 ' A' ' 67' ' ' LEU . . . -64.66 -44.15 91.32 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.256 -0.902 . . . . 0.0 110.178 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.56 HG22 ' CZ ' ' A' ' 63' ' ' PHE . 56.4 t -66.16 -39.78 85.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.238 -0.914 . . . . 0.0 110.265 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.401 ' O ' HG23 ' B' ' 25' ' ' VAL . 6.6 t0 -65.46 -31.51 72.64 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.192 -0.942 . . . . 0.0 110.234 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -62.59 -38.21 89.23 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.283 -0.885 . . . . 0.0 110.318 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.74 -39.19 93.68 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.202 -0.936 . . . . 0.0 110.38 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.1 -44.26 92.85 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.246 -0.909 . . . . 0.0 109.965 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . 0.401 HG23 ' O ' ' B' ' 21' ' ' ASP . 95.4 t -52.48 -19.37 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.376 -0.828 . . . . 0.0 110.476 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 9.4 ttt180 -71.84 8.75 1.08 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.169 -0.957 . . . . 0.0 111.671 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -84.89 145.22 43.28 Favored Pre-proline 0 N--CA 1.492 1.657 0 O-C-N 121.01 -1.056 . . . . 0.0 109.971 179.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -46.28 -75.75 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.66 0 O-C-N 123.855 1.45 . . . . 0.0 110.413 -179.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 9.5 mmt180 . . . . . 0 N--CA 1.492 1.64 0 O-C-N 121.184 -0.948 . . . . 0.0 110.186 -179.908 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.493 1.68 0 CA-C-O 121.235 0.541 . . . . 0.0 110.115 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -59.05 -168.27 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.27 -0.893 . . . . 0.0 110.187 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.442 ' N ' ' OD1' ' A' ' 3' ' ' ASP . 19.5 p-10 -132.74 93.01 3.14 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.249 -0.907 . . . . 0.0 110.124 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 15.1 t -140.9 9.2 2.14 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.309 -0.869 . . . . 0.0 110.114 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -131.22 -175.52 3.72 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.277 -0.889 . . . . 0.0 110.27 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -95.46 -47.53 6.23 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.292 -0.88 . . . . 0.0 110.233 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.11 -47.69 83.48 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.235 -0.915 . . . . 0.0 109.82 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -54.4 -36.23 63.71 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.422 -0.799 . . . . 0.0 109.791 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -61.46 -44.58 96.85 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.401 -0.812 . . . . 0.0 110.281 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.544 HG12 ' CD2' ' A' ' 14' ' ' PHE . 41.7 t -62.64 -41.27 91.54 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.14 -0.975 . . . . 0.0 109.967 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 58.6 mt -59.3 -47.11 91.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.32 -0.862 . . . . 0.0 109.743 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.63 -42.59 83.69 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.265 -0.897 . . . . 0.0 109.055 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.454 ' O ' ' HB1' ' B' ' 12' ' ' ALA . 0.0 OUTLIER -67.74 -38.42 83.5 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.437 -0.789 . . . . 0.0 109.21 178.914 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.544 ' CD2' HG12 ' A' ' 10' ' ' VAL . 0.9 OUTLIER -68.42 -43.22 77.64 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.33 -0.857 . . . . 0.0 109.647 179.284 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.1 ttt180 -53.42 -46.42 69.78 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.264 -0.898 . . . . 0.0 109.565 179.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.496 HG21 ' HA ' ' B' ' 9' ' ' LYS . 42.7 mt -58.13 -45.01 88.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.23 -0.918 . . . . 0.0 109.705 179.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.447 HD11 ' CG2' ' B' ' 13' ' ' VAL . 1.3 mp -63.13 -41.65 99.35 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.396 -0.815 . . . . 0.0 109.74 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.564 ' HB2' ' HB ' ' A' ' 24' ' ' ILE . . . -75.92 -1.78 27.14 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.319 -0.863 . . . . 0.0 110.04 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 67.61 62.43 0.43 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.29 -0.881 . . . . 0.0 110.446 179.997 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' A' ' 19' ' ' SER . 87.0 m-20 54.1 61.22 3.15 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.257 -0.902 . . . . 0.0 110.362 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.418 ' HE3' ' O ' ' A' ' 18' ' ' ALA . 39.2 mtmt -149.03 142.71 16.3 Favored Pre-proline 0 N--CA 1.489 1.495 0 O-C-N 121.297 -0.877 . . . . 0.0 109.86 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -69.9 -3.57 12.37 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 O-C-N 123.981 1.516 . . . . 0.0 110.095 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 33.1 p90 -145.74 159.16 43.58 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.252 -0.905 . . . . 0.0 110.154 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.564 ' HB ' ' HB2' ' A' ' 18' ' ' ALA . 10.5 tt -136.15 153.84 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.213 -0.929 . . . . 0.0 110.216 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.438 HD23 ' HA ' ' A' ' 25' ' ' LEU . 39.9 mt -80.86 134.3 35.74 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.196 -0.94 . . . . 0.0 110.234 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.412 ' HB2' ' CD1' ' A' ' 58' ' ' LEU . . . -55.52 -40.12 71.39 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.231 -0.918 . . . . 0.0 109.875 179.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -61.68 -38.29 87.27 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.319 -0.863 . . . . 0.0 109.729 179.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.432 ' HG2' ' OE2' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -68.66 -43.73 75.59 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.297 -0.877 . . . . 0.0 109.229 179.315 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.763 ' CD1' HD12 ' A' ' 33' ' ' LEU . 0.8 OUTLIER -64.27 -39.95 94.98 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.513 -0.742 . . . . 0.0 109.199 179.124 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.639 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -58.38 -34.77 71.08 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.544 -0.722 . . . . 0.0 110.236 179.826 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.8 ttt85 -93.12 -17.93 23.2 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.258 -0.901 . . . . 0.0 110.441 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.432 ' OE2' ' HG2' ' A' ' 28' ' ' GLU . 0.4 OUTLIER -88.56 -23.25 23.2 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.168 -0.957 . . . . 0.0 110.352 -179.893 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.763 HD12 ' CD1' ' A' ' 29' ' ' LEU . 13.1 mt -123.61 143.93 42.99 Favored Pre-proline 0 C--N 1.304 -1.381 0 O-C-N 121.231 -0.918 . . . . 0.0 110.383 -179.51 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.429 ' HD2' ' HB2' ' A' ' 37' ' ' GLN . 30.3 Cg_exo -46.62 145.19 6.68 Favored 'Trans proline' 0 C--N 1.305 -1.747 0 O-C-N 123.951 1.5 . . . . 0.0 109.918 179.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.424 ' O ' ' HB2' ' A' ' 39' ' ' GLN . 27.8 Cg_endo -42.12 -40.47 6.48 Favored 'Trans proline' 0 C--N 1.304 -1.802 0 O-C-N 123.94 1.495 . . . . 0.0 110.371 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -65.77 -46.92 76.97 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.226 -0.921 . . . . 0.0 110.578 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.474 ' OE1' HG13 ' B' ' 17' ' ' VAL . 1.2 mp0 -69.41 -43.63 73.03 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.219 -0.926 . . . . 0.0 110.289 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.639 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -61.19 -48.13 82.95 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.366 -0.834 . . . . 0.0 110.5 -179.651 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.432 ' O ' ' HB2' ' A' ' 43' ' ' LYS . 9.8 tt0 -57.51 -48.04 80.34 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.174 -0.954 . . . . 0.0 110.106 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -64.02 -41.56 97.42 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.262 -0.899 . . . . 0.0 110.241 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 66.9 m -64.53 -50.77 66.04 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.212 -0.93 . . . . 0.0 110.257 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.493 HG13 HD21 ' A' ' 29' ' ' LEU . 64.2 mt -66.72 -14.42 17.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.269 -0.895 . . . . 0.0 109.955 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.541 ' HD3' ' CZ ' ' A' ' 44' ' ' ARG . 9.8 tttp -73.55 -16.23 61.27 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.379 -0.825 . . . . 0.0 110.253 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.649 ' CB ' ' CD1' ' A' ' 63' ' ' PHE . 5.1 mpt_? -119.06 -58.42 1.94 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.358 -0.839 . . . . 0.0 110.647 -179.6 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.629 ' HE2' ' HA ' ' A' ' 60' ' ' TYR . 3.9 ttm -26.96 90.99 0.05 OUTLIER Pre-proline 0 N--CA 1.499 1.994 0 O-C-N 121.973 -0.454 . . . . 0.0 111.529 -179.663 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.52 ' N ' ' O ' ' A' ' 44' ' ' ARG . 18.1 Cg_endo -67.01 -166.5 0.12 Allowed 'Trans proline' 0 C--N 1.305 -1.728 0 O-C-N 124.141 1.601 . . . . 0.0 110.172 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.453 ' O ' ' O ' ' A' ' 48' ' ' TYR . . . -74.4 134.93 42.39 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.259 -0.901 . . . . 0.0 110.231 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.554 ' CD2' ' HB3' ' A' ' 53' ' ' SER . 0.0 OUTLIER -43.53 168.71 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.34 -0.85 . . . . 0.0 110.6 179.952 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.66 -34.75 4.14 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.244 -0.91 . . . . 0.0 110.09 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -70.97 132.85 22.06 Favored Glycine 0 N--CA 1.49 2.241 0 N-CA-C 109.426 -1.469 . . . . 0.0 109.426 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.76 159.88 43.32 Favored 'Trans proline' 0 C--N 1.304 -1.789 0 O-C-N 123.972 1.511 . . . . 0.0 110.173 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.455 ' O ' ' C ' ' A' ' 53' ' ' SER . . . 98.9 -103.34 2.73 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.554 ' HB3' ' CD2' ' A' ' 48' ' ' TYR . 0.3 OUTLIER 39.19 -156.2 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.285 0 O-C-N 121.505 -0.997 . . . . 0.0 110.663 179.789 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.511 ' N ' ' OG ' ' A' ' 53' ' ' SER . 9.6 m -127.94 -179.69 1.03 Allowed Pre-proline 0 C--N 1.294 -1.831 0 O-C-N 121.593 -0.692 . . . . 0.0 110.322 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -78.43 92.29 1.15 Allowed 'Trans proline' 0 C--N 1.306 -1.706 0 O-C-N 123.998 1.525 . . . . 0.0 110.273 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 121.79 26.27 1.96 Allowed Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -88.02 144.05 26.74 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.213 -1.169 . . . . 0.0 110.205 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.439 ' HB3' ' HG2' ' A' ' 45' ' ' MET . 45.0 mt -130.05 160.15 34.56 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.237 -0.914 . . . . 0.0 109.997 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.486 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.8 OUTLIER -113.38 110.77 20.86 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.086 -1.008 . . . . 0.0 110.706 179.925 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.629 ' HA ' ' HE2' ' A' ' 45' ' ' MET . 18.3 p90 -73.01 -28.12 62.18 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.26 -0.9 . . . . 0.0 109.512 179.283 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.612 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.09 -43.42 78.02 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.445 -0.784 . . . . 0.0 109.881 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.466 ' HB3' ' OD1' ' A' ' 59' ' ' ASP . . . -62.34 -33.3 74.44 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.252 -0.905 . . . . 0.0 109.798 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.649 ' CD1' ' CB ' ' A' ' 44' ' ' ARG . 4.0 t80 -72.12 -34.58 68.7 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.605 -0.684 . . . . 0.0 110.207 179.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.28 -49.67 74.73 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.259 -0.901 . . . . 0.0 110.388 -179.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.463 ' O ' ' N ' ' A' ' 69' ' ' GLY . 22.1 t -58.46 -39.06 78.9 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.178 -0.951 . . . . 0.0 110.293 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.06 -39.76 75.47 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.32 -0.863 . . . . 0.0 110.245 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.632 HD11 ' CZ ' ' A' ' 63' ' ' PHE . 1.8 mt -59.91 -40.04 87.44 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.24 -0.913 . . . . 0.0 110.277 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -98.77 -16.08 19.07 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.238 -0.914 . . . . 0.0 110.252 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.463 ' N ' ' O ' ' A' ' 65' ' ' SER . . . 91.53 172.11 42.71 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.4 -1.48 . . . . 0.0 109.4 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.441 ' O ' ' CB ' ' A' ' 71' ' ' SER . 23.1 tp10 -157.69 -64.16 0.09 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.192 -1.181 . . . . 0.0 110.247 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.441 ' CB ' ' O ' ' A' ' 70' ' ' GLU . 0.3 OUTLIER 65.28 150.34 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.287 -0.883 . . . . 0.0 110.25 -179.991 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -84.55 124.3 31.26 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.301 -0.874 . . . . 0.0 110.199 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.491 1.611 0 O-C-N 121.191 -0.943 . . . . 0.0 110.216 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' B' ' 9' ' ' LYS . . . . . . . . 0 N--CA 1.491 2.308 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.454 ' CB ' ' O ' ' B' ' 7' ' ' GLY . 0.7 OUTLIER 65.77 -64.74 0.19 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.267 -1.137 . . . . 0.0 110.218 179.995 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.497 ' N ' ' O ' ' B' ' 7' ' ' GLY . 1.4 ttpt -62.39 -42.3 99.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.23 -0.919 . . . . 0.0 110.011 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.31 -36.11 75.04 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.265 -0.897 . . . . 0.0 109.911 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.42 -42.16 83.68 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.253 -0.904 . . . . 0.0 109.938 179.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . 0.561 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -62.72 -40.89 98.6 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.299 -0.875 . . . . 0.0 109.445 179.494 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.596 ' O ' HG23 ' B' ' 17' ' ' VAL . 73.7 t -63.36 -40.39 88.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.356 -0.84 . . . . 0.0 109.493 179.307 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.71 -35.82 79.15 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.39 -0.819 . . . . 0.0 110.074 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 2.4 m -70.07 -47.22 62.82 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.214 -0.929 . . . . 0.0 110.319 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.561 HG23 ' O ' ' B' ' 12' ' ' ALA . 23.1 t -62.33 -43.09 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.248 -0.908 . . . . 0.0 110.352 -179.757 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.596 HG23 ' O ' ' B' ' 13' ' ' VAL . 88.1 t -62.08 -51.04 77.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.276 -0.89 . . . . 0.0 110.334 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.68 -40.16 86.89 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.213 -0.929 . . . . 0.0 110.286 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.85 -41.21 97.84 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.201 -0.937 . . . . 0.0 110.196 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.47 HG23 ' O ' ' B' ' 16' ' ' VAL . 71.5 t -66.79 -41.29 87.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.191 -0.943 . . . . 0.0 110.223 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.617 ' O ' HG23 ' B' ' 25' ' ' VAL . 13.6 t70 -64.58 -39.59 94.0 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.273 -0.892 . . . . 0.0 110.307 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -58.44 -47.52 83.7 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.085 -1.009 . . . . 0.0 110.308 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.499 ' HB2' HD22 ' A' ' 67' ' ' LEU . . . -57.3 -40.8 78.6 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.31 -0.869 . . . . 0.0 110.345 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 3.4 mmm-85 -66.19 -40.64 90.56 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.262 -0.899 . . . . 0.0 110.192 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . 0.617 HG23 ' O ' ' B' ' 21' ' ' ASP . 58.7 t -63.05 -21.54 28.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.275 -0.891 . . . . 0.0 110.221 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 4.9 ttt-85 -109.95 22.38 15.7 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.384 -0.823 . . . . 0.0 110.191 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -85.45 120.62 73.3 Favored Pre-proline 0 N--CA 1.493 1.696 0 O-C-N 121.264 -0.897 . . . . 0.0 110.242 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -50.24 175.78 0.04 OUTLIER 'Trans proline' 0 C--N 1.306 -1.687 0 O-C-N 123.969 1.51 . . . . 0.0 110.229 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 3.7 ttt85 . . . . . 0 N--CA 1.492 1.661 0 O-C-N 121.307 -0.871 . . . . 0.0 110.208 -179.935 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 ttt . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.268 0.556 . . . . 0.0 110.233 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -155.21 -47.0 0.08 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.245 -0.909 . . . . 0.0 110.138 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -123.13 175.47 6.62 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.182 -0.949 . . . . 0.0 110.066 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 46.1 p -142.54 120.85 12.31 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.192 -0.942 . . . . 0.0 110.185 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -168.56 -68.97 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.186 -0.946 . . . . 0.0 110.272 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -149.17 -67.01 0.22 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.189 -0.945 . . . . 0.0 110.208 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.504 ' O ' HD12 ' A' ' 11' ' ' ILE . . . -63.55 -50.01 71.19 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.243 -0.91 . . . . 0.0 109.821 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -36.7 65.53 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.392 -0.817 . . . . 0.0 109.942 179.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.1 tp60 -61.61 -37.49 84.12 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.232 -0.917 . . . . 0.0 110.2 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.435 HG12 ' HD2' ' A' ' 14' ' ' PHE . 66.9 t -58.13 -43.49 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.163 -0.961 . . . . 0.0 109.951 179.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.504 HD12 ' O ' ' A' ' 7' ' ' ALA . 2.2 mp -62.77 -48.66 87.05 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.278 -0.889 . . . . 0.0 109.54 179.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.69 -42.31 83.39 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.213 -0.93 . . . . 0.0 109.095 179.184 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.418 ' HA ' ' HB1' ' B' ' 12' ' ' ALA . 4.7 p -66.68 -39.14 88.0 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.394 -0.816 . . . . 0.0 109.046 178.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.541 ' HB3' ' CZ ' ' A' ' 60' ' ' TYR . 1.1 m-85 -68.6 -41.91 78.92 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.374 -0.829 . . . . 0.0 109.522 179.039 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.9 ttt180 -54.12 -44.02 70.97 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.341 -0.849 . . . . 0.0 109.629 179.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.635 HG21 ' HA ' ' B' ' 9' ' ' LYS . 68.3 mt -62.63 -44.93 99.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.409 -0.807 . . . . 0.0 109.859 179.607 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.404 HD23 HD12 ' A' ' 33' ' ' LEU . 6.4 mp -65.0 -34.4 78.36 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.373 -0.829 . . . . 0.0 109.899 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.491 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -81.07 -1.62 44.9 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.32 -0.863 . . . . 0.0 110.162 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.414 ' HB3' ' O ' ' A' ' 18' ' ' ALA . 8.8 t 59.01 74.75 0.43 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.251 -0.905 . . . . 0.0 110.206 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 47.77 62.63 2.37 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.267 -0.896 . . . . 0.0 110.208 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.586 ' HD2' ' CZ ' ' A' ' 23' ' ' TYR . 0.8 OUTLIER -145.96 142.91 18.34 Favored Pre-proline 0 N--CA 1.489 1.493 0 O-C-N 121.239 -0.913 . . . . 0.0 110.144 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -76.37 3.2 6.51 Favored 'Trans proline' 0 C--N 1.303 -1.831 0 O-C-N 124.094 1.576 . . . . 0.0 110.127 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.586 ' CZ ' ' HD2' ' A' ' 21' ' ' LYS . 9.1 p90 -148.91 167.9 24.5 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.224 -0.922 . . . . 0.0 110.228 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.718 HD13 ' H ' ' A' ' 25' ' ' LEU . 0.3 OUTLIER -129.11 145.48 35.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.19 -0.944 . . . . 0.0 110.053 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.718 ' H ' HD13 ' A' ' 24' ' ' ILE . 4.7 mt -89.42 151.18 22.16 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.236 -0.915 . . . . 0.0 110.235 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.82 -39.35 91.49 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.229 -0.92 . . . . 0.0 110.046 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -65.52 -34.9 79.33 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.298 -0.876 . . . . 0.0 110.077 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.454 ' HB3' HD11 ' A' ' 24' ' ' ILE . 12.2 mm-40 -62.07 -46.42 89.17 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.399 -0.813 . . . . 0.0 110.15 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.404 HD21 HG13 ' A' ' 24' ' ' ILE . 21.7 mt -59.86 -35.38 74.67 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.237 -0.914 . . . . 0.0 109.961 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.2 mmm-85 -69.06 -35.74 76.87 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.299 -0.876 . . . . 0.0 110.696 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -90.1 -29.79 18.09 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.149 -0.969 . . . . 0.0 110.71 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.434 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 3.1 mm-40 -91.61 -23.19 19.94 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.107 -0.996 . . . . 0.0 110.57 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.924 HD22 ' HB3' ' A' ' 37' ' ' GLN . 0.3 OUTLIER -128.48 144.95 53.97 Favored Pre-proline 0 N--CA 1.489 1.48 0 O-C-N 121.073 -1.017 . . . . 0.0 110.385 -179.715 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.781 ' HD2' HD23 ' A' ' 33' ' ' LEU . 2.6 Cg_endo -49.01 142.09 20.8 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 O-C-N 124.082 1.57 . . . . 0.0 110.107 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -43.31 -33.56 4.01 Favored 'Trans proline' 0 C--N 1.304 -1.792 0 O-C-N 124.005 1.529 . . . . 0.0 110.611 -179.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -65.38 -47.11 77.52 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.112 -0.992 . . . . 0.0 110.341 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.924 ' HB3' HD22 ' A' ' 33' ' ' LEU . 1.7 mp0 -70.18 -42.1 72.85 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.189 -0.945 . . . . 0.0 110.355 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.28 -42.61 77.74 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.258 -0.901 . . . . 0.0 110.62 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -60.53 -48.55 81.29 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.168 -0.957 . . . . 0.0 110.429 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -63.51 -46.74 84.69 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.162 -0.961 . . . . 0.0 110.471 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 89.0 m -65.3 -41.06 94.47 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.257 -0.902 . . . . 0.0 110.623 -179.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 63.0 mt -67.85 -23.03 28.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.183 -0.948 . . . . 0.0 110.601 -179.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -84.79 -23.54 29.12 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.191 -0.943 . . . . 0.0 110.783 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.502 ' HG2' ' CE1' ' A' ' 63' ' ' PHE . 0.7 OUTLIER -92.49 -56.91 2.85 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.108 -0.995 . . . . 0.0 110.641 -179.544 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.565 ' HE1' ' HB3' ' A' ' 60' ' ' TYR . 0.6 OUTLIER -33.98 103.57 0.23 Allowed Pre-proline 0 N--CA 1.496 1.839 0 O-C-N 121.606 -0.684 . . . . 0.0 111.059 -179.845 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.426 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 32.2 Cg_exo -60.6 -146.3 0.01 OUTLIER 'Trans proline' 0 C--N 1.307 -1.65 0 O-C-N 124.122 1.59 . . . . 0.0 110.359 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.433 ' O ' ' C ' ' A' ' 48' ' ' TYR . . . -99.28 115.14 28.47 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.363 -0.836 . . . . 0.0 110.031 179.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.572 ' CD2' ' HB3' ' A' ' 53' ' ' SER . 23.1 p90 -41.7 156.57 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.391 -0.818 . . . . 0.0 110.343 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -153.42 41.34 0.54 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.305 -0.872 . . . . 0.0 110.077 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -104.89 -164.16 24.09 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -100.16 164.03 0.47 Allowed 'Trans proline' 0 C--N 1.307 -1.648 0 O-C-N 123.993 1.523 . . . . 0.0 110.432 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.484 ' O ' ' O ' ' A' ' 53' ' ' SER . . . 49.39 24.46 5.28 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.575 ' O ' HG13 ' A' ' 54' ' ' VAL . 1.0 OUTLIER -54.92 -160.16 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.3 0 O-C-N 121.342 -1.093 . . . . 0.0 110.657 -179.637 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.739 ' CG2' ' HB2' ' A' ' 57' ' ' ALA . 17.3 m -157.03 -177.29 0.72 Allowed Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.264 -0.898 . . . . 0.0 110.149 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.413 ' HD2' ' HB ' ' A' ' 54' ' ' VAL . 12.4 Cg_endo -89.0 105.33 0.41 Allowed 'Trans proline' 0 C--N 1.305 -1.736 0 O-C-N 124.045 1.55 . . . . 0.0 110.292 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 108.9 19.31 8.69 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.739 ' HB2' ' CG2' ' A' ' 54' ' ' VAL . . . -91.35 140.23 29.97 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.334 -1.097 . . . . 0.0 110.356 -179.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.459 ' HB3' ' HB3' ' A' ' 45' ' ' MET . 15.0 mt -127.86 154.31 45.62 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.331 -0.856 . . . . 0.0 109.871 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.483 ' C ' ' HG3' ' A' ' 45' ' ' MET . 5.5 m-20 -105.23 110.87 23.4 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.105 -0.997 . . . . 0.0 110.552 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.565 ' HB3' ' HE1' ' A' ' 45' ' ' MET . 22.2 p90 -80.42 -21.22 42.43 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.322 -0.861 . . . . 0.0 109.759 179.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.509 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.9 -37.85 69.42 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.372 -0.83 . . . . 0.0 109.808 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.426 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -65.06 -33.75 76.78 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.246 -0.909 . . . . 0.0 109.642 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.502 ' CE1' ' HG2' ' A' ' 44' ' ' ARG . 1.5 t80 -71.91 -35.93 69.83 Favored 'General case' 0 C--N 1.299 -1.597 0 O-C-N 121.553 -0.717 . . . . 0.0 109.874 179.539 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.34 -49.61 76.58 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.279 -0.888 . . . . 0.0 110.074 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 41.8 m -64.3 -36.85 85.44 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.183 -0.948 . . . . 0.0 110.05 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.47 -34.43 72.39 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.297 -0.877 . . . . 0.0 110.024 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.59 HD21 ' HB2' ' B' ' 23' ' ' ALA . 0.2 OUTLIER -61.38 -44.75 96.62 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.285 -0.884 . . . . 0.0 109.955 179.891 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -99.95 3.96 44.67 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.298 -0.876 . . . . 0.0 110.129 179.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.461 ' O ' ' HB3' ' A' ' 70' ' ' GLU . . . -73.82 -135.47 0.31 Allowed Glycine 0 N--CA 1.489 2.207 0 N-CA-C 109.752 -1.339 . . . . 0.0 109.752 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.461 ' HB3' ' O ' ' A' ' 69' ' ' GLY . 9.2 tt0 63.83 69.53 0.54 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.275 -1.132 . . . . 0.0 110.077 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.4 ' OG ' ' N ' ' A' ' 72' ' ' ASP . 1.8 t -167.59 179.13 5.02 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.312 -0.868 . . . . 0.0 110.099 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.4 ' N ' ' OG ' ' A' ' 71' ' ' SER . 13.6 p-10 -101.74 131.72 47.86 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.203 -0.935 . . . . 0.0 110.248 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.638 0 O-C-N 121.228 -0.92 . . . . 0.0 110.275 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.265 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.453 ' O ' ' HG3' ' B' ' 8' ' ' LYS . 5.5 ptpp? -101.54 37.75 1.74 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.237 -1.155 . . . . 0.0 110.264 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.635 ' HA ' HG21 ' A' ' 16' ' ' ILE . 3.4 ttmt -57.66 -49.18 77.34 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.191 -0.943 . . . . 0.0 109.882 179.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.69 -33.84 64.53 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.252 -0.905 . . . . 0.0 109.612 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.66 -40.55 84.51 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.352 -0.843 . . . . 0.0 109.878 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . 0.599 ' HB2' HD12 ' A' ' 16' ' ' ILE . . . -62.66 -42.78 99.8 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.324 -0.86 . . . . 0.0 109.715 179.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.92 ' O ' HG23 ' B' ' 17' ' ' VAL . 70.2 t -59.48 -40.46 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.358 -0.839 . . . . 0.0 109.593 179.464 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.9 -41.41 87.15 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.402 -0.811 . . . . 0.0 109.893 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.11 -44.95 94.21 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.357 -0.839 . . . . 0.0 110.129 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.445 ' O ' HG23 ' B' ' 20' ' ' VAL . 95.6 t -64.31 -42.9 96.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.302 -0.873 . . . . 0.0 109.921 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.92 HG23 ' O ' ' B' ' 13' ' ' VAL . 22.1 t -61.29 -48.21 89.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.311 -0.868 . . . . 0.0 110.025 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.71 -45.87 90.76 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.249 -0.907 . . . . 0.0 109.995 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.01 -45.57 88.35 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.254 -0.904 . . . . 0.0 110.048 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.445 HG23 ' O ' ' B' ' 16' ' ' VAL . 46.9 t -62.6 -43.02 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.156 -0.965 . . . . 0.0 109.887 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.09 -36.85 75.83 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.252 -0.905 . . . . 0.0 109.972 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.63 -44.52 96.07 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.318 -0.864 . . . . 0.0 109.903 179.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.59 ' HB2' HD21 ' A' ' 67' ' ' LEU . . . -63.1 -35.08 79.08 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.308 -0.87 . . . . 0.0 110.258 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 44.3 ttt180 -67.08 -38.74 86.26 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.311 -0.868 . . . . 0.0 110.369 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 23.7 t -78.49 -21.53 13.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.184 -0.948 . . . . 0.0 110.328 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 7.0 ttp180 -103.44 23.27 12.83 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.271 -0.893 . . . . 0.0 110.279 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -97.53 149.83 36.14 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.194 -0.941 . . . . 0.0 110.142 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -97.18 107.2 0.09 OUTLIER 'Trans proline' 0 C--N 1.304 -1.768 0 O-C-N 123.919 1.484 . . . . 0.0 110.391 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 . . . . . 0 N--CA 1.492 1.652 0 O-C-N 121.192 -0.942 . . . . 0.0 110.233 179.972 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 ttp . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.215 0.531 . . . . 0.0 110.176 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -135.3 71.72 1.44 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.241 -0.912 . . . . 0.0 110.285 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -117.7 131.43 56.63 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.245 -0.909 . . . . 0.0 110.132 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 9.8 t -159.39 137.64 10.49 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.225 -0.922 . . . . 0.0 110.349 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -156.43 -79.76 0.08 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.292 -0.88 . . . . 0.0 110.176 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -132.51 -59.27 0.92 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.222 -0.923 . . . . 0.0 110.035 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -66.91 -44.84 79.72 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.307 -0.871 . . . . 0.0 109.681 179.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -54.66 -35.71 63.82 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.426 -0.796 . . . . 0.0 109.789 179.44 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -60.9 -45.33 95.06 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.295 -0.878 . . . . 0.0 109.986 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.518 HG12 ' HD2' ' A' ' 14' ' ' PHE . 61.8 t -63.87 -43.83 97.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.183 -0.948 . . . . 0.0 109.46 179.472 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 86.3 mt -60.67 -45.7 97.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.389 -0.819 . . . . 0.0 109.369 179.293 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.54 -41.67 81.4 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.327 -0.858 . . . . 0.0 108.778 179.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.546 ' HA ' ' HB1' ' B' ' 12' ' ' ALA . 2.6 m -68.03 -39.53 83.1 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 178.687 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.587 ' HB3' ' CZ ' ' A' ' 60' ' ' TYR . 2.6 m-85 -68.47 -41.96 79.41 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.481 -0.762 . . . . 0.0 109.506 179.205 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -53.39 -45.84 69.43 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.298 -0.876 . . . . 0.0 109.436 179.428 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.471 HG21 ' HA ' ' B' ' 9' ' ' LYS . 49.7 mt -62.34 -41.3 91.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.415 -0.803 . . . . 0.0 109.711 179.387 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.404 HD11 HG22 ' B' ' 13' ' ' VAL . 2.2 mp -65.02 -38.58 91.38 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.313 -0.867 . . . . 0.0 110.0 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.515 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -85.5 3.68 39.28 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.311 -0.868 . . . . 0.0 110.334 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.473 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 0.1 OUTLIER 60.6 61.39 1.73 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.248 -0.908 . . . . 0.0 110.379 179.949 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' A' ' 19' ' ' SER . 1.2 m-20 56.13 61.94 2.55 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.218 -0.926 . . . . 0.0 110.439 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.515 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 89.8 mttt -144.84 138.68 14.58 Favored Pre-proline 0 N--CA 1.489 1.494 0 O-C-N 121.287 -0.883 . . . . 0.0 109.733 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -68.3 -3.69 11.36 Favored 'Trans proline' 0 C--N 1.304 -1.8 0 O-C-N 124.008 1.53 . . . . 0.0 110.44 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 18.5 p90 -138.79 156.52 47.28 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.173 -0.954 . . . . 0.0 110.145 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.798 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -128.93 138.19 55.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.259 -0.9 . . . . 0.0 110.235 -179.803 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.798 ' N ' HD13 ' A' ' 24' ' ' ILE . 0.8 OUTLIER -80.54 141.9 34.67 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.277 -0.889 . . . . 0.0 110.41 -179.862 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.21 -40.63 94.71 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.37 -0.831 . . . . 0.0 110.455 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -55.97 -36.78 68.22 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.273 -0.892 . . . . 0.0 110.516 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.413 ' HB3' HD11 ' A' ' 24' ' ' ILE . 1.9 tt0 -67.42 -45.55 75.79 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.198 -0.939 . . . . 0.0 109.888 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.67 ' HG ' HD12 ' A' ' 24' ' ' ILE . 20.4 mt -60.77 -36.68 79.57 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.241 -0.912 . . . . 0.0 109.756 179.697 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.0 tpt180 -62.21 -34.63 76.84 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.33 -0.856 . . . . 0.0 109.643 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 7.4 ttp180 -92.92 -35.91 13.07 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.325 -0.86 . . . . 0.0 110.212 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -77.98 -23.76 48.27 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.334 -0.853 . . . . 0.0 110.744 -179.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.675 HD22 ' HB3' ' A' ' 37' ' ' GLN . 0.2 OUTLIER -125.46 163.5 38.17 Favored Pre-proline 0 N--CA 1.487 1.409 0 O-C-N 121.094 -1.004 . . . . 0.0 110.422 -179.622 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.485 ' HB2' ' OD2' ' A' ' 36' ' ' ASP . 39.6 Cg_exo -64.58 149.58 89.63 Favored 'Trans proline' 0 C--N 1.305 -1.754 0 O-C-N 124.035 1.545 . . . . 0.0 110.101 179.774 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -43.72 -44.85 11.29 Favored 'Trans proline' 0 C--N 1.304 -1.8 0 O-C-N 124.035 1.545 . . . . 0.0 110.418 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.49 ' OD1' ' NE2' ' A' ' 37' ' ' GLN . 3.4 p30 -65.89 -40.06 91.22 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.174 -0.954 . . . . 0.0 110.68 -179.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.675 ' HB3' HD22 ' A' ' 33' ' ' LEU . 76.0 mm-40 -70.07 -38.54 75.77 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.007 -1.058 . . . . 0.0 110.434 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.2 -42.44 93.53 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.162 -0.961 . . . . 0.0 110.363 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.414 ' O ' ' HB2' ' A' ' 43' ' ' LYS . 2.6 tt0 -58.54 -48.98 79.07 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.182 -0.949 . . . . 0.0 110.213 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -66.33 -48.08 71.42 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.242 -0.911 . . . . 0.0 110.17 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 89.6 m -65.39 -43.08 91.78 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.414 -0.804 . . . . 0.0 110.531 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 83.8 mt -71.2 -21.17 21.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.164 -0.96 . . . . 0.0 110.364 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 39' ' ' GLN . 38.5 ttmt -84.31 -43.59 14.64 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.176 -0.952 . . . . 0.0 110.382 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.613 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 1.6 mmp_? -68.83 -62.87 1.2 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.198 -0.939 . . . . 0.0 110.459 -179.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.678 ' HE1' ' HB3' ' A' ' 60' ' ' TYR . 2.3 ttm -30.43 118.1 0.33 Allowed Pre-proline 0 N--CA 1.494 1.768 0 O-C-N 121.853 -0.529 . . . . 0.0 111.336 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.565 ' O ' HD23 ' A' ' 58' ' ' LEU . 9.6 Cg_endo -74.14 -157.56 0.06 OUTLIER 'Trans proline' 0 C--N 1.306 -1.694 0 O-C-N 124.084 1.571 . . . . 0.0 110.321 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.602 ' O ' ' CD1' ' A' ' 48' ' ' TYR . . . -97.15 81.12 3.0 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.277 -0.889 . . . . 0.0 110.497 -179.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.602 ' CD1' ' O ' ' A' ' 47' ' ' ALA . 16.0 p90 36.4 -160.81 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.904 0 CA-C-O 121.456 0.645 . . . . 0.0 111.3 179.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -148.77 11.05 0.84 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.284 -0.885 . . . . 0.0 110.433 -179.74 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -112.24 -164.53 17.01 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.395 -1.482 . . . . 0.0 109.395 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -116.19 18.53 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.65 0 O-C-N 123.84 1.442 . . . . 0.0 110.326 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.479 ' O ' ' O ' ' A' ' 53' ' ' SER . . . -128.1 51.02 0.87 Allowed Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.868 -1.293 . . . . 0.0 109.868 -179.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.479 ' O ' ' O ' ' A' ' 52' ' ' GLY . 0.9 OUTLIER -51.56 -171.5 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.276 0 O-C-N 121.27 -1.135 . . . . 0.0 110.555 -179.89 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.961 HG23 ' HB2' ' A' ' 57' ' ' ALA . 0.0 OUTLIER -156.81 179.39 1.37 Allowed Pre-proline 0 N--CA 1.495 1.79 0 O-C-N 121.587 -0.696 . . . . 0.0 109.775 179.746 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.463 ' HD2' ' HB ' ' A' ' 54' ' ' VAL . 6.6 Cg_endo -59.56 78.53 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.733 0 O-C-N 123.948 1.499 . . . . 0.0 110.489 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.601 ' O ' HD23 ' A' ' 25' ' ' LEU . . . 90.92 92.24 1.3 Allowed Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.95 -1.26 . . . . 0.0 109.95 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.961 ' HB2' HG23 ' A' ' 54' ' ' VAL . . . -148.42 130.26 15.18 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.237 -1.155 . . . . 0.0 110.135 179.781 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.565 HD23 ' O ' ' A' ' 46' ' ' PRO . 1.1 mt -135.54 160.34 38.78 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.245 -0.91 . . . . 0.0 110.29 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.454 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.5 OUTLIER -107.16 111.26 23.6 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.34 -0.85 . . . . 0.0 110.138 179.759 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.678 ' HB3' ' HE1' ' A' ' 45' ' ' MET . 17.9 p90 -72.57 -23.69 61.0 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.286 -0.883 . . . . 0.0 110.081 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.516 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.88 -35.81 66.92 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.251 -0.906 . . . . 0.0 109.787 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.2 -34.26 75.93 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.285 -0.885 . . . . 0.0 109.821 179.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.613 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 12.1 t80 -72.04 -34.81 69.07 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.633 -0.667 . . . . 0.0 110.292 179.761 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.4 m -57.04 -49.72 74.95 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.21 -0.932 . . . . 0.0 110.461 -179.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.502 ' O ' ' N ' ' A' ' 69' ' ' GLY . 1.2 m -57.89 -35.71 71.39 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.171 -0.956 . . . . 0.0 110.614 -179.693 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.17 -46.09 82.24 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.13 -0.981 . . . . 0.0 110.635 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.469 HD21 ' CE1' ' A' ' 63' ' ' PHE . 0.1 OUTLIER -62.08 -43.54 98.61 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.253 -0.904 . . . . 0.0 110.593 -179.695 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -90.29 -16.62 28.93 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.182 -0.948 . . . . 0.0 110.509 -179.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.502 ' N ' ' O ' ' A' ' 65' ' ' SER . . . 112.09 124.27 4.37 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.429 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 10.4 pt-20 -104.61 39.36 1.69 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.266 -1.138 . . . . 0.0 110.243 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.6 t -146.61 170.03 17.77 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.169 -0.957 . . . . 0.0 110.226 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 46.8 t0 -69.42 133.75 48.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.18 -0.95 . . . . 0.0 110.153 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 24.0 mt . . . . . 0 N--CA 1.491 1.59 0 O-C-N 121.261 -0.899 . . . . 0.0 110.223 179.976 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.323 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.93 -39.77 4.71 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.19 -1.183 . . . . 0.0 110.203 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.759 ' O ' HG23 ' B' ' 13' ' ' VAL . 0.0 OUTLIER -70.81 -51.01 29.45 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.206 -0.934 . . . . 0.0 110.027 179.945 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.34 -40.57 71.37 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.258 -0.901 . . . . 0.0 109.943 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -65.63 -40.77 92.92 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.331 -0.856 . . . . 0.0 110.168 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . 0.546 ' HB1' ' HA ' ' A' ' 13' ' ' SER . . . -67.43 -38.01 83.9 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.269 -0.894 . . . . 0.0 110.2 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.759 HG23 ' O ' ' B' ' 9' ' ' LYS . 46.9 t -63.13 -44.14 99.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.328 -0.858 . . . . 0.0 110.152 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.2 -41.84 89.52 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.195 -0.94 . . . . 0.0 110.226 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 28.3 m -63.77 -37.43 87.32 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.317 -0.864 . . . . 0.0 110.234 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.664 ' O ' HG23 ' B' ' 20' ' ' VAL . 88.0 t -68.89 -46.43 79.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.202 -0.936 . . . . 0.0 110.198 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.517 HG23 ' O ' ' B' ' 13' ' ' VAL . 59.3 t -58.74 -43.52 88.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.225 -0.922 . . . . 0.0 110.195 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.97 -44.72 91.88 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.266 -0.897 . . . . 0.0 110.243 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.27 -43.54 94.49 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.196 -0.94 . . . . 0.0 110.22 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.664 HG23 ' O ' ' B' ' 16' ' ' VAL . 61.2 t -66.96 -42.5 88.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.323 -0.861 . . . . 0.0 110.328 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.856 ' O ' HG23 ' B' ' 25' ' ' VAL . 3.1 t0 -60.82 -31.63 71.03 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.252 -0.905 . . . . 0.0 110.376 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -59.24 -51.24 70.83 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.184 -0.948 . . . . 0.0 110.251 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.4 -38.24 87.06 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.245 -0.909 . . . . 0.0 110.148 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.68 -32.38 74.03 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.385 -0.822 . . . . 0.0 110.512 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . 0.856 HG23 ' O ' ' B' ' 21' ' ' ASP . 79.2 t -64.22 -26.36 40.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.213 -0.929 . . . . 0.0 110.586 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 15.0 mmt180 -108.5 28.74 8.06 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.401 -0.812 . . . . 0.0 110.181 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -79.95 124.15 83.27 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.306 -0.871 . . . . 0.0 110.007 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -47.62 -58.45 1.73 Allowed 'Trans proline' 0 C--N 1.307 -1.635 0 O-C-N 123.952 1.501 . . . . 0.0 110.219 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 O-C-N 121.261 -0.9 . . . . 0.0 110.225 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.9 mtp . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.286 0.565 . . . . 0.0 110.114 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.9 176.94 10.29 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.288 -0.882 . . . . 0.0 110.143 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -171.6 101.9 0.19 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.209 -0.932 . . . . 0.0 110.257 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 60.65 109.04 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.279 -0.888 . . . . 0.0 110.252 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -109.96 40.4 1.93 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.289 -0.882 . . . . 0.0 110.204 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.417 HG22 ' CE1' ' A' ' 68' ' ' TYR . 6.6 m -110.64 -67.41 1.0 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.326 -0.859 . . . . 0.0 110.159 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.54 -46.04 84.54 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.249 -0.907 . . . . 0.0 109.71 179.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -57.61 -36.65 72.06 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.402 -0.811 . . . . 0.0 109.879 179.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 37.3 tt0 -61.61 -45.85 92.33 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.263 -0.898 . . . . 0.0 110.115 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.495 HG21 ' HE2' ' A' ' 68' ' ' TYR . 54.1 t -59.47 -42.11 86.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.109 -0.995 . . . . 0.0 109.745 179.675 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 86.8 mt -65.31 -48.12 84.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 121.321 -0.862 . . . . 0.0 109.36 179.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.56 -39.81 77.53 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.282 -0.886 . . . . 0.0 108.792 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.485 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 7.0 m -67.21 -43.92 80.87 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 178.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.532 ' CB ' ' CD1' ' A' ' 60' ' ' TYR . 5.8 m-85 -67.32 -40.71 85.98 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.474 -0.766 . . . . 0.0 109.309 179.044 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.517 ' HG2' ' HA ' ' A' ' 20' ' ' ASP . 17.2 ttt180 -52.93 -40.95 64.01 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.407 -0.808 . . . . 0.0 109.223 179.241 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.412 HG21 ' HA ' ' B' ' 9' ' ' LYS . 49.1 mt -64.55 -43.91 96.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.407 -0.808 . . . . 0.0 110.224 179.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 13' ' ' SER . 15.5 mt -62.96 -41.73 99.62 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.087 -1.008 . . . . 0.0 110.096 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.693 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -83.59 13.31 4.7 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.311 -0.868 . . . . 0.0 110.299 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.429 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 65.69 57.8 0.83 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.21 -0.931 . . . . 0.0 110.28 179.899 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.517 ' HA ' ' HG2' ' A' ' 15' ' ' ARG . 0.6 OUTLIER 55.42 63.29 2.13 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.303 -0.873 . . . . 0.0 110.48 179.858 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -147.34 143.7 18.47 Favored Pre-proline 0 N--CA 1.49 1.565 0 O-C-N 121.202 -0.936 . . . . 0.0 110.034 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.467 ' O ' ' CD1' ' A' ' 23' ' ' TYR . 14.5 Cg_endo -72.89 -1.23 10.14 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 124.153 1.607 . . . . 0.0 110.114 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.666 ' CZ ' ' CE1' ' A' ' 48' ' ' TYR . 10.7 m-85 -130.44 150.06 51.84 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.262 -0.899 . . . . 0.0 109.866 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.693 HG12 ' HB2' ' A' ' 18' ' ' ALA . 0.1 OUTLIER -135.28 145.01 32.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.116 -0.99 . . . . 0.0 110.106 -179.828 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.577 ' N ' HD13 ' A' ' 24' ' ' ILE . 2.1 mp -80.09 153.54 28.67 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.267 -0.896 . . . . 0.0 110.061 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.462 ' O ' ' HB2' ' A' ' 29' ' ' LEU . . . -66.32 -45.37 80.54 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.249 -0.907 . . . . 0.0 110.071 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.84 -36.93 77.84 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.143 -0.973 . . . . 0.0 109.687 179.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.548 ' HB3' HD11 ' A' ' 24' ' ' ILE . 0.9 OUTLIER -58.37 -38.7 77.81 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.294 -0.878 . . . . 0.0 109.183 179.273 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.466 ' HG ' HD12 ' A' ' 24' ' ' ILE . 20.3 mt -61.42 -38.04 85.67 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.42 -0.8 . . . . 0.0 109.571 179.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 14.4 mtp85 -68.27 -34.03 75.45 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.306 -0.871 . . . . 0.0 110.077 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 15.4 ttt-85 -87.17 -21.56 25.85 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.284 -0.885 . . . . 0.0 110.7 -179.66 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 0.5 OUTLIER -99.02 -23.83 15.14 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.048 -1.033 . . . . 0.0 110.646 -179.552 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.791 HD22 ' HB3' ' A' ' 37' ' ' GLN . 3.5 mt -124.01 162.17 42.85 Favored Pre-proline 0 C--N 1.304 -1.39 0 O-C-N 121.11 -0.994 . . . . 0.0 110.196 -179.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.487 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 34.8 Cg_exo -62.72 179.86 0.64 Allowed 'Trans proline' 0 C--N 1.304 -1.768 0 O-C-N 123.918 1.483 . . . . 0.0 109.889 179.418 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.487 ' HD2' ' HB3' ' A' ' 34' ' ' PRO . 19.0 Cg_endo -63.99 -49.26 4.07 Favored 'Trans proline' 0 C--N 1.304 -1.772 0 O-C-N 123.941 1.495 . . . . 0.0 110.35 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -66.01 -40.94 91.55 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.292 -0.88 . . . . 0.0 110.863 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.791 ' HB3' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -69.65 -40.9 76.2 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.07 -1.019 . . . . 0.0 110.564 -179.5 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.45 -40.74 89.61 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.151 -0.968 . . . . 0.0 110.353 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -66.08 -48.87 69.56 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.187 -0.946 . . . . 0.0 110.509 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -62.08 -45.58 92.88 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.237 -0.914 . . . . 0.0 110.593 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 68.7 m -60.74 -44.33 96.8 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.149 -0.969 . . . . 0.0 110.514 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 72.3 mt -61.17 -32.84 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.169 -0.957 . . . . 0.0 110.404 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -76.44 -24.49 53.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.136 -0.978 . . . . 0.0 110.346 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.639 ' CD ' ' CE1' ' A' ' 63' ' ' PHE . 0.1 OUTLIER -84.07 -61.79 1.73 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.207 -0.933 . . . . 0.0 110.142 179.987 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.519 ' HE2' ' HA ' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -34.39 103.46 0.23 Allowed Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.672 -0.642 . . . . 0.0 111.241 179.89 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -60.91 -155.48 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.725 0 O-C-N 123.889 1.468 . . . . 0.0 109.683 179.361 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -101.44 123.75 46.01 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.098 -1.001 . . . . 0.0 110.368 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.666 ' CE1' ' CZ ' ' A' ' 23' ' ' TYR . 3.0 t80 -56.46 -83.12 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.273 -0.892 . . . . 0.0 110.153 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.407 ' N ' ' CG ' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -136.4 146.84 46.91 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.286 -0.884 . . . . 0.0 110.237 179.929 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -77.13 -56.98 3.82 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -97.4 128.58 0.27 Allowed 'Trans proline' 0 C--N 1.306 -1.709 0 O-C-N 123.977 1.514 . . . . 0.0 110.344 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.483 ' O ' ' O ' ' A' ' 53' ' ' SER . . . 116.07 -69.65 0.27 Allowed Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.514 ' HB3' ' CD2' ' A' ' 48' ' ' TYR . 93.4 p -55.51 -157.53 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.328 0 O-C-N 121.41 -1.053 . . . . 0.0 110.734 -179.545 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.434 ' HB ' ' HD2' ' A' ' 55' ' ' PRO . 16.6 m -134.7 173.03 6.27 Favored Pre-proline 0 N--CA 1.491 1.592 0 O-C-N 121.204 -0.935 . . . . 0.0 110.208 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.434 ' HD2' ' HB ' ' A' ' 54' ' ' VAL . 19.6 Cg_endo -76.25 55.71 4.7 Favored 'Trans proline' 0 C--N 1.304 -1.782 0 O-C-N 124.033 1.544 . . . . 0.0 110.178 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 174.74 35.68 0.04 OUTLIER Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -131.57 111.11 11.46 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.205 -1.173 . . . . 0.0 110.204 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.479 ' HB3' ' HB3' ' A' ' 45' ' ' MET . 54.5 mt -114.57 159.77 20.04 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.322 -0.861 . . . . 0.0 110.198 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.478 ' C ' ' HG3' ' A' ' 45' ' ' MET . 13.5 p30 -110.34 111.09 22.15 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.253 -0.905 . . . . 0.0 110.468 179.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.572 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 24.8 p90 -74.8 -27.35 60.27 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.169 -0.957 . . . . 0.0 109.268 179.435 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.572 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.12 -44.74 79.43 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.446 -0.784 . . . . 0.0 109.591 179.616 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.48 -32.83 72.85 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.254 -0.904 . . . . 0.0 109.472 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.639 ' CE1' ' CD ' ' A' ' 44' ' ' ARG . 1.1 t80 -71.67 -40.34 69.69 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.626 -0.671 . . . . 0.0 109.983 179.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 21.0 p -58.92 -45.14 91.07 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.295 -0.878 . . . . 0.0 110.23 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 16.3 t -60.51 -39.69 88.69 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.276 -0.89 . . . . 0.0 110.219 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.26 -40.7 51.22 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.215 -0.928 . . . . 0.0 110.104 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.692 ' O ' HD12 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -66.48 -45.55 79.31 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.274 -0.891 . . . . 0.0 109.68 179.821 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.507 ' N ' ' HG ' ' A' ' 67' ' ' LEU . 3.9 m-85 -94.47 6.47 48.67 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.632 -0.668 . . . . 0.0 110.223 -179.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -142.78 105.84 0.41 Allowed Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -124.96 65.77 1.12 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.29 -1.124 . . . . 0.0 110.218 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.4 t -126.39 -64.66 1.02 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.293 -0.879 . . . . 0.0 110.219 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -96.37 135.23 38.52 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.274 -0.891 . . . . 0.0 110.193 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.469 ' HA ' HD22 ' A' ' 73' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.64 0 O-C-N 121.205 -0.934 . . . . 0.0 110.209 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' GLY . . . . . 0.519 ' O ' ' CB ' ' B' ' 8' ' ' LYS . . . . . . . . 0 N--CA 1.49 2.262 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.519 ' CB ' ' O ' ' B' ' 7' ' ' GLY . 33.3 tttt 73.78 -48.07 0.66 Allowed 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.405 -1.056 . . . . 0.0 110.767 -179.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.69 ' O ' HG23 ' B' ' 13' ' ' VAL . 7.2 ttmt -57.02 -33.85 67.59 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.038 -1.038 . . . . 0.0 110.037 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.38 -38.65 88.0 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.269 -0.894 . . . . 0.0 109.664 179.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -65.39 -42.1 93.0 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.296 -0.877 . . . . 0.0 109.807 179.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . 0.401 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -63.16 -33.05 74.63 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.35 -0.844 . . . . 0.0 109.888 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.69 HG23 ' O ' ' B' ' 9' ' ' LYS . 87.8 t -65.72 -42.29 92.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.287 -0.883 . . . . 0.0 110.135 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.71 -39.56 81.17 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.23 -0.919 . . . . 0.0 110.245 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.5 m -65.97 -43.74 87.01 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.301 -0.874 . . . . 0.0 110.193 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.658 ' O ' HG23 ' B' ' 20' ' ' VAL . 67.9 t -64.93 -43.22 96.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.246 -0.909 . . . . 0.0 110.06 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.728 HG22 ' HG2' ' A' ' 37' ' ' GLN . 43.6 t -58.58 -50.44 78.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.288 -0.883 . . . . 0.0 110.039 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.8 -46.69 88.44 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.251 -0.905 . . . . 0.0 109.822 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.78 -45.96 87.4 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.342 -0.849 . . . . 0.0 109.901 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.658 HG23 ' O ' ' B' ' 16' ' ' VAL . 75.3 t -63.26 -44.14 99.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.278 -0.889 . . . . 0.0 109.642 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -59.61 -40.25 86.91 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.399 -0.813 . . . . 0.0 109.708 179.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -54.21 -40.13 67.34 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.231 -0.918 . . . . 0.0 109.532 179.539 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.504 ' HB2' HD13 ' A' ' 67' ' ' LEU . . . -60.04 -39.39 85.77 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.344 -0.847 . . . . 0.0 109.627 179.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 6.9 ttm-85 -60.26 -45.12 94.37 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.261 -0.899 . . . . 0.0 109.69 179.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 64.9 t -70.54 -21.14 22.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.384 -0.822 . . . . 0.0 109.781 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.484 ' O ' ' HD3' ' B' ' 28' ' ' PRO . 28.3 ttm-85 56.87 47.02 18.68 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.442 -0.786 . . . . 0.0 110.278 179.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -81.18 107.76 8.61 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.252 -0.905 . . . . 0.0 110.008 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . 0.484 ' HD3' ' O ' ' B' ' 26' ' ' ARG . 43.5 Cg_endo -72.22 -59.97 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.712 0 O-C-N 123.945 1.497 . . . . 0.0 110.409 -179.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 3.7 tpt180 . . . . . 0 N--CA 1.489 1.522 0 O-C-N 121.249 -0.907 . . . . 0.0 110.175 -179.899 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 121.26 0.553 . . . . 0.0 110.236 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 46.51 84.79 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.26 -0.9 . . . . 0.0 110.316 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -154.45 -162.37 1.39 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.222 -0.924 . . . . 0.0 110.226 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.426 ' CG2' ' HB3' ' A' ' 7' ' ' ALA . 8.0 t -50.3 176.55 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.203 -0.936 . . . . 0.0 110.177 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -107.45 -32.26 7.8 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.191 -0.943 . . . . 0.0 110.28 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.643 HG22 ' CE2' ' A' ' 68' ' ' TYR . 3.6 m -61.49 -50.91 70.85 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.247 -0.908 . . . . 0.0 110.15 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.426 ' HB3' ' CG2' ' A' ' 4' ' ' THR . . . -69.99 -45.2 67.8 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.253 -0.904 . . . . 0.0 109.864 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -54.78 -37.07 65.58 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.34 -0.85 . . . . 0.0 109.806 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.0 tp60 -61.98 -45.0 95.55 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.306 -0.871 . . . . 0.0 110.0 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.826 HG12 ' CD2' ' A' ' 14' ' ' PHE . 17.3 t -60.36 -45.14 96.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.238 -0.914 . . . . 0.0 109.947 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 69.2 mt -59.4 -49.65 82.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.319 -0.863 . . . . 0.0 109.911 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.97 -47.91 81.54 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.186 -0.947 . . . . 0.0 109.343 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.41 ' HB2' HG23 ' B' ' 16' ' ' VAL . 2.0 p -65.42 -36.06 82.8 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.336 -0.852 . . . . 0.0 109.201 179.161 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.826 ' CD2' HG12 ' A' ' 10' ' ' VAL . 1.0 OUTLIER -68.29 -43.99 76.46 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.431 -0.793 . . . . 0.0 109.323 179.308 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.2 ttt180 -53.53 -48.44 69.04 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.391 -0.818 . . . . 0.0 108.974 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.523 HG21 ' HA ' ' B' ' 9' ' ' LYS . 50.7 mt -58.93 -43.42 88.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.412 -0.805 . . . . 0.0 109.566 179.195 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.1 mp -64.94 -36.05 83.13 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.324 -0.86 . . . . 0.0 110.033 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.641 ' HB1' ' O ' ' A' ' 23' ' ' TYR . . . -81.04 0.78 34.29 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.311 -0.868 . . . . 0.0 110.149 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.459 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 3.3 t 65.28 76.14 0.34 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.259 -0.901 . . . . 0.0 110.172 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.409 ' C ' ' O ' ' A' ' 19' ' ' SER . 10.4 t70 42.85 56.34 4.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.284 -0.885 . . . . 0.0 110.298 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.459 ' HG3' ' O ' ' A' ' 19' ' ' SER . 9.5 mttm -143.94 143.85 24.43 Favored Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.225 -0.922 . . . . 0.0 110.116 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.464 ' O ' ' CD1' ' A' ' 23' ' ' TYR . 19.2 Cg_endo -76.27 3.36 6.32 Favored 'Trans proline' 0 C--N 1.304 -1.795 0 O-C-N 124.049 1.552 . . . . 0.0 110.182 179.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.641 ' O ' ' HB1' ' A' ' 18' ' ' ALA . 47.7 m-85 -141.91 165.84 26.37 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.305 -0.872 . . . . 0.0 110.429 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.57 HD13 ' HB3' ' A' ' 28' ' ' GLU . 0.3 OUTLIER -132.48 146.32 33.1 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.376 -0.827 . . . . 0.0 109.841 179.932 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.496 ' N ' HD13 ' A' ' 24' ' ' ILE . 49.2 mt -92.33 155.64 17.79 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.164 -0.96 . . . . 0.0 110.344 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.574 ' HA ' HD21 ' A' ' 29' ' ' LEU . . . -63.07 -38.97 93.32 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.35 -0.844 . . . . 0.0 110.056 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.05 -33.99 70.81 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.226 -0.921 . . . . 0.0 109.705 179.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.57 ' HB3' HD13 ' A' ' 24' ' ' ILE . 19.9 tt0 -62.9 -51.27 67.62 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.357 -0.839 . . . . 0.0 110.227 -179.563 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.64 HD13 ' HA ' ' A' ' 38' ' ' ALA . 4.0 pp -67.8 -33.28 74.49 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.01 -1.056 . . . . 0.0 109.221 179.132 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.494 ' N ' HD12 ' A' ' 29' ' ' LEU . 0.0 OUTLIER -65.55 -33.91 77.02 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.233 -0.917 . . . . 0.0 110.539 179.908 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -89.73 -15.1 33.22 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.062 -1.023 . . . . 0.0 111.395 -179.147 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.538 ' HG2' ' HA ' ' A' ' 29' ' ' LEU . 12.1 pt-20 -108.79 -24.32 11.35 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.797 -1.19 . . . . 0.0 111.329 -179.339 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.637 HD22 ' HB3' ' A' ' 37' ' ' GLN . 0.5 OUTLIER -110.1 146.32 33.95 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 120.944 -1.098 . . . . 0.0 110.173 -179.929 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.428 ' O ' ' C ' ' A' ' 35' ' ' PRO . 47.8 Cg_exo -48.17 140.75 19.2 Favored 'Trans proline' 0 C--N 1.305 -1.719 0 O-C-N 123.934 1.491 . . . . 0.0 110.194 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.428 ' C ' ' O ' ' A' ' 34' ' ' PRO . 29.8 Cg_endo -41.12 -38.15 3.07 Favored 'Trans proline' 0 C--N 1.304 -1.804 0 O-C-N 124.062 1.559 . . . . 0.0 110.263 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -65.74 -44.16 86.79 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.308 -0.87 . . . . 0.0 110.441 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.637 ' HB3' HD22 ' A' ' 33' ' ' LEU . 62.6 mm-40 -68.95 -42.19 77.02 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.197 -0.939 . . . . 0.0 110.26 -179.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.64 ' HA ' HD13 ' A' ' 29' ' ' LEU . . . -56.25 -43.4 78.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.23 -0.919 . . . . 0.0 110.248 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -65.9 -44.75 84.3 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.24 -0.912 . . . . 0.0 110.148 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.09 -47.81 78.6 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.233 -0.917 . . . . 0.0 110.009 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.489 ' O ' ' HG2' ' A' ' 45' ' ' MET . 60.9 m -65.84 -51.0 62.57 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.453 -0.779 . . . . 0.0 111.082 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.637 HD11 HD11 ' A' ' 29' ' ' LEU . 44.3 mt -50.84 -28.49 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 O-C-N 121.208 -0.932 . . . . 0.0 110.675 -179.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 6.1 tttt -85.81 -27.14 25.33 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.218 -0.926 . . . . 0.0 110.693 -179.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.583 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 13.8 mmt180 -76.72 -71.63 0.39 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.245 -0.909 . . . . 0.0 110.801 -179.452 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.548 ' HE2' ' CA ' ' A' ' 60' ' ' TYR . 12.0 ptp -57.33 122.48 55.0 Favored Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 121.173 -0.954 . . . . 0.0 110.498 -179.636 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.404 ' O ' HD23 ' A' ' 58' ' ' LEU . 18.7 Cg_endo -75.5 -158.61 0.08 OUTLIER 'Trans proline' 0 C--N 1.307 -1.657 0 O-C-N 123.95 1.5 . . . . 0.0 110.199 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.471 ' O ' ' N ' ' A' ' 49' ' ' SER . . . -90.47 134.1 34.58 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.186 -0.947 . . . . 0.0 110.274 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.547 ' CE1' ' CZ ' ' A' ' 23' ' ' TYR . 3.7 t80 -61.88 79.35 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.279 -0.888 . . . . 0.0 110.272 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.471 ' N ' ' O ' ' A' ' 47' ' ' ALA . 33.5 p -67.26 176.87 2.05 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.228 -0.92 . . . . 0.0 110.251 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 156.06 -148.06 17.59 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -85.05 -20.35 3.51 Favored 'Trans proline' 0 C--N 1.304 -1.767 0 O-C-N 124.021 1.537 . . . . 0.0 110.237 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -148.42 -70.14 0.01 OUTLIER Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.422 -1.471 . . . . 0.0 109.422 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.403 ' OG ' ' N ' ' A' ' 54' ' ' VAL . 10.0 t 53.7 -178.59 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.186 -1.185 . . . . 0.0 110.081 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.403 ' N ' ' OG ' ' A' ' 53' ' ' SER . 21.6 m -140.33 175.96 2.82 Favored Pre-proline 0 C--N 1.296 -1.745 0 O-C-N 121.716 -0.615 . . . . 0.0 110.09 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -86.64 118.94 1.58 Allowed 'Trans proline' 0 C--N 1.305 -1.741 0 O-C-N 123.949 1.5 . . . . 0.0 110.272 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 120.58 -20.26 8.87 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -77.01 122.27 24.68 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.318 -1.107 . . . . 0.0 110.179 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.429 ' HB3' ' HG3' ' A' ' 45' ' ' MET . 70.8 mt -118.99 156.89 28.81 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.278 -0.889 . . . . 0.0 110.33 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.404 ' O ' ' HB2' ' A' ' 45' ' ' MET . 0.7 OUTLIER -107.81 113.29 26.42 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.278 -0.888 . . . . 0.0 110.212 -179.964 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.548 ' CA ' ' HE2' ' A' ' 45' ' ' MET . 26.0 p90 -83.78 -23.29 31.57 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.214 -0.929 . . . . 0.0 110.339 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.482 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.02 -41.46 74.99 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.119 -0.988 . . . . 0.0 109.508 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.51 -32.42 73.77 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.321 -0.862 . . . . 0.0 109.612 179.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.583 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 5.3 t80 -69.65 -33.09 72.12 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 121.62 -0.675 . . . . 0.0 110.252 179.725 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.447 ' O ' ' HB2' ' A' ' 68' ' ' TYR . 5.8 p -63.92 -50.05 70.21 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.222 -0.924 . . . . 0.0 110.154 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.492 ' O ' ' N ' ' A' ' 69' ' ' GLY . 25.8 t -68.8 -35.39 76.96 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.203 -0.936 . . . . 0.0 110.108 179.839 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.18 -46.17 68.17 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.333 -0.854 . . . . 0.0 110.512 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.678 HD12 ' C ' ' A' ' 67' ' ' LEU . 0.3 OUTLIER -69.33 -38.19 78.06 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.1 -1.0 . . . . 0.0 110.112 -179.84 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.643 ' CE2' HG22 ' A' ' 6' ' ' THR . 2.4 m-85 -96.84 2.9 52.33 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.484 -0.76 . . . . 0.0 110.248 179.721 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 65' ' ' SER . . . -76.12 -166.14 21.17 Favored Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.675 -1.37 . . . . 0.0 109.675 -179.8 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -136.46 -44.32 0.61 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.359 -1.083 . . . . 0.0 110.289 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.92 115.56 15.75 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.205 -0.934 . . . . 0.0 110.308 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -69.89 110.33 4.95 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.271 -0.893 . . . . 0.0 110.248 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 14.7 tp . . . . . 0 N--CA 1.492 1.646 0 O-C-N 121.2 -0.937 . . . . 0.0 110.162 179.927 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 7' ' ' GLY . . . . . 0.449 ' C ' ' CD ' ' B' ' 8' ' ' LYS . . . . . . . . 0 N--CA 1.49 2.268 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.52 ' HG2' ' N ' ' B' ' 9' ' ' LYS . 0.0 OUTLIER -177.77 -29.64 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.279 -1.13 . . . . 0.0 110.408 179.824 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.523 ' HA ' HG21 ' A' ' 16' ' ' ILE . 0.7 OUTLIER -57.61 -51.1 70.87 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.008 -1.058 . . . . 0.0 109.834 179.914 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.11 -33.98 67.89 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.252 -0.905 . . . . 0.0 109.581 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -68.7 -40.75 79.85 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.406 -0.809 . . . . 0.0 109.809 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.04 -35.87 81.69 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.344 -0.847 . . . . 0.0 109.983 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.487 HG23 ' O ' ' B' ' 9' ' ' LYS . 57.8 t -61.62 -43.4 96.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.359 -0.838 . . . . 0.0 110.043 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.87 -35.57 75.08 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.236 -0.915 . . . . 0.0 110.131 179.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 17.0 m -68.16 -48.6 64.86 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.271 -0.893 . . . . 0.0 109.956 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.41 HG23 ' HB2' ' A' ' 13' ' ' SER . 74.1 t -61.22 -44.32 98.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.237 -0.914 . . . . 0.0 110.13 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.537 HG22 ' HG3' ' A' ' 37' ' ' GLN . 44.1 t -58.46 -48.07 86.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.227 -0.921 . . . . 0.0 110.05 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.3 -39.81 88.24 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.348 -0.845 . . . . 0.0 110.134 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.54 -44.29 82.82 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.274 -0.891 . . . . 0.0 110.006 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.449 ' HB ' ' OE1' ' A' ' 37' ' ' GLN . 77.5 t -63.79 -47.49 90.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.21 -0.931 . . . . 0.0 110.138 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.499 ' O ' HG23 ' B' ' 25' ' ' VAL . 4.1 t70 -55.2 -38.05 67.88 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.18 -0.95 . . . . 0.0 109.636 179.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -63.38 -36.88 85.19 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.395 -0.816 . . . . 0.0 109.953 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.554 ' HB1' HH21 ' A' ' 44' ' ' ARG . . . -64.76 -39.48 93.68 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.305 -0.872 . . . . 0.0 110.3 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . 0.441 ' CG ' ' N ' ' B' ' 25' ' ' VAL . 0.5 OUTLIER -62.33 -44.92 95.36 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.257 -0.902 . . . . 0.0 109.845 -179.96 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . 0.499 HG23 ' O ' ' B' ' 21' ' ' ASP . 13.6 t -65.99 -24.51 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.256 -0.902 . . . . 0.0 110.039 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.05 16.41 11.29 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.514 -0.741 . . . . 0.0 109.584 179.609 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . 0.415 ' HB3' ' O ' ' B' ' 24' ' ' ARG . 17.8 tt0 -105.3 143.56 27.02 Favored Pre-proline 0 N--CA 1.491 1.583 0 O-C-N 121.407 -0.808 . . . . 0.0 110.472 -179.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -80.13 99.75 1.2 Allowed 'Trans proline' 0 C--N 1.306 -1.709 0 O-C-N 124.069 1.563 . . . . 0.0 110.295 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 54.6 ttm-85 . . . . . 0 N--CA 1.492 1.635 0 O-C-N 121.183 -0.948 . . . . 0.0 110.16 179.969 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 ptt? . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.244 0.545 . . . . 0.0 110.189 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -109.32 -77.19 0.6 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.231 -0.918 . . . . 0.0 110.17 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.415 ' O ' ' HG2' ' A' ' 8' ' ' GLU . 1.7 p30 -168.83 -160.41 0.28 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.287 -0.883 . . . . 0.0 110.117 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -131.08 127.47 38.24 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.21 -0.931 . . . . 0.0 110.135 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -172.16 169.91 5.35 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.221 -0.924 . . . . 0.0 110.193 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.608 ' CG2' ' CE1' ' A' ' 68' ' ' TYR . 2.9 m -55.57 -51.33 67.48 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.26 -0.9 . . . . 0.0 110.09 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -69.84 -44.31 70.15 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.205 -0.934 . . . . 0.0 109.774 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 3' ' ' ASP . 19.7 tp10 -54.98 -36.41 65.35 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.371 -0.831 . . . . 0.0 109.697 179.583 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.402 ' O ' ' OG ' ' A' ' 13' ' ' SER . 1.1 tp60 -61.25 -44.83 96.61 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.295 -0.878 . . . . 0.0 109.858 179.89 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 59.2 t -58.38 -41.22 80.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.244 -0.91 . . . . 0.0 109.549 179.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.578 HG23 ' HE1' ' A' ' 60' ' ' TYR . 69.2 mt -66.71 -43.91 89.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.419 -0.801 . . . . 0.0 109.492 179.295 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.59 -43.27 84.5 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.276 -0.89 . . . . 0.0 108.861 179.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.447 ' O ' HD23 ' A' ' 17' ' ' LEU . 0.1 OUTLIER -66.74 -38.66 87.1 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 178.71 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.565 ' HB3' ' CE2' ' A' ' 60' ' ' TYR . 1.2 m-85 -68.38 -42.28 79.36 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.491 -0.755 . . . . 0.0 109.437 179.124 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.77 -43.37 72.73 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.296 -0.878 . . . . 0.0 109.399 179.303 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.429 ' CD1' ' HB2' ' B' ' 12' ' ' ALA . 80.9 mt -63.79 -44.83 98.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.314 -0.866 . . . . 0.0 109.624 179.402 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.495 HD13 ' HA ' ' A' ' 17' ' ' LEU . 3.2 mm? -63.31 -34.75 78.36 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.32 -0.863 . . . . 0.0 109.735 179.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.731 ' HB1' ' O ' ' A' ' 23' ' ' TYR . . . -79.92 2.44 23.43 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.375 -0.828 . . . . 0.0 110.112 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.482 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 4.3 t 60.27 80.3 0.21 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.282 -0.886 . . . . 0.0 110.113 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.482 ' O ' ' HG2' ' A' ' 21' ' ' LYS . 6.3 m-20 45.31 59.33 3.6 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.346 -0.846 . . . . 0.0 110.438 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.482 ' HG2' ' O ' ' A' ' 20' ' ' ASP . 18.4 mttp -153.5 141.72 14.01 Favored Pre-proline 0 N--CA 1.489 1.502 0 O-C-N 121.25 -0.906 . . . . 0.0 110.047 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.512 ' HG2' ' CE2' ' A' ' 23' ' ' TYR . 23.4 Cg_endo -78.36 6.25 4.89 Favored 'Trans proline' 0 C--N 1.303 -1.824 0 O-C-N 124.172 1.617 . . . . 0.0 110.232 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.731 ' O ' ' HB1' ' A' ' 18' ' ' ALA . 22.1 m-85 -135.91 166.16 23.97 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.277 -0.889 . . . . 0.0 110.107 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.64 HD13 ' H ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -138.45 140.58 39.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.137 -0.977 . . . . 0.0 110.062 -179.945 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.64 ' H ' HD13 ' A' ' 24' ' ' ILE . 4.4 mp -83.55 154.45 23.81 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.174 -0.953 . . . . 0.0 110.019 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.83 -45.28 71.57 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.254 -0.904 . . . . 0.0 110.304 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -56.54 -39.69 73.84 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.268 -0.895 . . . . 0.0 109.937 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -59.26 -41.62 89.26 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.327 -0.858 . . . . 0.0 109.199 179.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 1.037 HD13 HD12 ' A' ' 33' ' ' LEU . 2.0 mm? -61.52 -33.82 74.47 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.53 -0.731 . . . . 0.0 109.417 179.265 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 14.8 mmm-85 -68.91 -34.38 75.31 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.381 -0.824 . . . . 0.0 110.322 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.2 -25.45 15.29 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.146 -0.971 . . . . 0.0 111.413 -179.139 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.482 ' HB3' HD12 ' A' ' 17' ' ' LEU . 12.3 mm-40 -91.64 -23.59 19.79 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 120.925 -1.109 . . . . 0.0 111.449 -178.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 1.037 HD12 HD13 ' A' ' 29' ' ' LEU . 7.8 mt -123.85 163.64 33.93 Favored Pre-proline 0 N--CA 1.487 1.392 0 O-C-N 120.847 -1.158 . . . . 0.0 110.734 -179.297 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.518 ' HD3' HD23 ' A' ' 33' ' ' LEU . 21.7 Cg_exo -61.52 139.33 81.2 Favored 'Trans proline' 0 C--N 1.306 -1.69 0 O-C-N 124.114 1.586 . . . . 0.0 110.003 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.431 ' C ' ' O ' ' A' ' 34' ' ' PRO . 31.7 Cg_endo -39.98 -41.65 3.03 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 O-C-N 124.065 1.561 . . . . 0.0 110.511 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -66.0 -37.58 86.31 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.283 -0.885 . . . . 0.0 111.081 -179.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.875 ' OE1' HG22 ' B' ' 17' ' ' VAL . 0.1 OUTLIER -69.64 -42.16 74.62 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.928 -1.107 . . . . 0.0 110.42 -179.562 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.489 ' O ' HG12 ' A' ' 42' ' ' ILE . . . -56.01 -48.3 76.17 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.179 -0.951 . . . . 0.0 110.288 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -56.11 -48.83 75.43 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.086 -1.009 . . . . 0.0 110.469 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -62.56 -48.12 80.88 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.152 -0.968 . . . . 0.0 110.101 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 56.6 m -65.26 -47.29 77.25 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.255 -0.903 . . . . 0.0 110.046 179.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.489 HG12 ' O ' ' A' ' 38' ' ' ALA . 16.2 mm -57.41 -22.88 18.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.389 -0.819 . . . . 0.0 110.109 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 26.1 tttt -84.47 -24.14 29.6 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.284 -0.885 . . . . 0.0 110.385 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.603 ' HB3' ' CG ' ' A' ' 63' ' ' PHE . 10.6 mmt180 -93.65 -67.92 0.83 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.246 -0.909 . . . . 0.0 110.275 -179.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.505 ' HE1' ' HB3' ' A' ' 60' ' ' TYR . 2.0 ttm -36.62 105.44 0.3 Allowed Pre-proline 0 N--CA 1.493 1.721 0 O-C-N 121.598 -0.689 . . . . 0.0 111.001 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.458 ' HD2' ' OD1' ' A' ' 59' ' ' ASP . 37.6 Cg_exo -71.57 -158.79 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.729 0 O-C-N 124.03 1.542 . . . . 0.0 109.785 179.453 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -99.86 124.96 45.71 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.083 -1.011 . . . . 0.0 110.25 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -63.11 137.29 58.19 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.284 -0.885 . . . . 0.0 110.064 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 19.9 p -127.72 105.96 8.81 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.246 -0.909 . . . . 0.0 110.13 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -130.74 -122.68 2.43 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.632 -1.387 . . . . 0.0 109.632 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -97.08 19.18 0.48 Allowed 'Trans proline' 0 C--N 1.305 -1.757 0 O-C-N 123.97 1.511 . . . . 0.0 110.243 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 147.93 -37.37 1.1 Allowed Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.401 ' OG ' ' N ' ' A' ' 54' ' ' VAL . 9.6 t 52.87 -179.65 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.308 0 O-C-N 121.255 -1.144 . . . . 0.0 110.179 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 1.024 ' CG2' ' HB2' ' A' ' 57' ' ' ALA . 32.7 m -108.75 165.32 12.89 Favored Pre-proline 0 C--N 1.294 -1.808 0 O-C-N 121.71 -0.619 . . . . 0.0 110.151 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -74.61 80.86 2.22 Favored 'Trans proline' 0 C--N 1.304 -1.784 0 O-C-N 123.989 1.521 . . . . 0.0 110.208 -179.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 127.28 39.23 0.38 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 1.024 ' HB2' ' CG2' ' A' ' 54' ' ' VAL . . . -111.57 115.68 29.58 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.124 -1.221 . . . . 0.0 110.275 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.409 ' HB3' ' HB3' ' A' ' 45' ' ' MET . 1.1 mt -111.62 157.75 20.05 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.226 -0.921 . . . . 0.0 110.181 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.475 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.7 OUTLIER -110.52 111.44 22.69 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.125 -0.984 . . . . 0.0 110.397 179.738 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.578 ' HE1' HG23 ' A' ' 11' ' ' ILE . 22.7 p90 -73.66 -24.82 60.03 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.217 -0.927 . . . . 0.0 109.182 179.362 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.547 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.65 -42.68 79.36 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.465 -0.772 . . . . 0.0 109.765 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.45 -40.3 86.39 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.298 -0.876 . . . . 0.0 109.874 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.603 ' CG ' ' HB3' ' A' ' 44' ' ' ARG . 1.7 t80 -71.97 -35.17 69.46 Favored 'General case' 0 C--N 1.298 -1.666 0 O-C-N 121.591 -0.693 . . . . 0.0 110.384 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 70.3 m -58.37 -43.48 88.46 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.21 -0.931 . . . . 0.0 110.465 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.468 ' O ' ' N ' ' A' ' 69' ' ' GLY . 0.3 OUTLIER -61.28 -40.69 95.05 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.173 -0.954 . . . . 0.0 110.272 -179.855 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.61 -31.94 67.46 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.281 -0.887 . . . . 0.0 110.452 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.722 HD21 ' HB2' ' B' ' 23' ' ' ALA . 0.5 OUTLIER -64.67 -44.41 90.48 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.109 -0.994 . . . . 0.0 110.386 -179.825 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.608 ' CE1' ' CG2' ' A' ' 6' ' ' THR . 28.4 m-85 -99.54 -25.98 14.25 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.198 -0.939 . . . . 0.0 110.27 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.468 ' N ' ' O ' ' A' ' 65' ' ' SER . . . -82.65 68.36 3.55 Favored Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.414 ' OE2' ' HB3' ' A' ' 71' ' ' SER . 2.0 pp20? -109.99 -22.64 11.73 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.214 -1.168 . . . . 0.0 110.179 179.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.414 ' HB3' ' OE2' ' A' ' 70' ' ' GLU . 22.3 t -172.23 95.89 0.15 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.304 -0.873 . . . . 0.0 110.178 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -64.49 111.49 2.71 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.254 -0.904 . . . . 0.0 110.189 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.2 pp . . . . . 0 N--CA 1.492 1.625 0 O-C-N 121.272 -0.893 . . . . 0.0 110.136 -179.997 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.315 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.52 34.33 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.271 -1.135 . . . . 0.0 110.134 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.815 ' O ' HG23 ' B' ' 13' ' ' VAL . 0.3 OUTLIER -58.32 -40.34 81.82 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.291 -0.88 . . . . 0.0 110.159 -179.944 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.11 -46.5 79.1 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.23 -0.919 . . . . 0.0 109.964 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -62.12 -40.95 97.63 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.277 -0.89 . . . . 0.0 110.032 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . 0.468 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -64.33 -37.11 86.33 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.342 -0.849 . . . . 0.0 110.184 179.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.929 ' O ' HG23 ' B' ' 17' ' ' VAL . 42.7 t -65.31 -45.09 94.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.321 -0.862 . . . . 0.0 110.128 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.33 -35.94 74.75 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.234 -0.916 . . . . 0.0 110.173 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 15.0 m -67.54 -40.95 85.01 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.378 -0.826 . . . . 0.0 110.347 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.85 ' O ' HG23 ' B' ' 20' ' ' VAL . 57.4 t -69.91 -40.18 78.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.248 -0.908 . . . . 0.0 110.168 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.929 HG23 ' O ' ' B' ' 13' ' ' VAL . 16.7 t -61.45 -47.41 93.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.365 -0.834 . . . . 0.0 110.238 -179.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.86 -46.01 92.27 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.253 -0.904 . . . . 0.0 110.322 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.04 -41.4 95.23 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.228 -0.92 . . . . 0.0 110.287 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.85 HG23 ' O ' ' B' ' 16' ' ' VAL . 75.1 t -67.1 -39.44 83.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.25 -0.906 . . . . 0.0 110.425 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.44 -33.73 76.55 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.235 -0.916 . . . . 0.0 110.333 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.995 ' O ' HG12 ' B' ' 25' ' ' VAL . 28.8 tt0 -58.09 -49.38 77.14 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.286 -0.884 . . . . 0.0 110.267 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.722 ' HB2' HD21 ' A' ' 67' ' ' LEU . . . -66.15 -37.32 85.39 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.235 -0.915 . . . . 0.0 110.411 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 51.1 ttt-85 -70.35 -36.45 74.2 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.268 -0.895 . . . . 0.0 110.648 -179.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . 0.995 HG12 ' O ' ' B' ' 22' ' ' GLN . 3.3 p -52.51 -23.16 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.082 -1.011 . . . . 0.0 110.275 -179.664 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 1.3 ttt180 -102.97 19.81 18.75 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.439 -0.788 . . . . 0.0 110.158 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.71 124.8 53.69 Favored Pre-proline 0 N--CA 1.491 1.582 0 O-C-N 121.334 -0.854 . . . . 0.0 110.274 -179.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -68.56 149.52 74.26 Favored 'Trans proline' 0 C--N 1.306 -1.708 0 O-C-N 124.013 1.533 . . . . 0.0 110.206 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 43.9 mtt85 . . . . . 0 N--CA 1.49 1.553 0 O-C-N 121.161 -0.962 . . . . 0.0 110.233 -179.928 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.654 0 CA-C-O 121.236 0.541 . . . . 0.0 110.173 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -108.99 163.34 13.39 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.232 -0.918 . . . . 0.0 110.186 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -88.61 60.27 5.52 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.2 -0.938 . . . . 0.0 110.222 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.434 HG21 ' HB3' ' A' ' 8' ' ' GLU . 9.6 t -103.84 -146.38 0.38 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.264 -0.898 . . . . 0.0 110.127 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -96.22 -84.89 0.35 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.259 -0.9 . . . . 0.0 110.192 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.5 m -156.6 -43.55 0.07 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.258 -0.901 . . . . 0.0 110.141 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.568 ' HA ' ' CZ ' ' A' ' 68' ' ' TYR . . . -69.99 -41.48 74.34 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.335 -0.853 . . . . 0.0 109.873 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.434 ' HB3' HG21 ' A' ' 4' ' ' THR . 2.1 tp10 -59.66 -36.9 77.35 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.278 -0.889 . . . . 0.0 109.742 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -64.58 -44.04 91.94 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.439 -0.788 . . . . 0.0 110.284 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.628 HG21 ' OH ' ' A' ' 68' ' ' TYR . 54.3 t -57.87 -43.75 85.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.203 -0.936 . . . . 0.0 109.86 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.494 HD12 ' O ' ' A' ' 7' ' ' ALA . 5.5 mt -63.74 -49.16 83.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.329 -0.857 . . . . 0.0 109.351 179.35 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.06 -43.15 86.78 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.294 -0.879 . . . . 0.0 108.92 179.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.499 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 1.0 OUTLIER -63.56 -46.63 85.02 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.608 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.578 ' HB3' ' CE2' ' A' ' 60' ' ' TYR . 3.6 m-85 -59.81 -43.14 94.63 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.465 -0.772 . . . . 0.0 109.129 178.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -52.96 -40.59 63.82 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.405 HG21 ' HA ' ' B' ' 9' ' ' LYS . 61.6 mt -67.1 -44.93 87.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.541 -0.724 . . . . 0.0 110.267 179.41 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.568 HD13 ' OE1' ' A' ' 32' ' ' GLU . 9.3 mt -57.88 -42.11 83.9 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.929 -1.107 . . . . 0.0 109.698 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.446 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -79.5 4.07 16.79 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.378 -0.826 . . . . 0.0 110.298 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.448 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 0.3 OUTLIER 64.91 66.8 0.55 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.268 -0.895 . . . . 0.0 110.234 179.959 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 52.11 59.88 4.22 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.213 -0.929 . . . . 0.0 110.308 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.448 ' HG3' ' O ' ' A' ' 19' ' ' SER . 20.9 mttt -143.51 142.05 20.27 Favored Pre-proline 0 N--CA 1.49 1.525 0 O-C-N 121.182 -0.949 . . . . 0.0 110.014 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -69.81 -3.15 11.47 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 O-C-N 124.089 1.573 . . . . 0.0 110.263 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.523 ' CD1' ' O ' ' A' ' 23' ' ' TYR . 7.0 p90 -143.4 152.37 41.5 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.239 -0.913 . . . . 0.0 110.055 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.404 HD13 HG21 ' A' ' 24' ' ' ILE . 3.9 tt -123.0 147.39 27.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.243 -0.911 . . . . 0.0 110.344 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.503 ' HB2' ' HB2' ' A' ' 28' ' ' GLU . 1.2 mp -80.48 141.43 35.22 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.241 -0.912 . . . . 0.0 109.92 179.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.496 ' O ' ' HG ' ' A' ' 29' ' ' LEU . . . -60.27 -40.6 90.94 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.203 -0.936 . . . . 0.0 110.471 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -65.01 -35.17 80.34 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.165 -0.959 . . . . 0.0 110.124 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.503 ' HB2' ' HB2' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -68.8 -49.98 54.04 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.366 -0.834 . . . . 0.0 109.869 179.992 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.725 HD12 ' C ' ' A' ' 29' ' ' LEU . 0.9 OUTLIER -66.82 -34.07 77.01 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.373 -0.829 . . . . 0.0 110.042 179.834 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.76 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 17.2 ttp180 -69.18 -34.48 75.0 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.319 -0.863 . . . . 0.0 111.12 -179.642 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.551 ' NH1' ' HB3' ' A' ' 31' ' ' ARG . 5.0 ttp-105 -86.48 -22.46 26.43 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.007 -1.058 . . . . 0.0 111.32 -178.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.568 ' OE1' HD13 ' A' ' 17' ' ' LEU . 12.8 pt-20 -90.7 -24.03 20.55 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.831 -1.168 . . . . 0.0 110.776 -179.542 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.589 HD23 ' HD2' ' A' ' 34' ' ' PRO . 7.6 mt -103.17 155.91 36.06 Favored Pre-proline 0 N--CA 1.488 1.457 0 O-C-N 121.122 -0.986 . . . . 0.0 110.409 -179.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.589 ' HD2' HD23 ' A' ' 33' ' ' LEU . 6.2 Cg_exo -59.18 142.54 99.36 Favored 'Trans proline' 0 C--N 1.302 -1.892 0 O-C-N 124.069 1.563 . . . . 0.0 109.775 179.593 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.429 ' C ' ' O ' ' A' ' 34' ' ' PRO . 33.7 Cg_exo -37.72 -44.08 1.56 Allowed 'Trans proline' 0 C--N 1.305 -1.749 0 O-C-N 124.055 1.555 . . . . 0.0 110.917 -179.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.486 ' OD1' ' HB2' ' A' ' 34' ' ' PRO . 2.9 p-10 -65.9 -45.82 80.58 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.091 -1.006 . . . . 0.0 111.04 -179.606 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.626 ' HG2' HG22 ' B' ' 17' ' ' VAL . 0.6 OUTLIER -69.82 -37.85 76.36 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.951 -1.093 . . . . 0.0 110.705 -179.53 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.76 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -60.96 -43.86 98.13 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.369 -0.832 . . . . 0.0 110.952 -179.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.3 tm0? -60.09 -44.92 94.46 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.255 -0.903 . . . . 0.0 110.849 -179.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -62.21 -41.72 98.63 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.237 -0.914 . . . . 0.0 110.922 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 27.5 m -62.69 -50.88 69.41 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.128 -0.982 . . . . 0.0 110.755 -179.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.644 HD12 HD11 ' A' ' 29' ' ' LEU . 1.1 mt -63.84 -18.01 21.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.203 -0.935 . . . . 0.0 110.188 -179.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.45 ' C ' ' HD2' ' A' ' 44' ' ' ARG . 9.2 tttt -83.22 -16.01 48.19 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.25 -0.906 . . . . 0.0 110.772 -179.69 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.592 ' HB3' ' CG ' ' A' ' 63' ' ' PHE . 2.0 mpt_? -114.32 -62.26 1.62 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.106 -0.996 . . . . 0.0 110.675 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.492 ' HE1' ' HB3' ' A' ' 60' ' ' TYR . 2.3 ttm -32.88 111.1 0.35 Allowed Pre-proline 0 N--CA 1.497 1.92 0 O-C-N 121.618 -0.676 . . . . 0.0 111.272 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.428 ' O ' ' HA ' ' A' ' 58' ' ' LEU . 12.3 Cg_endo -80.06 177.68 8.02 Favored 'Trans proline' 0 C--N 1.306 -1.687 0 O-C-N 124.024 1.539 . . . . 0.0 110.194 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.87 133.17 46.24 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.252 -0.905 . . . . 0.0 110.237 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.444 ' CB ' ' O ' ' A' ' 57' ' ' ALA . 7.7 t80 -59.23 107.8 0.6 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.24 -0.912 . . . . 0.0 110.08 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -107.92 148.89 29.03 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.252 -0.905 . . . . 0.0 110.222 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 148.46 -150.91 23.15 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -78.7 106.74 2.15 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 O-C-N 124.084 1.57 . . . . 0.0 110.222 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.497 ' O ' ' HB2' ' A' ' 53' ' ' SER . . . 72.34 156.91 3.22 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.497 ' HB2' ' O ' ' A' ' 52' ' ' GLY . 34.6 t 178.37 -163.83 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.338 0 O-C-N 121.364 -1.08 . . . . 0.0 110.331 179.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.806 ' CG2' ' HB2' ' A' ' 57' ' ' ALA . 15.4 m -144.89 170.91 7.31 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.323 -0.861 . . . . 0.0 110.235 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -87.78 43.67 0.9 Allowed 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.998 1.525 . . . . 0.0 110.269 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 179.98 35.83 0.07 OUTLIER Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.806 ' HB2' ' CG2' ' A' ' 54' ' ' VAL . . . -122.36 104.5 9.46 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.214 -1.168 . . . . 0.0 110.107 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.438 ' HB3' ' HB3' ' A' ' 45' ' ' MET . 54.3 mt -93.76 159.04 15.38 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.323 -0.861 . . . . 0.0 110.176 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.479 ' C ' ' HG3' ' A' ' 45' ' ' MET . 1.2 m-20 -115.28 110.42 19.39 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.105 -0.997 . . . . 0.0 110.41 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.579 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 15.9 p90 -72.77 -25.77 61.29 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.379 -0.826 . . . . 0.0 110.271 179.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.579 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.7 -36.73 67.5 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.279 -0.888 . . . . 0.0 109.958 -179.7 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.56 -43.36 80.84 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.322 -0.861 . . . . 0.0 109.557 179.416 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.592 ' CG ' ' HB3' ' A' ' 44' ' ' ARG . 1.5 t80 -72.12 -35.29 69.11 Favored 'General case' 0 C--N 1.297 -1.689 0 O-C-N 121.75 -0.593 . . . . 0.0 110.311 179.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.566 ' O ' ' CE2' ' A' ' 68' ' ' TYR . 44.3 m -59.67 -49.87 76.07 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.298 -0.876 . . . . 0.0 110.569 -179.606 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.97 -41.24 82.49 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.184 -0.947 . . . . 0.0 110.344 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -56.64 -39.6 73.96 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.231 -0.918 . . . . 0.0 110.386 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.546 ' CD2' ' HB2' ' B' ' 23' ' ' ALA . 15.3 mt -57.75 -41.12 81.3 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.144 -0.972 . . . . 0.0 110.241 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.628 ' OH ' HG21 ' A' ' 10' ' ' VAL . 2.7 m-85 -84.15 10.15 10.95 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.271 -0.893 . . . . 0.0 110.077 -179.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 149.26 -101.58 0.22 Allowed Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 48.6 tt0 -166.85 -54.99 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.228 -1.16 . . . . 0.0 110.204 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.1 m -161.52 159.72 28.23 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.214 -0.929 . . . . 0.0 110.244 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -80.08 133.71 36.13 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.191 -0.943 . . . . 0.0 110.163 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.436 HD22 ' HA ' ' A' ' 73' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.576 0 O-C-N 121.253 -0.905 . . . . 0.0 110.305 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.331 0 N-CA-C 109.524 -1.431 . . . . 0.0 109.524 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.466 ' HB2' ' OE1' ' B' ' 11' ' ' GLU . 0.2 OUTLIER -158.28 37.04 0.24 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.217 -1.167 . . . . 0.0 110.133 179.905 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.405 ' HA ' HG21 ' A' ' 16' ' ' ILE . 0.0 OUTLIER -65.65 -45.63 82.24 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.24 -0.913 . . . . 0.0 110.025 179.849 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.99 -40.84 77.34 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.314 -0.866 . . . . 0.0 109.997 179.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.466 ' OE1' ' HB2' ' B' ' 8' ' ' LYS . 5.2 mt-10 -62.05 -40.92 97.39 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.333 -0.854 . . . . 0.0 110.024 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . 0.458 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -65.43 -43.08 91.61 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.415 -0.803 . . . . 0.0 110.0 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.558 ' O ' HG23 ' B' ' 17' ' ' VAL . 90.1 t -58.64 -44.25 89.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.215 -0.928 . . . . 0.0 110.013 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.29 -39.56 90.89 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.307 -0.87 . . . . 0.0 110.179 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 19.7 m -64.66 -44.43 90.42 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.226 -0.921 . . . . 0.0 110.136 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.458 HG23 ' O ' ' B' ' 12' ' ' ALA . 59.8 t -65.18 -42.28 93.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.246 -0.909 . . . . 0.0 110.08 179.898 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.626 HG22 ' HG2' ' A' ' 37' ' ' GLN . 74.4 t -60.66 -44.79 97.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.271 -0.893 . . . . 0.0 110.256 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.71 -46.32 90.16 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.197 -0.94 . . . . 0.0 110.199 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.51 -42.02 92.53 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.27 -0.894 . . . . 0.0 110.232 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.449 HG23 ' O ' ' B' ' 16' ' ' VAL . 57.6 t -66.04 -46.04 89.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.304 -0.873 . . . . 0.0 110.244 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -63.08 -32.58 73.98 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.235 -0.915 . . . . 0.0 110.221 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 4.5 tp60 -56.9 -41.45 78.12 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.268 -0.895 . . . . 0.0 110.11 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.546 ' HB2' ' CD2' ' A' ' 67' ' ' LEU . . . -60.63 -39.06 86.85 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.207 -0.933 . . . . 0.0 109.981 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.72 -33.22 74.67 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.367 -0.833 . . . . 0.0 110.264 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -67.91 -20.8 26.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.277 -0.889 . . . . 0.0 110.05 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 12.0 ttm180 -84.28 26.81 0.73 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.323 -0.861 . . . . 0.0 110.966 -179.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -109.77 134.04 20.75 Favored Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.092 -1.005 . . . . 0.0 110.166 179.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -43.71 100.7 0.04 OUTLIER 'Trans proline' 0 C--N 1.306 -1.709 0 O-C-N 123.879 1.463 . . . . 0.0 110.23 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 10.9 ttm180 . . . . . 0 N--CA 1.49 1.572 0 O-C-N 121.277 -0.889 . . . . 0.0 110.269 -179.991 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 121.269 0.557 . . . . 0.0 110.2 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -95.05 94.04 7.73 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.212 -0.93 . . . . 0.0 110.264 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -93.84 -170.96 2.45 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.25 -0.906 . . . . 0.0 110.207 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -117.9 159.6 22.83 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.303 -0.873 . . . . 0.0 110.285 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.493 ' O ' ' N ' ' A' ' 7' ' ' ALA . 0.2 OUTLIER 62.21 154.12 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.165 -0.959 . . . . 0.0 110.321 179.937 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.778 HG22 ' CZ ' ' A' ' 68' ' ' TYR . 1.9 m 66.62 -59.88 0.35 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.284 -0.885 . . . . 0.0 110.258 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.493 ' N ' ' O ' ' A' ' 5' ' ' ASP . . . -67.8 -37.97 82.69 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.289 -0.882 . . . . 0.0 109.43 179.592 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.6 tp10 -59.85 -36.02 75.98 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.418 -0.801 . . . . 0.0 109.681 179.209 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.15 -45.66 93.74 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.327 -0.858 . . . . 0.0 110.046 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.684 HG12 ' CD2' ' A' ' 14' ' ' PHE . 21.7 t -61.88 -43.64 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.097 -1.002 . . . . 0.0 109.649 179.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 34.8 mt -57.3 -49.47 79.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.385 -0.822 . . . . 0.0 109.413 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.05 -41.85 93.19 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.293 -0.879 . . . . 0.0 109.063 179.09 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.444 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 5.1 m -65.46 -41.24 93.6 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.48 -0.762 . . . . 0.0 109.153 179.022 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.684 ' CD2' HG12 ' A' ' 10' ' ' VAL . 2.2 m-85 -68.43 -41.26 80.58 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.385 -0.822 . . . . 0.0 109.395 179.257 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.471 ' HD3' ' HA ' ' A' ' 20' ' ' ASP . 1.5 tmm_? -53.58 -43.63 68.7 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.353 -0.842 . . . . 0.0 109.612 179.509 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.633 HD12 ' HB2' ' B' ' 12' ' ' ALA . 54.8 mt -60.14 -44.94 96.28 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.283 -0.886 . . . . 0.0 109.691 179.627 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 13' ' ' SER . 38.5 mt -65.36 -40.15 93.21 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.295 -0.878 . . . . 0.0 109.803 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.561 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -72.35 -4.88 32.58 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.298 -0.876 . . . . 0.0 110.103 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.468 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.3 OUTLIER 68.48 54.17 0.54 Allowed 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.24 -0.912 . . . . 0.0 110.2 -179.922 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.471 ' HA ' ' HD3' ' A' ' 15' ' ' ARG . 2.2 t70 63.02 36.74 12.2 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.204 -0.935 . . . . 0.0 110.313 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.561 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 7.5 mmtt -118.47 144.75 35.86 Favored Pre-proline 0 N--CA 1.49 1.543 0 O-C-N 121.237 -0.914 . . . . 0.0 110.037 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 21' ' ' LYS . 38.4 Cg_exo -68.77 -5.33 15.2 Favored 'Trans proline' 0 C--N 1.304 -1.79 0 O-C-N 124.123 1.591 . . . . 0.0 109.999 179.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.544 ' CD1' ' N ' ' A' ' 23' ' ' TYR . 18.0 p90 -141.01 165.11 28.45 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.419 -0.8 . . . . 0.0 110.106 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.859 HD12 ' CD2' ' A' ' 29' ' ' LEU . 0.4 OUTLIER -125.76 149.88 30.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.217 -0.927 . . . . 0.0 109.96 -179.886 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.823 HD22 ' N ' ' A' ' 25' ' ' LEU . 2.9 mm? -90.99 154.64 19.3 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.26 -0.9 . . . . 0.0 110.238 -179.872 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.0 -37.64 78.83 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.3 -0.875 . . . . 0.0 110.112 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -65.89 -35.2 79.98 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.277 -0.889 . . . . 0.0 110.071 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.44 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 1.1 mt-10 -62.59 -43.99 97.43 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.322 -0.862 . . . . 0.0 109.93 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.859 ' CD2' HD12 ' A' ' 24' ' ' ILE . 3.8 mm? -62.55 -34.31 76.69 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.173 -0.955 . . . . 0.0 109.883 179.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.77 -39.05 80.43 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.312 -0.868 . . . . 0.0 110.175 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.74 -15.9 27.68 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.267 -0.895 . . . . 0.0 110.298 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.44 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 3.1 mm-40 -100.41 -23.58 14.71 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.109 -0.994 . . . . 0.0 110.383 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.9 HD23 ' HD2' ' A' ' 34' ' ' PRO . 0.3 OUTLIER -134.8 151.4 75.63 Favored Pre-proline 0 N--CA 1.487 1.395 0 O-C-N 121.103 -0.998 . . . . 0.0 110.306 -179.694 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.9 ' HD2' HD23 ' A' ' 33' ' ' LEU . 8.8 Cg_endo -50.5 140.41 35.73 Favored 'Trans proline' 0 C--N 1.304 -1.763 0 O-C-N 124.009 1.531 . . . . 0.0 110.218 179.727 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -43.72 -35.03 6.19 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 124.029 1.542 . . . . 0.0 110.328 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -62.68 -45.63 91.89 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.179 -0.951 . . . . 0.0 110.239 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.743 ' HG2' HG22 ' B' ' 17' ' ' VAL . 1.9 mp0 -69.33 -42.23 75.6 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.179 -0.951 . . . . 0.0 110.297 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.45 -48.42 79.21 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.243 -0.911 . . . . 0.0 110.225 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -57.48 -43.06 83.79 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.31 -0.869 . . . . 0.0 109.867 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -66.13 -44.22 84.85 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.284 -0.885 . . . . 0.0 110.127 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.475 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 5.5 m -59.52 -50.7 72.9 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.3 -0.875 . . . . 0.0 110.494 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 81.2 mt -60.0 -25.21 32.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.269 -0.895 . . . . 0.0 110.339 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.85 -40.37 72.41 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.27 -0.894 . . . . 0.0 109.721 179.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.615 ' HB2' ' CD2' ' A' ' 63' ' ' PHE . 11.1 mpt_? -84.46 -69.07 0.67 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.373 -0.829 . . . . 0.0 109.815 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.699 ' HE1' ' HB3' ' A' ' 60' ' ' TYR . 21.5 mtt -32.04 116.78 0.39 Allowed Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.775 -0.578 . . . . 0.0 111.197 179.42 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.692 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 38.8 Cg_exo -87.83 -149.64 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.753 0 O-C-N 124.013 1.533 . . . . 0.0 110.048 179.721 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -89.05 140.03 29.86 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.195 -0.941 . . . . 0.0 110.299 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -69.23 -56.21 8.26 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.233 -0.917 . . . . 0.0 110.257 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 55.81 89.37 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.28 -0.887 . . . . 0.0 110.233 -179.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -134.29 -156.62 7.91 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.683 -1.367 . . . . 0.0 109.683 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -84.53 79.87 2.4 Favored 'Trans proline' 0 C--N 1.306 -1.705 0 O-C-N 124.068 1.562 . . . . 0.0 110.378 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.485 ' O ' ' O ' ' A' ' 53' ' ' SER . . . 86.33 38.81 8.14 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.693 -1.363 . . . . 0.0 109.693 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.485 ' O ' ' O ' ' A' ' 52' ' ' GLY . 1.5 p -54.22 -162.55 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.277 0 O-C-N 121.338 -1.095 . . . . 0.0 110.599 -179.715 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.771 HG22 ' HB2' ' A' ' 57' ' ' ALA . 24.0 m -124.92 160.79 52.57 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.255 -0.903 . . . . 0.0 110.185 179.834 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -73.5 69.06 4.32 Favored 'Trans proline' 0 C--N 1.306 -1.663 0 O-C-N 124.031 1.543 . . . . 0.0 110.36 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 148.7 37.14 0.04 OUTLIER Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.734 -1.346 . . . . 0.0 109.734 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.771 ' HB2' HG22 ' A' ' 54' ' ' VAL . . . -113.56 115.01 27.29 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.204 -1.174 . . . . 0.0 110.016 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.854 HD22 ' N ' ' A' ' 58' ' ' LEU . 0.9 OUTLIER -105.6 160.73 14.96 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.28 -0.887 . . . . 0.0 110.217 -179.615 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.514 ' OD1' ' N ' ' A' ' 59' ' ' ASP . 1.5 p-10 -107.46 110.53 22.5 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.097 -1.002 . . . . 0.0 111.081 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.699 ' HB3' ' HE1' ' A' ' 45' ' ' MET . 16.0 p90 -72.77 -23.21 60.79 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.328 -0.858 . . . . 0.0 109.231 178.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.576 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.19 -41.92 72.59 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.273 -0.892 . . . . 0.0 108.719 179.436 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.692 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -58.89 -32.19 69.28 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 119.494 -0.882 . . . . 0.0 108.79 178.493 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.634 ' CZ ' HG22 ' B' ' 20' ' ' VAL . 26.2 t80 -59.7 -49.33 78.16 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 121.257 0.551 . . . . 0.0 110.708 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.474 ' OG ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -70.5 -37.25 74.16 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.123 -0.985 . . . . 0.0 110.78 -179.432 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 51.3 p -64.52 -41.78 96.18 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.149 -0.969 . . . . 0.0 110.467 -179.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -75.57 -40.69 56.31 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.148 -0.97 . . . . 0.0 110.507 -179.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.577 HD13 ' CD1' ' A' ' 63' ' ' PHE . 0.2 OUTLIER -64.02 -43.98 93.95 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.204 -0.935 . . . . 0.0 110.424 -179.713 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.778 ' CZ ' HG22 ' A' ' 6' ' ' THR . 24.5 m-85 -98.89 15.36 25.84 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.23 -0.919 . . . . 0.0 110.287 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -96.5 -170.23 34.46 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.454 -1.458 . . . . 0.0 109.454 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -68.27 -169.09 0.13 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.259 -1.142 . . . . 0.0 110.15 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.4 p -164.5 -177.11 4.67 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.281 -0.887 . . . . 0.0 110.234 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -101.68 135.09 43.8 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.198 -0.939 . . . . 0.0 110.199 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.8 tp . . . . . 0 N--CA 1.492 1.645 0 O-C-N 121.239 -0.913 . . . . 0.0 110.14 -179.947 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.89 -5.71 56.52 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.262 -1.14 . . . . 0.0 110.282 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.444 ' HA ' HG21 ' A' ' 16' ' ' ILE . 10.4 ttpt -62.3 -39.45 93.05 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.251 -0.906 . . . . 0.0 110.239 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.66 -40.04 86.42 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.211 -0.931 . . . . 0.0 110.15 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.31 -39.81 91.87 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.316 -0.865 . . . . 0.0 110.273 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . 0.808 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -61.98 -41.87 98.51 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.18 -0.95 . . . . 0.0 109.984 -179.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.669 HG13 ' HG ' ' A' ' 33' ' ' LEU . 59.0 t -63.65 -43.11 98.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.264 -0.898 . . . . 0.0 109.721 179.518 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.51 -42.21 95.91 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.317 -0.864 . . . . 0.0 110.005 179.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 22.8 m -64.57 -43.21 94.63 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.314 -0.866 . . . . 0.0 110.018 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.808 HG23 ' O ' ' B' ' 12' ' ' ALA . 30.9 t -63.61 -46.51 94.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.255 -0.903 . . . . 0.0 110.024 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.743 HG22 ' HG2' ' A' ' 37' ' ' GLN . 83.2 t -58.16 -42.32 82.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.245 -0.91 . . . . 0.0 109.944 179.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.67 -45.57 93.66 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.231 -0.918 . . . . 0.0 109.917 179.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.97 -42.06 90.35 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.301 -0.874 . . . . 0.0 109.957 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.634 HG22 ' CZ ' ' A' ' 63' ' ' PHE . 52.2 t -67.77 -43.2 86.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.278 -0.889 . . . . 0.0 110.045 179.837 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.871 ' O ' HG23 ' B' ' 25' ' ' VAL . 2.0 t70 -64.2 -34.04 77.17 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.283 -0.885 . . . . 0.0 110.123 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.439 ' OE1' ' OE1' ' B' ' 27' ' ' GLU . 0.6 OUTLIER -66.9 -36.58 82.6 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.232 -0.917 . . . . 0.0 110.243 179.926 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.539 ' HB2' ' CD2' ' A' ' 67' ' ' LEU . . . -65.38 -42.77 92.32 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.238 -0.913 . . . . 0.0 110.618 -179.701 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . 0.461 ' HG2' ' O ' ' B' ' 21' ' ' ASP . 2.1 ptm180 -70.3 -35.84 73.95 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.041 -1.037 . . . . 0.0 110.274 -179.863 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . 0.871 HG23 ' O ' ' B' ' 21' ' ' ASP . 71.3 t -54.22 -21.19 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.363 -0.836 . . . . 0.0 110.463 -179.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.466 ' CB ' ' O ' ' B' ' 25' ' ' VAL . 0.5 OUTLIER 67.88 70.87 0.33 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.329 -0.857 . . . . 0.0 110.096 -179.899 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . 0.439 ' OE1' ' OE1' ' B' ' 22' ' ' GLN . 1.6 pt-20 -75.98 142.39 72.59 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.235 -0.915 . . . . 0.0 110.336 -179.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -83.84 137.18 7.49 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 O-C-N 124.086 1.572 . . . . 0.0 110.358 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 2.9 ttt85 . . . . . 0 N--CA 1.491 1.582 0 O-C-N 121.187 -0.946 . . . . 0.0 110.279 179.979 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 ptp . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 121.284 0.564 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -139.67 155.93 47.11 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.246 -0.909 . . . . 0.0 110.27 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 17.4 p30 -150.37 163.98 37.0 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.282 -0.886 . . . . 0.0 110.011 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.47 ' HA ' ' OE1' ' A' ' 8' ' ' GLU . 10.0 t -161.22 175.78 11.95 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.163 -0.96 . . . . 0.0 110.435 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -178.42 -160.51 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.315 -0.866 . . . . 0.0 110.207 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.418 HG22 ' CZ ' ' A' ' 68' ' ' TYR . 4.2 m -76.93 -52.23 9.79 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.289 -0.882 . . . . 0.0 110.092 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -70.04 -46.25 65.42 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.162 -0.961 . . . . 0.0 109.909 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.47 ' OE1' ' HA ' ' A' ' 4' ' ' THR . 1.3 tt0 -54.64 -36.68 64.79 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.383 -0.823 . . . . 0.0 110.051 179.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.416 ' HG2' HG21 ' B' ' 15' ' ' THR . 40.6 tt0 -61.63 -43.09 99.51 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.255 -0.903 . . . . 0.0 110.236 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 98.2 t -61.79 -42.13 93.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.194 -0.941 . . . . 0.0 109.996 179.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.622 HG23 ' HE1' ' A' ' 60' ' ' TYR . 82.7 mt -57.41 -49.88 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.31 -0.869 . . . . 0.0 109.683 179.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.54 -37.61 76.04 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 119.504 -0.878 . . . . 0.0 108.796 178.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.475 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 41.7 m -67.66 -39.7 84.54 Favored 'General case' 0 N--CA 1.485 1.324 0 O-C-N 121.456 -0.778 . . . . 0.0 109.206 178.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.517 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 0.7 OUTLIER -68.41 -42.62 78.73 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.346 -0.847 . . . . 0.0 109.534 179.185 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -53.95 -41.57 67.92 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.245 -0.91 . . . . 0.0 108.939 179.077 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.8 mt -62.0 -41.11 89.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.459 -0.775 . . . . 0.0 109.611 179.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 13' ' ' SER . 26.7 mt -64.89 -41.94 95.19 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.256 -0.902 . . . . 0.0 109.456 179.455 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.666 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -77.14 -7.31 55.58 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.438 -0.789 . . . . 0.0 110.092 179.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.477 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 68.07 67.44 0.34 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.231 -0.918 . . . . 0.0 110.235 -179.908 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.413 ' O ' ' HG2' ' A' ' 21' ' ' LYS . 0.3 OUTLIER 59.85 61.84 1.82 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.246 -0.908 . . . . 0.0 110.3 179.885 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.666 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 6.3 mttt -147.92 142.78 16.93 Favored Pre-proline 0 N--CA 1.489 1.487 0 O-C-N 121.234 -0.916 . . . . 0.0 110.01 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 21' ' ' LYS . 35.2 Cg_exo -74.29 0.92 7.9 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 O-C-N 123.955 1.503 . . . . 0.0 110.081 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.477 ' CD1' ' HB1' ' A' ' 57' ' ' ALA . 45.5 p90 -145.83 164.82 30.73 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.259 -0.901 . . . . 0.0 110.159 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.815 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -131.62 141.91 44.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.162 -0.961 . . . . 0.0 110.2 -179.873 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.815 ' N ' HD13 ' A' ' 24' ' ' ILE . 4.2 mt -81.52 157.7 24.73 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.13 -0.981 . . . . 0.0 110.205 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.73 -41.06 75.8 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.302 -0.874 . . . . 0.0 110.32 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -60.7 -35.41 76.23 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.176 -0.953 . . . . 0.0 110.17 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.455 ' OE1' ' OE2' ' A' ' 32' ' ' GLU . 9.0 mt-10 -64.25 -44.11 92.82 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.348 -0.845 . . . . 0.0 109.925 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.637 HD12 HG13 ' A' ' 42' ' ' ILE . 18.0 mt -60.66 -33.72 73.24 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.203 -0.936 . . . . 0.0 109.609 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.594 HH12 HD13 ' A' ' 42' ' ' ILE . 18.9 mtt85 -67.89 -35.08 77.88 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.388 -0.82 . . . . 0.0 110.309 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.4 ttt180 -95.62 -20.62 18.81 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.164 -0.96 . . . . 0.0 110.82 -179.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.456 ' OE1' ' HB3' ' A' ' 17' ' ' LEU . 86.5 mt-10 -96.14 -23.78 16.59 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.05 -1.031 . . . . 0.0 110.466 -179.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.521 HD22 ' CB ' ' A' ' 37' ' ' GLN . 6.0 mt -129.44 153.59 80.62 Favored Pre-proline 0 C--N 1.305 -1.348 0 O-C-N 121.233 -0.917 . . . . 0.0 110.078 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.415 ' CD ' HD23 ' A' ' 33' ' ' LEU . 33.1 Cg_exo -56.19 154.46 28.45 Favored 'Trans proline' 0 C--N 1.306 -1.69 0 O-C-N 123.94 1.495 . . . . 0.0 110.264 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -47.68 -38.74 29.66 Favored 'Trans proline' 0 C--N 1.307 -1.652 0 O-C-N 124.048 1.551 . . . . 0.0 110.305 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.73 -46.33 85.87 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.248 -0.908 . . . . 0.0 110.291 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.621 ' HG2' HG22 ' B' ' 17' ' ' VAL . 9.6 mp0 -69.27 -44.42 71.92 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.282 -0.886 . . . . 0.0 110.383 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.904 ' O ' HD12 ' A' ' 42' ' ' ILE . . . -56.26 -48.07 77.29 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.175 -0.953 . . . . 0.0 110.367 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.8 tm0? -64.74 -43.02 94.7 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.226 -0.921 . . . . 0.0 110.191 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -64.93 -46.79 80.17 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.281 -0.887 . . . . 0.0 110.305 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.443 ' SG ' ' O ' ' A' ' 37' ' ' GLN . 62.2 m -65.46 -49.71 68.09 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.157 -0.965 . . . . 0.0 110.452 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.904 HD12 ' O ' ' A' ' 38' ' ' ALA . 6.3 mt -58.22 -24.03 23.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.221 -0.924 . . . . 0.0 110.38 -179.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.41 -30.3 33.62 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.156 -0.965 . . . . 0.0 110.367 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.576 ' HG3' ' CE1' ' A' ' 63' ' ' PHE . 2.2 mmt180 -86.27 -58.93 2.44 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.218 -0.927 . . . . 0.0 110.195 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.687 ' SD ' HG22 ' A' ' 24' ' ' ILE . 1.4 ttm -38.29 119.27 1.02 Allowed Pre-proline 0 N--CA 1.492 1.641 0 O-C-N 121.511 -0.743 . . . . 0.0 110.722 179.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.446 ' CD ' ' HB3' ' A' ' 62' ' ' ALA . 12.4 Cg_endo -82.1 -163.16 0.2 Allowed 'Trans proline' 0 C--N 1.305 -1.736 0 O-C-N 123.937 1.493 . . . . 0.0 110.22 179.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -88.44 127.43 35.51 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.215 -0.928 . . . . 0.0 110.267 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.5 ' CB ' ' O ' ' A' ' 57' ' ' ALA . 5.9 t80 -65.04 116.31 6.31 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.191 -0.943 . . . . 0.0 110.052 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.32 126.74 52.44 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.203 -0.936 . . . . 0.0 110.18 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -155.6 -119.5 0.65 Allowed Glycine 0 N--CA 1.489 2.232 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -95.13 -42.1 0.02 OUTLIER 'Trans proline' 0 C--N 1.304 -1.765 0 O-C-N 124.053 1.554 . . . . 0.0 110.203 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.485 ' O ' ' O ' ' A' ' 53' ' ' SER . . . -170.56 51.9 0.19 Allowed Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.451 -1.46 . . . . 0.0 109.451 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.485 ' O ' ' O ' ' A' ' 52' ' ' GLY . 2.5 m -54.87 -159.82 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.325 0 O-C-N 121.347 -1.09 . . . . 0.0 110.746 -179.656 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.443 ' O ' ' N ' ' A' ' 56' ' ' GLY . 12.1 m -141.44 147.84 48.11 Favored Pre-proline 0 N--CA 1.492 1.633 0 O-C-N 121.225 -0.922 . . . . 0.0 110.158 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -57.88 86.68 0.05 OUTLIER 'Trans proline' 0 C--N 1.305 -1.728 0 O-C-N 124.095 1.577 . . . . 0.0 110.21 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 54' ' ' VAL . . . 164.73 -36.52 0.28 Allowed Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.5 ' O ' ' CB ' ' A' ' 48' ' ' TYR . . . -78.82 96.62 5.68 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.206 -1.173 . . . . 0.0 110.207 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.487 ' CB ' ' HG2' ' A' ' 45' ' ' MET . 13.2 mt -92.71 155.76 17.49 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.186 -0.946 . . . . 0.0 110.17 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.472 ' C ' ' HG3' ' A' ' 45' ' ' MET . 4.4 m-20 -103.32 111.7 24.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.2 -0.938 . . . . 0.0 110.13 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.622 ' HE1' HG23 ' A' ' 11' ' ' ILE . 23.7 p90 -72.63 -22.35 60.96 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.389 -0.82 . . . . 0.0 110.157 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.488 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.01 -34.18 65.58 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.182 -0.949 . . . . 0.0 110.021 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.446 ' HB3' ' CD ' ' A' ' 46' ' ' PRO . . . -68.23 -36.49 79.58 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.234 -0.916 . . . . 0.0 109.827 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.606 ' CE1' ' HB3' ' A' ' 67' ' ' LEU . 3.5 t80 -72.1 -35.42 69.2 Favored 'General case' 0 C--N 1.297 -1.683 0 O-C-N 121.676 -0.64 . . . . 0.0 110.455 179.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.5 m -56.51 -49.76 73.78 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.258 -0.901 . . . . 0.0 110.567 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.5 m -66.15 -35.6 80.92 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.247 -0.908 . . . . 0.0 110.471 -179.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.13 -39.36 63.36 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.299 -0.875 . . . . 0.0 110.841 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.732 HD12 ' C ' ' A' ' 67' ' ' LEU . 0.3 OUTLIER -72.55 -41.22 66.02 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.099 -1.001 . . . . 0.0 110.413 -179.499 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.627 ' CD2' HD11 ' A' ' 67' ' ' LEU . 1.8 m-85 -98.46 4.99 48.41 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.38 -0.825 . . . . 0.0 110.206 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -90.41 161.71 28.91 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 64.5 tt0 -118.12 103.36 9.8 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.238 -1.154 . . . . 0.0 110.197 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.6 t -141.07 69.13 1.34 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.298 -0.876 . . . . 0.0 110.304 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -80.35 138.71 36.73 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.293 -0.88 . . . . 0.0 110.22 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.489 ' O ' HD23 ' A' ' 73' ' ' LEU . 6.3 tt . . . . . 0 N--CA 1.491 1.597 0 O-C-N 121.288 -0.883 . . . . 0.0 110.2 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.259 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 5.6 ptpp? -125.02 -4.57 7.48 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.288 -1.125 . . . . 0.0 110.093 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.544 ' O ' HG23 ' B' ' 13' ' ' VAL . 6.2 ttmt -62.63 -45.67 91.77 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.277 -0.89 . . . . 0.0 109.983 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.52 -37.87 79.47 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.219 -0.926 . . . . 0.0 109.906 179.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -63.34 -43.08 98.77 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.238 -0.914 . . . . 0.0 110.014 179.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . 0.465 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -63.65 -37.56 87.81 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.299 -0.875 . . . . 0.0 110.088 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.591 ' O ' HG23 ' B' ' 17' ' ' VAL . 87.9 t -60.63 -43.27 94.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.269 -0.894 . . . . 0.0 110.018 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.07 -39.07 84.77 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.298 -0.876 . . . . 0.0 110.158 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . 0.416 HG21 ' HG2' ' A' ' 9' ' ' GLN . 53.0 m -65.52 -49.01 70.53 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.182 -0.949 . . . . 0.0 110.118 179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.607 ' O ' HG23 ' B' ' 20' ' ' VAL . 36.9 t -63.53 -40.73 90.15 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.319 -0.863 . . . . 0.0 110.21 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.621 HG22 ' HG2' ' A' ' 37' ' ' GLN . 71.6 t -61.94 -47.26 94.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.224 -0.922 . . . . 0.0 110.271 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.44 -41.1 96.75 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.161 -0.962 . . . . 0.0 110.425 -179.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.78 -45.6 81.82 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.18 -0.95 . . . . 0.0 110.371 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.607 HG23 ' O ' ' B' ' 16' ' ' VAL . 58.4 t -67.83 -45.91 83.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.178 -0.951 . . . . 0.0 110.39 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -56.88 -31.78 65.19 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.253 -0.904 . . . . 0.0 110.271 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.962 ' O ' HG12 ' B' ' 25' ' ' VAL . 1.5 tt0 -56.79 -49.88 74.0 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.268 -0.895 . . . . 0.0 110.572 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.94 -34.87 73.84 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.226 -0.921 . . . . 0.0 110.545 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 2.5 tpt180 -70.34 -34.25 72.43 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.164 -0.96 . . . . 0.0 110.489 -179.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . 0.962 HG12 ' O ' ' B' ' 22' ' ' GLN . 1.8 p -63.24 -21.47 28.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.164 -0.96 . . . . 0.0 110.279 -179.703 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.86 38.9 3.5 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.319 -0.863 . . . . 0.0 110.479 -179.838 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . 0.418 ' HA ' ' HD3' ' B' ' 28' ' ' PRO . 0.4 OUTLIER -112.05 150.83 43.01 Favored Pre-proline 0 N--CA 1.491 1.585 0 O-C-N 121.198 -0.939 . . . . 0.0 110.208 179.846 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' B' ' 27' ' ' GLU . 31.3 Cg_exo -81.52 170.6 14.33 Favored 'Trans proline' 0 C--N 1.306 -1.684 0 O-C-N 123.928 1.488 . . . . 0.0 110.361 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 O-C-N 121.32 -0.863 . . . . 0.0 110.157 -179.96 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.4 mtm . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.197 0.523 . . . . 0.0 110.271 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -94.23 143.13 26.65 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.253 -0.904 . . . . 0.0 110.172 -179.956 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -76.34 -63.93 1.22 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.316 -0.865 . . . . 0.0 110.102 179.913 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.2 p -146.29 80.35 1.56 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.216 -0.928 . . . . 0.0 110.154 179.974 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 53.21 -166.41 0.07 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.229 -0.919 . . . . 0.0 110.103 -179.936 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.824 HG21 ' OH ' ' A' ' 68' ' ' TYR . 2.0 m -105.03 -28.45 11.04 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.136 -0.977 . . . . 0.0 110.107 179.89 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.88 -44.99 83.71 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.237 -0.914 . . . . 0.0 109.628 179.626 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.14 -36.01 67.78 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.467 -0.771 . . . . 0.0 109.959 179.532 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -61.11 -44.17 97.76 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.296 -0.878 . . . . 0.0 110.273 -179.642 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.473 ' HB ' ' HB3' ' A' ' 64' ' ' SER . 22.8 t -58.62 -46.36 90.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.151 -0.968 . . . . 0.0 109.964 179.842 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 21.5 mt -65.18 -49.73 77.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.303 -0.873 . . . . 0.0 109.699 179.789 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.14 -40.84 91.2 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.268 -0.895 . . . . 0.0 109.177 179.274 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.471 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 68.1 m -67.02 -41.15 87.11 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.394 -0.816 . . . . 0.0 109.277 179.134 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.537 ' HB3' ' CD2' ' A' ' 60' ' ' TYR . 1.7 m-85 -68.2 -43.01 79.03 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.386 -0.821 . . . . 0.0 109.57 179.426 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.1 ttp180 -53.24 -41.19 65.2 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.217 -0.927 . . . . 0.0 109.124 179.222 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 40.5 mt -59.8 -44.86 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.446 -0.784 . . . . 0.0 109.504 179.151 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 13' ' ' SER . 18.4 mt -65.05 -41.68 94.94 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.287 -0.883 . . . . 0.0 109.701 179.508 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.629 ' HB1' ' O ' ' A' ' 23' ' ' TYR . . . -73.29 -1.41 17.82 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.307 -0.871 . . . . 0.0 110.074 179.778 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.489 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 1.4 t 68.28 64.92 0.34 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.198 -0.939 . . . . 0.0 110.267 -179.998 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 50.26 58.2 5.75 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.397 -0.814 . . . . 0.0 110.293 179.953 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.577 ' HD3' ' CZ ' ' A' ' 23' ' ' TYR . 29.8 mttt -140.7 143.01 30.64 Favored Pre-proline 0 N--CA 1.49 1.56 0 O-C-N 121.303 -0.873 . . . . 0.0 110.085 179.852 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_endo -65.62 -7.6 16.81 Favored 'Trans proline' 0 C--N 1.305 -1.722 0 O-C-N 123.931 1.49 . . . . 0.0 110.122 179.83 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.629 ' O ' ' HB1' ' A' ' 18' ' ' ALA . 23.3 p90 -138.99 166.4 24.59 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.214 -0.929 . . . . 0.0 110.495 -179.927 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.727 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -136.32 144.48 32.85 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.374 -0.829 . . . . 0.0 109.87 -179.967 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.727 ' N ' HD13 ' A' ' 24' ' ' ILE . 4.0 mt -79.87 150.4 30.64 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.188 -0.945 . . . . 0.0 110.075 -179.825 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.581 ' HB2' HD11 ' A' ' 58' ' ' LEU . . . -67.17 -45.61 76.46 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.297 -0.877 . . . . 0.0 110.327 -179.875 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.456 ' CG ' ' N ' ' A' ' 28' ' ' GLU . 22.9 pt-20 -59.27 -37.54 77.88 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.138 -0.976 . . . . 0.0 109.747 179.883 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.456 ' N ' ' CG ' ' A' ' 27' ' ' GLU . 6.2 tt0 -66.75 -34.66 78.32 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.237 -0.914 . . . . 0.0 108.876 179.076 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.556 HD11 ' HA ' ' A' ' 38' ' ' ALA . 2.6 tp -66.67 -39.92 88.37 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 108.706 -0.849 . . . . 0.0 108.706 178.803 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.23 -34.43 78.09 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.561 -0.712 . . . . 0.0 109.544 179.065 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.7 tpt180 -84.46 -39.3 19.1 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.484 -0.76 . . . . 0.0 110.876 -179.792 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -76.15 -23.5 54.79 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.217 -0.927 . . . . 0.0 110.973 -179.084 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.684 HD11 HG11 ' B' ' 16' ' ' VAL . 4.2 mt -127.87 156.59 75.69 Favored Pre-proline 0 N--CA 1.488 1.458 0 O-C-N 121.07 -1.019 . . . . 0.0 110.228 -179.837 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.606 ' CD ' HD23 ' A' ' 33' ' ' LEU . 22.9 Cg_exo -60.01 142.49 98.55 Favored 'Trans proline' 0 C--N 1.304 -1.774 0 O-C-N 124.011 1.532 . . . . 0.0 110.184 179.979 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -41.68 -38.87 4.59 Favored 'Trans proline' 0 C--N 1.304 -1.773 0 O-C-N 124.065 1.561 . . . . 0.0 110.225 179.996 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -63.12 -43.28 98.87 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.337 -0.852 . . . . 0.0 110.242 179.956 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.794 ' HG3' HG22 ' B' ' 17' ' ' VAL . 25.0 mm100 -69.21 -41.99 76.34 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.188 -0.945 . . . . 0.0 109.981 179.966 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.556 ' HA ' HD11 ' A' ' 29' ' ' LEU . . . -63.67 -48.22 78.08 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.294 -0.879 . . . . 0.0 110.089 179.969 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -54.95 -48.6 72.96 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.251 -0.906 . . . . 0.0 109.926 179.932 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -64.01 -47.86 78.61 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.311 -0.868 . . . . 0.0 109.854 179.771 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.509 ' O ' ' HG2' ' A' ' 45' ' ' MET . 75.9 m -65.43 -49.57 68.69 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.341 -0.849 . . . . 0.0 110.381 179.929 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.474 HG12 ' O ' ' A' ' 38' ' ' ALA . 9.0 mm -41.54 -33.43 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.317 -0.865 . . . . 0.0 110.241 -179.893 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.44 -37.67 19.52 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.29 -0.881 . . . . 0.0 110.263 179.948 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.521 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 0.9 OUTLIER -65.79 -75.66 0.09 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.284 -0.885 . . . . 0.0 110.243 -179.878 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.549 ' CE ' ' HB3' ' A' ' 60' ' ' TYR . 6.3 ptp -53.02 108.58 1.14 Allowed Pre-proline 0 N--CA 1.488 1.462 0 O-C-N 121.22 -0.925 . . . . 0.0 110.175 179.952 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.506 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 17.3 Cg_exo -68.95 -147.17 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.756 0 O-C-N 123.995 1.524 . . . . 0.0 110.326 -179.865 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -83.3 152.07 25.29 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.24 -0.912 . . . . 0.0 110.237 179.989 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.511 ' CD1' ' C ' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -68.65 173.67 4.93 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.265 -0.897 . . . . 0.0 110.353 179.997 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.7 p -169.02 44.97 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.302 -0.874 . . . . 0.0 110.216 179.946 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -105.56 166.79 14.4 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.465 -1.454 . . . . 0.0 109.465 179.936 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -86.48 127.84 2.88 Favored 'Trans proline' 0 C--N 1.304 -1.769 0 O-C-N 124.069 1.562 . . . . 0.0 110.338 179.994 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.474 ' O ' ' O ' ' A' ' 53' ' ' SER . . . 96.9 -19.45 54.71 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 179.967 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.474 ' O ' ' O ' ' A' ' 52' ' ' GLY . 6.0 m -53.63 -163.93 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.291 -1.123 . . . . 0.0 110.718 -179.666 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.491 ' O ' ' CE2' ' A' ' 48' ' ' TYR . 13.4 m -148.26 166.75 14.85 Favored Pre-proline 0 N--CA 1.493 1.675 0 O-C-N 121.368 -0.833 . . . . 0.0 110.132 179.838 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -72.7 121.72 7.62 Favored 'Trans proline' 0 C--N 1.304 -1.779 0 O-C-N 124.065 1.561 . . . . 0.0 110.335 -179.891 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 119.22 -7.73 12.57 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 179.888 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.413 ' HB1' ' HB2' ' A' ' 23' ' ' TYR . . . -88.98 157.44 18.38 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.146 -1.208 . . . . 0.0 110.334 -179.978 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.581 HD11 ' HB2' ' A' ' 26' ' ' ALA . 91.7 mt -127.71 160.29 32.12 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.294 -0.879 . . . . 0.0 110.024 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -111.75 111.93 23.26 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.149 -0.969 . . . . 0.0 110.517 -179.775 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.549 ' HB3' ' CE ' ' A' ' 45' ' ' MET . 14.5 p90 -81.66 -19.82 40.87 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.318 -0.864 . . . . 0.0 109.647 179.415 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.422 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.03 -36.65 68.24 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.249 -0.907 . . . . 0.0 109.793 179.883 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.506 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -63.94 -34.95 79.14 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.224 -0.923 . . . . 0.0 109.763 179.593 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.953 ' CZ ' HD11 ' A' ' 67' ' ' LEU . 4.6 t80 -71.78 -32.74 67.96 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.567 -0.708 . . . . 0.0 110.114 179.628 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.473 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.9 OUTLIER -71.79 -49.29 40.02 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.348 -0.845 . . . . 0.0 110.297 -179.876 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 66.2 m -63.75 -42.34 97.86 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.251 -0.905 . . . . 0.0 110.301 -179.887 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.499 ' HA ' ' O ' ' A' ' 69' ' ' GLY . . . -70.52 -28.75 65.18 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.188 -0.945 . . . . 0.0 110.27 -179.87 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.953 HD11 ' CZ ' ' A' ' 63' ' ' PHE . 8.4 mt -61.44 -42.41 98.71 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.205 -0.935 . . . . 0.0 110.365 -179.935 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.824 ' OH ' HG21 ' A' ' 6' ' ' THR . 20.1 m-85 -98.39 4.43 48.51 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.208 -0.932 . . . . 0.0 110.223 179.987 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.499 ' O ' ' HA ' ' A' ' 66' ' ' ALA . . . -151.46 134.08 4.49 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 -179.962 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.439 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 11.8 pt-20 -118.41 145.38 45.24 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.323 -1.104 . . . . 0.0 110.177 -179.993 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 71.0 p -167.36 -164.7 0.62 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.235 -0.916 . . . . 0.0 110.16 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 19.7 p-10 -104.08 116.02 31.48 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.331 -0.856 . . . . 0.0 110.175 179.964 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.3 tp . . . . . 0 N--CA 1.491 1.617 0 O-C-N 121.281 -0.887 . . . . 0.0 110.218 -179.991 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.235 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 3.1 tmtm? -103.6 -65.59 1.0 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.228 -1.16 . . . . 0.0 110.132 -179.906 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.402 ' O ' HG23 ' B' ' 13' ' ' VAL . 0.7 OUTLIER -61.79 -44.69 96.37 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.18 -0.95 . . . . 0.0 110.147 179.974 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.01 -38.8 68.35 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.219 -0.926 . . . . 0.0 109.949 179.871 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -65.48 -39.93 92.51 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.286 -0.884 . . . . 0.0 110.017 179.806 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.28 -37.5 85.75 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.208 -0.933 . . . . 0.0 109.991 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.402 HG23 ' O ' ' B' ' 9' ' ' LYS . 51.9 t -65.0 -40.44 89.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.208 -0.933 . . . . 0.0 109.8 179.658 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.63 -35.59 76.57 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.326 -0.858 . . . . 0.0 110.058 179.843 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 41.2 m -68.1 -43.6 78.12 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.291 -0.88 . . . . 0.0 110.238 -179.981 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.684 HG11 HD11 ' A' ' 33' ' ' LEU . 92.1 t -66.6 -42.48 89.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.273 -0.892 . . . . 0.0 110.134 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.794 HG22 ' HG3' ' A' ' 37' ' ' GLN . 70.1 t -63.38 -47.54 91.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.406 -0.809 . . . . 0.0 110.313 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.31 -40.76 95.36 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.307 -0.871 . . . . 0.0 110.198 -179.976 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.67 -37.97 88.0 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.286 -0.884 . . . . 0.0 110.236 179.977 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.526 HG23 ' O ' ' B' ' 16' ' ' VAL . 54.5 t -67.92 -43.86 85.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.199 -0.938 . . . . 0.0 110.273 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.44 ' O ' HG23 ' B' ' 25' ' ' VAL . 38.4 t0 -62.1 -35.57 79.1 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.308 -0.87 . . . . 0.0 110.366 -179.965 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -60.05 -50.08 75.12 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.222 -0.924 . . . . 0.0 110.297 -179.978 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.43 ' HB2' ' CD2' ' A' ' 67' ' ' LEU . . . -63.76 -35.07 79.39 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.278 -0.889 . . . . 0.0 110.107 179.994 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.22 -41.53 73.48 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.247 -0.908 . . . . 0.0 110.182 179.833 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . 0.598 HG12 ' HB2' ' B' ' 27' ' ' GLU . 65.8 t -78.34 -21.73 13.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 121.242 -0.911 . . . . 0.0 110.245 -179.979 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 48.87 35.73 7.07 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.406 -0.809 . . . . 0.0 110.456 179.773 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . 0.598 ' HB2' HG12 ' B' ' 25' ' ' VAL . 5.4 tt0 -111.95 140.84 23.85 Favored Pre-proline 0 N--CA 1.492 1.674 0 O-C-N 121.096 -1.003 . . . . 0.0 110.237 179.906 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' B' ' 27' ' ' GLU . 38.4 Cg_exo -86.43 -67.47 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.694 0 O-C-N 124.006 1.529 . . . . 0.0 110.36 179.914 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.176 -0.952 . . . . 0.0 110.276 -179.962 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 121.197 0.522 . . . . 0.0 110.233 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -140.26 102.87 4.46 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.296 -0.877 . . . . 0.0 110.186 -179.963 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.407 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 7.5 t0 -122.74 27.88 7.56 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.261 -0.899 . . . . 0.0 110.222 179.99 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.2 p -91.41 79.69 5.56 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.242 -0.911 . . . . 0.0 110.257 -179.871 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -133.28 177.96 7.27 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.233 -0.917 . . . . 0.0 110.225 179.875 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.78 -66.53 1.04 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.224 -0.923 . . . . 0.0 110.191 -179.885 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.68 -47.78 77.17 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.186 -0.946 . . . . 0.0 109.867 179.909 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.65 -36.15 64.26 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.425 -0.797 . . . . 0.0 109.981 179.586 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.407 ' NE2' ' O ' ' A' ' 3' ' ' ASP . 0.0 OUTLIER -61.45 -44.68 96.68 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.364 -0.835 . . . . 0.0 110.37 -179.711 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.48 HG21 HD21 ' A' ' 67' ' ' LEU . 88.6 t -57.99 -41.38 80.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.261 -0.9 . . . . 0.0 110.012 179.996 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 59.5 mt -63.65 -49.83 80.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.359 -0.838 . . . . 0.0 109.651 179.653 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.25 -42.45 91.15 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.284 -0.885 . . . . 0.0 109.033 179.22 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.471 ' HA ' HD12 ' A' ' 16' ' ' ILE . 0.1 OUTLIER -64.09 -39.43 94.05 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.379 -0.826 . . . . 0.0 109.302 179.033 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.623 ' CB ' ' CD1' ' A' ' 60' ' ' TYR . 3.1 m-85 -68.15 -42.17 80.51 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.308 -0.87 . . . . 0.0 109.51 179.282 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -55.85 -41.18 73.94 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.166 -0.959 . . . . 0.0 109.429 179.209 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.637 ' CD1' ' HB2' ' B' ' 12' ' ' ALA . 96.8 mt -60.27 -44.84 96.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.388 -0.82 . . . . 0.0 109.728 179.408 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 13' ' ' SER . 61.1 mt -64.98 -41.89 95.04 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.315 -0.866 . . . . 0.0 109.548 179.561 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.566 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -71.06 -15.27 62.53 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.357 -0.839 . . . . 0.0 110.089 179.625 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.478 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.2 OUTLIER 68.05 72.25 0.31 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.291 -0.881 . . . . 0.0 110.339 -179.985 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.463 ' HB2' ' O ' ' A' ' 19' ' ' SER . 2.7 m-20 56.62 61.9 2.49 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.347 -0.845 . . . . 0.0 110.367 179.857 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.566 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 35.1 mttp -153.5 142.1 14.3 Favored Pre-proline 0 N--CA 1.489 1.49 0 O-C-N 121.274 -0.891 . . . . 0.0 110.093 179.878 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.402 ' HG2' ' HG2' ' A' ' 51' ' ' PRO . 12.0 Cg_endo -76.59 3.9 6.02 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 O-C-N 124.092 1.575 . . . . 0.0 110.188 179.912 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.416 ' CD1' ' C ' ' A' ' 23' ' ' TYR . 20.6 p90 -145.9 156.52 43.59 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.185 -0.947 . . . . 0.0 110.026 179.999 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.827 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -125.67 142.74 41.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.169 -0.957 . . . . 0.0 109.735 179.997 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.827 ' N ' HD13 ' A' ' 24' ' ' ILE . 6.0 mp -80.14 145.81 32.15 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.132 -0.98 . . . . 0.0 109.919 -179.729 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.469 ' O ' ' HG ' ' A' ' 29' ' ' LEU . . . -58.68 -44.91 90.36 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.324 -0.86 . . . . 0.0 110.366 -179.628 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.77 -34.18 77.74 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.216 -0.928 . . . . 0.0 110.369 180.0 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.619 ' HB3' HD11 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -64.08 -51.08 65.74 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.12 -0.988 . . . . 0.0 110.288 -179.698 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.861 HD21 ' CG1' ' A' ' 42' ' ' ILE . 1.0 OUTLIER -67.27 -33.54 75.51 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.141 -0.974 . . . . 0.0 109.579 179.402 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.802 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -61.23 -35.0 76.04 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.524 -0.735 . . . . 0.0 110.347 -179.965 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.2 ttt180 -94.03 -17.83 22.48 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.221 -0.925 . . . . 0.0 110.262 -179.949 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -90.09 -21.62 22.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.273 -0.892 . . . . 0.0 110.246 179.972 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.702 HD11 HG11 ' B' ' 16' ' ' VAL . 11.2 mt -117.59 154.27 50.69 Favored Pre-proline 0 N--CA 1.487 1.395 0 O-C-N 121.261 -0.899 . . . . 0.0 110.249 -179.698 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.468 ' HD2' ' HB2' ' A' ' 37' ' ' GLN . 39.7 Cg_exo -59.24 153.87 50.17 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 O-C-N 123.875 1.461 . . . . 0.0 110.134 179.788 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -43.89 -44.1 11.95 Favored 'Trans proline' 0 C--N 1.305 -1.72 0 O-C-N 124.088 1.573 . . . . 0.0 110.542 -179.857 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.424 ' O ' ' HB2' ' A' ' 40' ' ' TYR . 0.3 OUTLIER -65.53 -46.91 77.76 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.273 -0.892 . . . . 0.0 110.393 -179.835 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.612 ' HG2' HG22 ' B' ' 17' ' ' VAL . 3.8 mp0 -69.69 -41.82 74.94 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.202 -0.936 . . . . 0.0 110.377 -179.935 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.802 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -59.21 -48.38 81.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.183 -0.948 . . . . 0.0 110.374 -179.811 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 -66.23 -43.48 86.49 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.25 -0.906 . . . . 0.0 110.37 -179.894 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.424 ' HB2' ' O ' ' A' ' 36' ' ' ASP . 1.2 t80 -62.31 -47.08 85.88 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.31 -0.869 . . . . 0.0 110.548 -179.76 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.455 ' O ' ' SD ' ' A' ' 45' ' ' MET . 71.9 m -62.43 -51.17 68.59 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.284 -0.885 . . . . 0.0 110.508 -179.668 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.861 ' CG1' HD21 ' A' ' 29' ' ' LEU . 53.3 mt -58.84 -19.08 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.244 -0.91 . . . . 0.0 110.332 -179.96 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 4.9 tttm -85.22 -19.98 30.84 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.323 -0.861 . . . . 0.0 110.529 -179.717 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.601 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 12.6 mmt85 -100.35 -72.82 0.66 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.176 -0.953 . . . . 0.0 110.759 -179.56 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.531 ' N ' ' HB2' ' A' ' 63' ' ' PHE . 1.4 ptm -45.25 127.47 5.85 Favored Pre-proline 0 N--CA 1.487 1.412 0 O-C-N 121.14 -0.975 . . . . 0.0 110.265 -179.698 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.706 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 9.4 Cg_endo -52.51 -170.33 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.738 0 O-C-N 124.084 1.571 . . . . 0.0 110.3 -179.94 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.509 ' O ' ' HB2' ' A' ' 48' ' ' TYR . . . -108.22 37.88 2.36 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.253 -0.904 . . . . 0.0 110.473 -179.713 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.509 ' HB2' ' O ' ' A' ' 47' ' ' ALA . 88.1 t80 179.3 174.68 0.74 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.295 -0.878 . . . . 0.0 110.175 179.771 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.507 ' HB3' ' HD2' ' A' ' 51' ' ' PRO . 0.1 OUTLIER -137.51 -56.47 0.69 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.244 -0.91 . . . . 0.0 110.333 -179.962 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.506 ' N ' ' CD ' ' A' ' 51' ' ' PRO . . . 164.39 -52.59 0.28 Allowed Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.805 -1.318 . . . . 0.0 109.805 -179.997 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.507 ' HD2' ' HB3' ' A' ' 49' ' ' SER . 33.1 Cg_exo -46.96 173.28 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.732 0 O-C-N 123.947 1.498 . . . . 0.0 110.387 -179.948 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.563 ' O ' HG13 ' A' ' 54' ' ' VAL . . . -49.23 102.75 0.06 OUTLIER Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.711 -1.356 . . . . 0.0 109.711 -179.832 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.461 ' C ' ' O ' ' A' ' 52' ' ' GLY . 0.0 OUTLIER -37.83 139.5 0.31 Allowed 'General case' 0 C--N 1.308 -1.221 0 O-C-N 121.517 -0.99 . . . . 0.0 110.771 -179.754 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.641 HG22 ' HB2' ' A' ' 57' ' ' ALA . 34.5 m -128.28 161.16 58.17 Favored Pre-proline 0 C--N 1.294 -1.808 0 O-C-N 121.697 -0.627 . . . . 0.0 110.248 -179.894 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.405 ' HD2' ' HB ' ' A' ' 54' ' ' VAL . 37.4 Cg_exo -45.18 96.68 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.74 0 O-C-N 124.05 1.553 . . . . 0.0 110.328 179.977 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.435 ' N ' ' O ' ' A' ' 54' ' ' VAL . . . 77.1 78.55 0.74 Allowed Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.611 -1.396 . . . . 0.0 109.611 179.85 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.641 ' HB2' HG22 ' A' ' 54' ' ' VAL . . . -117.21 121.6 41.68 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.275 -1.132 . . . . 0.0 110.213 179.876 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.5 HD12 ' N ' ' A' ' 58' ' ' LEU . 2.5 mp -129.03 143.66 50.94 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.223 -0.923 . . . . 0.0 110.089 179.592 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.543 ' OD1' ' HB3' ' A' ' 61' ' ' ALA . 7.7 t0 -94.69 111.29 23.06 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.18 -0.95 . . . . 0.0 110.244 179.755 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.623 ' CD1' ' CB ' ' A' ' 14' ' ' PHE . 21.7 p90 -76.87 -25.29 52.92 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.189 -0.944 . . . . 0.0 108.882 179.118 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.543 ' HB3' ' OD1' ' A' ' 59' ' ' ASP . . . -56.42 -45.35 80.76 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.519 -0.738 . . . . 0.0 109.449 179.33 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.706 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -57.16 -36.15 70.4 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.346 -0.846 . . . . 0.0 109.643 179.549 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.601 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 1.6 t80 -71.8 -37.86 70.32 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.647 -0.658 . . . . 0.0 110.004 179.581 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.4 p -56.03 -49.73 72.89 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.313 -0.867 . . . . 0.0 110.234 -179.897 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.1 m -62.27 -37.3 84.95 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.165 -0.96 . . . . 0.0 110.064 179.892 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.89 -39.05 64.17 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.234 -0.916 . . . . 0.0 110.115 179.753 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.701 HD12 ' C ' ' A' ' 67' ' ' LEU . 0.1 OUTLIER -60.32 -44.86 95.08 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.247 -0.908 . . . . 0.0 109.593 179.893 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.557 ' N ' ' HG ' ' A' ' 67' ' ' LEU . 4.5 m-85 -95.5 5.12 52.37 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.569 -0.707 . . . . 0.0 110.239 179.985 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 85.19 137.35 4.01 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.641 -1.384 . . . . 0.0 109.641 179.927 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -96.27 -49.13 5.34 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.263 -1.139 . . . . 0.0 110.172 179.998 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 58.7 m -163.25 -85.04 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.199 -0.938 . . . . 0.0 110.12 179.905 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.489 ' N ' ' OD1' ' A' ' 72' ' ' ASP . 38.1 p-10 -96.57 103.15 15.04 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.246 -0.908 . . . . 0.0 110.103 179.874 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.8 HD22 ' C ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.667 0 O-C-N 121.264 -0.897 . . . . 0.0 110.447 -179.859 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.244 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 24.6 ttmt -97.48 6.35 48.29 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.298 -1.119 . . . . 0.0 110.153 -179.955 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.413 ' HA ' HG21 ' A' ' 16' ' ' ILE . 8.7 ttpt -62.37 -48.44 79.78 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.274 -0.891 . . . . 0.0 110.174 -179.935 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.74 -40.22 72.21 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.196 -0.94 . . . . 0.0 109.986 179.915 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.35 -41.43 98.85 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.215 -0.928 . . . . 0.0 109.974 179.855 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . 0.637 ' HB2' ' CD1' ' A' ' 16' ' ' ILE . . . -62.86 -42.83 99.9 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.276 -0.89 . . . . 0.0 110.057 179.909 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.665 ' O ' HG23 ' B' ' 17' ' ' VAL . 79.0 t -57.53 -43.06 82.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.261 -0.899 . . . . 0.0 110.057 179.829 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.94 -37.55 85.13 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.338 -0.851 . . . . 0.0 109.97 179.849 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . 0.402 ' HB ' ' OG ' ' A' ' 13' ' ' SER . 11.8 m -64.61 -44.26 91.13 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.296 -0.878 . . . . 0.0 109.879 179.91 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.702 HG11 HD11 ' A' ' 33' ' ' LEU . 73.5 t -65.71 -45.54 91.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.294 -0.879 . . . . 0.0 110.043 179.935 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.665 HG23 ' O ' ' B' ' 13' ' ' VAL . 59.5 t -58.42 -45.84 89.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.255 -0.903 . . . . 0.0 110.116 179.914 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.36 -43.79 93.45 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.297 -0.877 . . . . 0.0 110.256 179.993 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.44 -45.86 82.18 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.279 -0.888 . . . . 0.0 110.2 -179.95 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.427 HG23 ' O ' ' B' ' 16' ' ' VAL . 54.8 t -60.22 -41.17 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.259 -0.9 . . . . 0.0 110.056 179.826 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.646 ' O ' HG23 ' B' ' 25' ' ' VAL . 13.1 t70 -64.79 -33.01 74.98 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.364 -0.835 . . . . 0.0 110.143 179.994 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.36 -49.98 75.71 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.206 -0.934 . . . . 0.0 110.027 179.881 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.42 -40.42 97.13 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.253 -0.905 . . . . 0.0 109.993 179.805 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 2.4 ttp85 -61.05 -32.6 72.23 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.37 -0.831 . . . . 0.0 110.316 -179.966 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . 0.646 HG23 ' O ' ' B' ' 21' ' ' ASP . 70.6 t -71.06 -21.12 21.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.195 -0.941 . . . . 0.0 110.44 -179.734 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.23 44.41 1.32 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.297 -0.877 . . . . 0.0 110.515 -179.666 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . 0.519 ' O ' ' N ' ' B' ' 29' ' ' ARG . 3.9 tt0 -111.18 124.23 33.27 Favored Pre-proline 0 N--CA 1.493 1.69 0 O-C-N 121.135 -0.978 . . . . 0.0 110.083 179.766 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' B' ' 27' ' ' GLU . 21.1 Cg_exo -63.77 69.12 0.19 Allowed 'Trans proline' 0 C--N 1.307 -1.647 0 O-C-N 123.967 1.509 . . . . 0.0 110.326 -179.912 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . 0.519 ' N ' ' O ' ' B' ' 27' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.186 -0.946 . . . . 0.0 110.204 179.889 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.432 ' O ' ' HB3' ' A' ' 2' ' ' ALA . 2.7 mtt . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.21 0.529 . . . . 0.0 110.219 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.463 ' O ' ' O ' ' A' ' 3' ' ' ASP . . . 56.84 -105.63 0.28 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.273 -0.892 . . . . 0.0 110.261 -179.982 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.463 ' O ' ' O ' ' A' ' 2' ' ' ALA . 15.8 t0 59.2 122.02 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.945 -1.097 . . . . 0.0 110.362 179.929 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 9.9 t -143.24 143.46 31.75 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.166 -0.959 . . . . 0.0 110.22 179.946 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.505 ' O ' ' N ' ' A' ' 7' ' ' ALA . 4.5 t0 -169.44 48.36 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.156 -0.965 . . . . 0.0 110.173 -179.955 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.601 HG22 ' CZ ' ' A' ' 68' ' ' TYR . 7.4 m 63.19 -71.57 0.05 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.328 -0.857 . . . . 0.0 110.248 -179.939 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.505 ' N ' ' O ' ' A' ' 5' ' ' ASP . . . -68.41 -36.2 78.75 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.158 -0.964 . . . . 0.0 109.561 179.702 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.593 ' HA ' HD12 ' A' ' 11' ' ' ILE . 0.5 OUTLIER -70.69 -36.49 73.32 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.401 -0.812 . . . . 0.0 109.812 179.474 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.57 -42.62 99.11 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.33 -0.856 . . . . 0.0 110.081 179.9 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.527 HG12 ' CD2' ' A' ' 14' ' ' PHE . 96.0 t -60.61 -46.44 95.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.224 -0.922 . . . . 0.0 109.829 179.643 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.593 HD12 ' HA ' ' A' ' 8' ' ' GLU . 56.8 mt -54.73 -45.78 73.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.328 -0.858 . . . . 0.0 109.393 179.471 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.72 -41.07 81.03 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.22 -0.925 . . . . 0.0 108.635 178.859 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.4 m -68.21 -37.95 81.42 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 178.718 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.577 ' HB3' ' CD1' ' A' ' 60' ' ' TYR . 1.9 m-85 -68.39 -41.95 79.77 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.452 -0.78 . . . . 0.0 109.387 179.033 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -54.15 -46.42 72.27 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.407 -0.808 . . . . 0.0 109.393 179.355 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 53.2 mt -58.13 -43.69 85.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.389 -0.819 . . . . 0.0 109.501 179.336 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.481 HD11 HG22 ' B' ' 13' ' ' VAL . 2.5 mp -65.0 -40.13 94.49 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.397 -0.814 . . . . 0.0 109.748 179.485 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.669 ' HB2' ' HB ' ' A' ' 24' ' ' ILE . . . -77.19 -1.35 29.02 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.374 -0.829 . . . . 0.0 110.246 179.739 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.483 ' O ' ' HG3' ' A' ' 21' ' ' LYS . 0.3 OUTLIER 68.71 63.87 0.32 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.226 -0.922 . . . . 0.0 110.308 179.965 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 51.68 59.02 4.87 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.19 -0.944 . . . . 0.0 110.141 179.937 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 19' ' ' SER . 9.0 mttt -145.46 142.92 18.75 Favored Pre-proline 0 N--CA 1.49 1.525 0 O-C-N 121.248 -0.908 . . . . 0.0 110.071 179.985 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -69.63 -4.84 14.76 Favored 'Trans proline' 0 C--N 1.305 -1.723 0 O-C-N 123.973 1.512 . . . . 0.0 109.907 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.434 ' CD1' ' C ' ' A' ' 23' ' ' TYR . 19.6 p90 -144.77 161.9 38.09 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.349 -0.844 . . . . 0.0 109.884 179.866 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.669 ' HB ' ' HB2' ' A' ' 18' ' ' ALA . 11.3 tt -139.32 153.14 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.137 -0.977 . . . . 0.0 110.311 -179.823 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.2 mp -89.24 156.24 18.89 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.309 -0.87 . . . . 0.0 109.964 179.798 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.38 -42.23 92.92 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.172 -0.955 . . . . 0.0 110.256 -179.825 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -56.45 -40.48 74.87 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.28 -0.887 . . . . 0.0 110.152 179.931 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 1.9 mt-10 -68.32 -41.12 81.31 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.212 -0.93 . . . . 0.0 108.771 179.215 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.702 HD23 HG13 ' A' ' 42' ' ' ILE . 3.3 tp -66.83 -38.84 87.19 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 179.012 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.5 ttm180 -66.96 -34.58 78.08 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.559 -0.713 . . . . 0.0 110.587 -179.923 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.08 -20.26 22.24 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.21 -0.931 . . . . 0.0 111.04 -179.391 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.461 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 86.2 mt-10 -94.87 -19.26 20.44 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.012 -1.055 . . . . 0.0 110.814 -179.447 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.617 HD12 ' CD1' ' A' ' 29' ' ' LEU . 5.7 mt -120.92 162.06 37.03 Favored Pre-proline 0 N--CA 1.489 1.498 0 O-C-N 121.079 -1.013 . . . . 0.0 110.303 -179.857 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.492 ' CD ' HD23 ' A' ' 33' ' ' LEU . 32.5 Cg_exo -67.76 148.43 77.27 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 124.032 1.543 . . . . 0.0 110.246 179.914 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.402 ' C ' ' O ' ' A' ' 34' ' ' PRO . 16.6 Cg_exo -41.78 -40.59 5.73 Favored 'Trans proline' 0 C--N 1.303 -1.864 0 O-C-N 124.116 1.588 . . . . 0.0 110.496 -179.823 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 -63.58 -47.25 82.27 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.223 -0.923 . . . . 0.0 110.37 -179.705 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.636 ' HG2' HG22 ' B' ' 17' ' ' VAL . 14.5 mp0 -69.58 -40.85 76.47 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.192 -0.943 . . . . 0.0 110.267 179.957 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.865 ' O ' HD12 ' A' ' 42' ' ' ILE . . . -58.88 -47.84 83.51 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.303 -0.873 . . . . 0.0 110.299 -179.921 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 48.7 tp60 -61.63 -48.83 79.12 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.309 -0.869 . . . . 0.0 110.378 -179.906 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.19 -42.22 89.15 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.235 -0.916 . . . . 0.0 110.228 179.991 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 13.7 m -63.65 -48.24 78.03 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.305 -0.872 . . . . 0.0 110.15 179.885 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.865 HD12 ' O ' ' A' ' 38' ' ' ALA . 1.2 mt -61.23 -21.24 24.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.274 -0.891 . . . . 0.0 110.071 -179.993 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -81.56 -39.79 24.08 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.15 -0.969 . . . . 0.0 110.144 179.794 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.599 ' HB2' ' CD2' ' A' ' 63' ' ' PHE . 40.4 mmt-85 -77.11 -66.09 0.87 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.273 -0.892 . . . . 0.0 109.97 179.805 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.634 ' HE3' ' CB ' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -29.91 114.92 0.31 Allowed Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.9 -0.5 . . . . 0.0 111.471 179.648 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.801 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 18.5 Cg_endo -94.18 -158.65 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.743 0 O-C-N 124.003 1.528 . . . . 0.0 109.932 179.649 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.81 124.63 32.52 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.197 -0.94 . . . . 0.0 110.189 179.863 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -68.48 132.71 47.45 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.34 -0.85 . . . . 0.0 110.224 -179.848 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.489 ' HB3' ' O ' ' A' ' 52' ' ' GLY . 0.6 OUTLIER 59.2 157.88 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.368 -0.833 . . . . 0.0 110.482 179.972 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -84.05 -73.49 1.26 Allowed Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -99.19 27.08 0.16 Allowed 'Trans proline' 0 C--N 1.305 -1.73 0 O-C-N 124.037 1.546 . . . . 0.0 110.199 -179.96 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.686 ' O ' ' CB ' ' A' ' 53' ' ' SER . . . -140.26 147.26 18.96 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -179.993 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.686 ' CB ' ' O ' ' A' ' 52' ' ' GLY . 30.1 t 130.91 -166.56 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.385 0 C-N-CA 124.003 0.921 . . . . 0.0 109.518 179.832 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.478 HG23 ' HB2' ' A' ' 57' ' ' ALA . 13.4 m -135.19 156.07 78.41 Favored Pre-proline 0 N--CA 1.491 1.596 0 O-C-N 121.295 -0.878 . . . . 0.0 110.198 179.87 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -60.46 100.54 0.15 Allowed 'Trans proline' 0 C--N 1.306 -1.705 0 O-C-N 123.94 1.495 . . . . 0.0 110.281 -179.986 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 123.61 8.98 6.06 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.714 -1.354 . . . . 0.0 109.714 179.903 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.756 ' C ' HD22 ' A' ' 58' ' ' LEU . . . -104.64 119.18 38.4 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.204 -1.174 . . . . 0.0 110.143 -179.969 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.789 HD22 ' N ' ' A' ' 58' ' ' LEU . 3.1 mm? -113.66 160.49 18.55 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.361 -0.837 . . . . 0.0 110.021 179.962 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.886 ' OD1' ' HB3' ' A' ' 61' ' ' ALA . 6.9 t70 -109.38 110.23 21.31 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.993 -1.067 . . . . 0.0 111.008 -179.915 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.634 ' CB ' ' HE3' ' A' ' 45' ' ' MET . 26.4 p90 -73.1 -23.61 60.53 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 178.192 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.886 ' HB3' ' OD1' ' A' ' 59' ' ' ASP . . . -56.29 -40.68 74.67 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.702 -0.624 . . . . 0.0 109.71 179.667 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.801 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -56.4 -32.17 64.57 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.241 -0.912 . . . . 0.0 109.619 179.532 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.599 ' CD2' ' HB2' ' A' ' 44' ' ' ARG . 1.7 t80 -65.78 -47.6 74.63 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.6 -0.688 . . . . 0.0 110.559 179.976 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.0 t -55.81 -47.53 77.0 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.168 -0.958 . . . . 0.0 110.759 -179.288 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.32 -39.19 92.13 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.14 -0.975 . . . . 0.0 110.521 -179.721 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.26 -30.53 57.89 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.149 -0.969 . . . . 0.0 110.556 -179.656 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.815 HD13 ' HB2' ' B' ' 23' ' ' ALA . 0.6 OUTLIER -78.59 -45.2 22.24 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.119 -0.988 . . . . 0.0 109.603 -179.955 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.601 ' CZ ' HG22 ' A' ' 6' ' ' THR . 17.1 m-85 -96.37 9.7 40.41 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.535 -0.728 . . . . 0.0 110.316 179.961 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -94.48 -147.65 22.72 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.916 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.403 ' O ' ' O ' ' A' ' 71' ' ' SER . 10.5 pt-20 -129.33 -168.47 1.94 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.26 -1.141 . . . . 0.0 110.155 -179.951 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.403 ' O ' ' O ' ' A' ' 70' ' ' GLU . 0.2 OUTLIER 61.03 149.65 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.239 -0.913 . . . . 0.0 110.264 179.986 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -104.55 125.02 50.31 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.231 -0.918 . . . . 0.0 110.262 179.946 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 51.0 mt . . . . . 0 N--CA 1.492 1.629 0 O-C-N 121.278 -0.889 . . . . 0.0 110.188 -179.931 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' B' B ' 7' ' ' GLY . . . . . 0.5 ' O ' ' N ' ' B' ' 9' ' ' LYS . . . . . . . . 0 N--CA 1.49 2.285 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.468 ' CB ' ' O ' ' B' ' 7' ' ' GLY . 0.7 OUTLIER 66.85 -59.68 0.37 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.208 -1.172 . . . . 0.0 110.161 -179.92 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.728 ' O ' HG23 ' B' ' 13' ' ' VAL . 2.4 ttmt -57.84 -50.04 74.62 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.2 -0.938 . . . . 0.0 109.926 179.863 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.0 -38.36 67.79 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.184 -0.948 . . . . 0.0 109.706 179.66 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -67.79 -41.03 83.82 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.407 -0.808 . . . . 0.0 109.874 179.684 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.53 -37.67 88.36 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.315 -0.865 . . . . 0.0 109.902 179.718 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.728 HG23 ' O ' ' B' ' 9' ' ' LYS . 46.5 t -61.1 -41.51 89.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.266 -0.896 . . . . 0.0 109.998 179.732 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.95 -42.94 99.97 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.264 -0.897 . . . . 0.0 110.022 179.778 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 90.6 m -61.29 -43.2 99.26 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.22 -0.925 . . . . 0.0 110.159 179.88 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.663 ' O ' HG23 ' B' ' 20' ' ' VAL . 98.2 t -64.81 -41.27 91.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.177 -0.952 . . . . 0.0 110.053 179.86 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.664 HG23 ' O ' ' B' ' 13' ' ' VAL . 86.5 t -59.87 -46.31 93.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.295 -0.878 . . . . 0.0 110.271 -179.964 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.17 -39.63 94.41 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.247 -0.908 . . . . 0.0 110.27 -179.948 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.42 -41.49 96.58 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.257 -0.902 . . . . 0.0 110.399 -179.855 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.663 HG23 ' O ' ' B' ' 16' ' ' VAL . 61.4 t -67.01 -41.67 87.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.225 -0.922 . . . . 0.0 110.367 -179.807 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.642 ' O ' HG23 ' B' ' 25' ' ' VAL . 0.4 OUTLIER -60.86 -40.14 91.8 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.269 -0.894 . . . . 0.0 110.303 -179.964 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.21 -49.03 72.99 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.251 -0.905 . . . . 0.0 110.287 -179.977 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.815 ' HB2' HD13 ' A' ' 67' ' ' LEU . . . -63.02 -37.44 87.18 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.277 -0.889 . . . . 0.0 110.233 179.997 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 9.9 ttp180 -68.42 -45.16 73.32 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.271 -0.893 . . . . 0.0 110.05 179.925 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . 0.642 HG23 ' O ' ' B' ' 21' ' ' ASP . 20.3 t -73.16 -20.83 18.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.223 -0.923 . . . . 0.0 110.239 179.996 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.4 ' C ' ' O ' ' B' ' 25' ' ' VAL . 1.5 mtt180 43.84 48.05 6.91 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.277 -0.889 . . . . 0.0 110.375 179.662 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . 0.494 ' CG ' ' O ' ' B' ' 27' ' ' GLU . 4.9 pt-20 -100.55 121.33 53.42 Favored Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.157 -0.964 . . . . 0.0 110.241 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -65.2 80.28 0.21 Allowed 'Trans proline' 0 C--N 1.305 -1.755 0 O-C-N 123.986 1.519 . . . . 0.0 110.071 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 14.9 mtt85 . . . . . 0 N--CA 1.49 1.574 0 O-C-N 121.159 -0.963 . . . . 0.0 110.232 -179.828 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 ttt . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 121.193 0.52 . . . . 0.0 110.292 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 53.49 -179.51 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.213 -0.929 . . . . 0.0 110.277 179.999 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.637 ' O ' HG22 ' A' ' 4' ' ' THR . 33.4 t70 -68.74 -65.15 0.74 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.245 -0.909 . . . . 0.0 110.066 179.924 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.637 HG22 ' O ' ' A' ' 3' ' ' ASP . 14.7 t 37.97 -152.83 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.627 -0.671 . . . . 0.0 110.602 179.886 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.401 ' N ' HG23 ' A' ' 4' ' ' THR . 4.3 m-20 -97.96 112.22 24.24 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.241 -0.912 . . . . 0.0 110.294 -179.981 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -87.62 -39.69 14.84 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.182 -0.949 . . . . 0.0 110.134 179.878 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -66.16 -46.82 76.09 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.262 -0.899 . . . . 0.0 109.725 179.826 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.571 ' HA ' HD12 ' A' ' 11' ' ' ILE . 23.4 tt0 -54.52 -36.78 64.6 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.358 -0.839 . . . . 0.0 109.82 179.633 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -62.02 -48.39 80.49 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.29 -0.881 . . . . 0.0 109.91 179.92 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.531 HG12 ' HD2' ' A' ' 14' ' ' PHE . 77.7 t -58.92 -43.25 88.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.251 -0.906 . . . . 0.0 109.773 179.657 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.571 HD12 ' HA ' ' A' ' 8' ' ' GLU . 45.0 mt -62.0 -47.07 94.92 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.305 -0.872 . . . . 0.0 109.545 179.433 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.56 -42.13 82.41 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.324 -0.86 . . . . 0.0 108.944 179.175 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.473 ' O ' HD13 ' A' ' 17' ' ' LEU . 0.8 OUTLIER -68.43 -40.39 81.19 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.416 -0.802 . . . . 0.0 109.277 179.004 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.558 ' HB3' ' CD1' ' A' ' 60' ' ' TYR . 1.7 m-85 -65.26 -42.94 92.73 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.242 -0.911 . . . . 0.0 109.587 179.396 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 35.8 ttm-85 -55.96 -47.08 78.27 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.302 -0.873 . . . . 0.0 109.579 179.388 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.1 mt -60.73 -41.14 87.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 121.398 -0.814 . . . . 0.0 109.649 179.403 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.531 HD23 ' OE2' ' A' ' 32' ' ' GLU . 5.5 mp -64.86 -40.5 95.24 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.419 -0.8 . . . . 0.0 109.781 179.602 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.585 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -73.65 -4.89 37.04 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.405 -0.809 . . . . 0.0 110.103 179.842 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.458 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.1 OUTLIER 67.46 59.42 0.5 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.298 -0.876 . . . . 0.0 110.158 -179.948 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.423 ' CB ' ' O ' ' A' ' 19' ' ' SER . 0.2 OUTLIER 63.96 64.66 0.74 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.276 -0.89 . . . . 0.0 110.295 179.939 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.585 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 73.4 mttt -153.02 143.6 15.67 Favored Pre-proline 0 N--CA 1.489 1.491 0 O-C-N 121.212 -0.93 . . . . 0.0 110.093 -179.979 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -75.69 2.0 7.44 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 O-C-N 123.957 1.504 . . . . 0.0 110.011 179.539 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.549 ' CD1' ' N ' ' A' ' 23' ' ' TYR . 14.7 p90 -142.48 169.7 17.09 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.326 -0.858 . . . . 0.0 109.952 179.949 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.823 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -137.27 141.63 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.104 -0.998 . . . . 0.0 110.165 -179.897 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.823 ' N ' HD13 ' A' ' 24' ' ' ILE . 1.4 mp -81.54 153.6 26.69 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.21 -0.931 . . . . 0.0 110.127 -179.925 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.478 ' O ' ' HG ' ' A' ' 29' ' ' LEU . . . -68.27 -38.53 81.82 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.366 -0.834 . . . . 0.0 110.403 -179.775 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -69.25 -34.2 74.43 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.252 -0.905 . . . . 0.0 109.937 179.852 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.498 ' OE2' ' HA ' ' A' ' 18' ' ' ALA . 14.5 tt0 -65.5 -50.97 63.29 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.23 -0.919 . . . . 0.0 109.951 -179.98 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.733 HD12 ' C ' ' A' ' 29' ' ' LEU . 1.2 pp -67.3 -33.74 75.91 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.187 -0.945 . . . . 0.0 109.716 179.378 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.636 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 10.3 mtt-85 -63.73 -34.1 77.13 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.427 -0.796 . . . . 0.0 110.381 179.974 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.14 -16.33 29.78 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.205 -0.934 . . . . 0.0 111.255 -179.174 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.562 ' CG ' ' HA ' ' A' ' 29' ' ' LEU . 0.8 OUTLIER -99.51 -23.77 14.99 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.807 -1.183 . . . . 0.0 110.726 -179.667 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.652 HD22 ' HB3' ' A' ' 37' ' ' GLN . 4.3 mt -108.89 139.86 21.31 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.229 -0.919 . . . . 0.0 110.44 -179.994 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.492 ' HD2' HD23 ' A' ' 33' ' ' LEU . 37.5 Cg_exo -44.36 139.47 6.61 Favored 'Trans proline' 0 C--N 1.306 -1.693 0 O-C-N 123.962 1.506 . . . . 0.0 109.87 179.676 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.438 ' C ' ' O ' ' A' ' 34' ' ' PRO . 24.9 Cg_exo -39.92 -39.01 2.13 Favored 'Trans proline' 0 C--N 1.306 -1.693 0 O-C-N 124.027 1.541 . . . . 0.0 110.574 -179.563 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.16 -45.98 79.03 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.244 -0.91 . . . . 0.0 110.805 -179.891 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.652 ' HB3' HD22 ' A' ' 33' ' ' LEU . 98.3 mm-40 -69.64 -44.34 70.8 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.032 -1.043 . . . . 0.0 110.413 -179.664 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.636 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -58.16 -49.24 77.71 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.315 -0.866 . . . . 0.0 110.56 -179.553 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -58.97 -40.85 86.0 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.152 -0.967 . . . . 0.0 110.412 -179.887 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.29 -47.97 71.91 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.254 -0.904 . . . . 0.0 110.356 -179.88 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.573 ' HA ' ' CE1' ' A' ' 63' ' ' PHE . 48.1 m -63.02 -48.33 79.23 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.236 -0.915 . . . . 0.0 110.371 -179.863 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.644 ' CD1' HD21 ' A' ' 29' ' ' LEU . 12.4 mm -47.1 -19.3 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.303 -0.873 . . . . 0.0 111.225 -179.854 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.28 -24.12 30.04 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.969 -1.082 . . . . 0.0 111.527 -179.072 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.664 ' NH1' HD21 ' A' ' 67' ' ' LEU . 36.7 mtt180 -95.79 -69.91 0.73 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 120.862 -1.149 . . . . 0.0 110.862 -179.419 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.567 ' C ' ' O ' ' A' ' 44' ' ' ARG . 2.1 mtp -14.99 84.13 0.03 OUTLIER Pre-proline 0 N--CA 1.507 2.399 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -179.477 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.743 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 35.4 Cg_exo -57.22 168.29 2.82 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 O-C-N 124.053 1.554 . . . . 0.0 110.28 -179.923 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.436 ' O ' ' C ' ' A' ' 48' ' ' TYR . . . -56.79 120.47 7.92 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.197 -0.939 . . . . 0.0 110.113 179.974 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.548 ' CG ' ' N ' ' A' ' 49' ' ' SER . 16.9 p90 -41.67 -40.16 1.87 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.367 -0.833 . . . . 0.0 110.452 -179.931 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.548 ' N ' ' CG ' ' A' ' 48' ' ' TYR . 0.3 OUTLIER 170.94 -170.15 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.221 -0.924 . . . . 0.0 110.111 -179.907 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -106.97 -54.4 0.67 Allowed Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.347 -1.501 . . . . 0.0 109.347 179.891 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -114.19 45.87 0.01 OUTLIER 'Trans proline' 0 C--N 1.307 -1.652 0 O-C-N 123.934 1.491 . . . . 0.0 110.301 179.768 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.49 ' O ' ' O ' ' A' ' 53' ' ' SER . . . -120.7 -108.37 2.14 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -179.857 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.518 ' HB3' ' CD2' ' A' ' 48' ' ' TYR . 0.7 OUTLIER -55.99 -153.33 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.314 0 O-C-N 121.388 -1.066 . . . . 0.0 110.805 -179.577 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 18.9 m -106.06 150.36 39.21 Favored Pre-proline 0 N--CA 1.49 1.526 0 O-C-N 121.196 -0.94 . . . . 0.0 110.182 179.917 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -49.86 112.03 0.63 Allowed 'Trans proline' 0 C--N 1.305 -1.755 0 O-C-N 124.037 1.546 . . . . 0.0 110.325 -179.991 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 129.44 -26.75 4.31 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 179.895 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.73 144.58 56.25 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.2 -1.176 . . . . 0.0 110.274 -179.996 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 79.1 mt -121.06 157.44 30.04 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.195 -0.941 . . . . 0.0 109.962 179.813 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.45 ' CG ' ' HA ' ' A' ' 48' ' ' TYR . 1.2 m-20 -104.54 112.07 25.0 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.209 -0.932 . . . . 0.0 110.527 -179.911 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.558 ' CD1' ' HB3' ' A' ' 14' ' ' PHE . 23.2 p90 -81.19 -19.43 43.33 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.298 -0.876 . . . . 0.0 109.353 179.483 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.427 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.86 -40.83 73.46 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.326 -0.859 . . . . 0.0 109.264 179.575 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.743 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -58.36 -32.31 68.45 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.328 -0.858 . . . . 0.0 108.981 179.083 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.887 ' O ' HD12 ' A' ' 67' ' ' LEU . 6.1 t80 -58.65 -45.45 89.3 Favored 'General case' 0 C--N 1.3 -1.558 0 CA-C-O 121.278 0.561 . . . . 0.0 110.219 179.607 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 81.2 p -72.44 -45.02 61.5 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.191 -0.943 . . . . 0.0 110.554 -179.78 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 47.2 t -68.42 -41.04 80.97 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.255 -0.903 . . . . 0.0 110.576 -179.642 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.25 -35.44 71.42 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.209 -0.932 . . . . 0.0 110.594 -179.683 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.887 HD12 ' O ' ' A' ' 63' ' ' PHE . 11.2 mt -74.94 -41.14 60.21 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.172 -0.955 . . . . 0.0 110.556 -179.705 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -97.39 7.39 46.63 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.154 -0.966 . . . . 0.0 110.307 -179.783 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -74.19 -23.88 74.83 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 179.905 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -59.66 -33.34 71.41 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.303 -1.116 . . . . 0.0 110.227 -179.994 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.4 m -108.86 125.92 52.51 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.217 -0.927 . . . . 0.0 110.108 179.978 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -80.62 125.02 29.48 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.255 -0.903 . . . . 0.0 110.162 -179.982 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.622 0 O-C-N 121.306 -0.871 . . . . 0.0 110.144 179.973 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 7' ' ' GLY . . . . . 0.522 ' O ' ' N ' ' B' ' 9' ' ' LYS . . . . . . . . 0 N--CA 1.49 2.291 0 N-CA-C 109.589 -1.405 . . . . 0.0 109.589 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.05 -74.39 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.267 -1.137 . . . . 0.0 110.279 179.938 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.522 ' N ' ' O ' ' B' ' 7' ' ' GLY . 0.0 OUTLIER -60.36 -44.05 95.95 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.302 -0.873 . . . . 0.0 110.241 -179.997 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.16 -35.95 74.42 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.195 -0.94 . . . . 0.0 110.067 179.993 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -65.42 -40.62 93.56 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.268 -0.895 . . . . 0.0 109.91 179.855 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . 0.418 ' O ' HG23 ' B' ' 16' ' ' VAL . . . -64.17 -44.32 92.42 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.292 -0.88 . . . . 0.0 110.234 179.96 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.609 ' O ' HG23 ' B' ' 17' ' ' VAL . 47.5 t -62.25 -46.25 96.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.229 -0.919 . . . . 0.0 110.042 -179.914 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.49 -35.42 72.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.281 -0.887 . . . . 0.0 110.038 179.905 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 8.8 m -66.2 -42.87 88.22 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.267 -0.895 . . . . 0.0 109.97 179.737 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.761 ' O ' HG23 ' B' ' 20' ' ' VAL . 53.3 t -67.16 -43.3 88.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.21 -0.931 . . . . 0.0 110.103 179.907 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.609 HG23 ' O ' ' B' ' 13' ' ' VAL . 59.2 t -61.4 -44.92 99.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.354 -0.841 . . . . 0.0 110.315 -179.905 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.14 -43.54 94.92 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.222 -0.924 . . . . 0.0 110.213 179.865 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.37 -40.59 96.14 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.28 -0.887 . . . . 0.0 110.213 -179.898 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.761 HG23 ' O ' ' B' ' 16' ' ' VAL . 65.6 t -67.49 -42.52 87.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.153 -0.967 . . . . 0.0 110.101 179.993 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.529 ' O ' HG23 ' B' ' 25' ' ' VAL . 4.3 t0 -63.17 -40.13 96.65 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.274 -0.891 . . . . 0.0 110.132 179.919 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -54.21 -49.96 68.2 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.288 -0.883 . . . . 0.0 109.846 179.908 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.479 ' HB2' HD22 ' A' ' 67' ' ' LEU . . . -58.27 -42.41 86.47 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.192 -0.942 . . . . 0.0 109.795 179.632 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 5.0 ttp180 -60.54 -47.81 84.53 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.303 -0.873 . . . . 0.0 109.99 179.837 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . 0.529 HG23 ' O ' ' B' ' 21' ' ' ASP . 57.7 t -57.52 -20.91 14.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.248 -0.907 . . . . 0.0 110.022 179.822 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 55.99 38.06 29.54 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.524 -0.735 . . . . 0.0 110.332 179.944 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . 0.461 ' HA ' ' HD3' ' B' ' 28' ' ' PRO . 0.5 OUTLIER -92.19 136.64 25.55 Favored Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.287 -0.883 . . . . 0.0 110.279 -179.969 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' B' ' 27' ' ' GLU . 23.8 Cg_exo -87.49 63.63 3.92 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 O-C-N 124.039 1.547 . . . . 0.0 110.702 -179.874 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.708 0 O-C-N 121.08 -1.012 . . . . 0.0 110.239 179.722 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 mpt? . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.347 0.594 . . . . 0.0 110.264 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -83.33 -43.0 16.45 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.201 -0.937 . . . . 0.0 110.243 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -164.35 119.92 1.52 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.349 -0.845 . . . . 0.0 110.119 179.9 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.1 p -105.56 150.12 25.65 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.238 -0.914 . . . . 0.0 110.375 -179.953 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 15.0 p30 -166.98 172.66 10.0 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.264 -0.897 . . . . 0.0 110.093 -179.989 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.1 m -111.32 -32.05 6.86 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.197 -0.939 . . . . 0.0 110.271 -179.936 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.582 ' HA ' ' CZ ' ' A' ' 68' ' ' TYR . . . -65.22 -46.55 80.17 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.193 -0.942 . . . . 0.0 109.948 179.925 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.78 -36.54 69.98 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.28 -0.888 . . . . 0.0 109.831 179.485 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.57 -43.36 99.01 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.341 -0.849 . . . . 0.0 110.181 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.868 HG21 ' OH ' ' A' ' 68' ' ' TYR . 65.6 t -59.07 -44.87 92.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.09 -1.006 . . . . 0.0 109.777 179.732 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 44.4 mt -57.1 -49.72 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.404 -0.81 . . . . 0.0 109.465 179.574 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.78 -39.24 84.23 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.309 -0.869 . . . . 0.0 108.829 178.901 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.504 ' HB3' HG23 ' B' ' 16' ' ' VAL . 70.8 m -65.41 -40.54 93.52 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.465 -0.772 . . . . 0.0 109.099 178.898 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -66.82 -43.88 82.65 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.343 -0.848 . . . . 0.0 109.366 179.102 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -53.35 -41.21 65.58 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.353 -0.842 . . . . 0.0 109.153 179.049 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.526 HD12 ' HB2' ' B' ' 12' ' ' ALA . 49.3 mt -59.18 -45.09 93.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.426 -0.796 . . . . 0.0 109.687 179.326 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 13' ' ' SER . 15.4 mt -65.09 -41.83 94.63 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.185 -0.947 . . . . 0.0 109.41 179.386 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.5 ' HB1' ' HB2' ' A' ' 21' ' ' LYS . . . -71.12 -7.27 45.44 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.527 -0.733 . . . . 0.0 110.123 179.826 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.486 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 1.5 t 68.38 64.3 0.34 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.24 -0.912 . . . . 0.0 110.199 -179.971 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 58.2 66.35 1.12 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.257 -0.902 . . . . 0.0 110.312 179.969 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.5 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 64.5 mttt -153.15 143.22 15.31 Favored Pre-proline 0 N--CA 1.49 1.537 0 O-C-N 121.248 -0.908 . . . . 0.0 110.023 179.992 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -75.28 2.17 7.06 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 O-C-N 123.983 1.517 . . . . 0.0 110.156 179.703 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.431 ' CZ ' ' HD3' ' A' ' 21' ' ' LYS . 23.7 p90 -141.66 160.65 39.72 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.202 -0.936 . . . . 0.0 110.075 179.951 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.855 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -130.31 140.79 47.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.228 -0.92 . . . . 0.0 109.937 179.916 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.855 ' N ' HD13 ' A' ' 24' ' ' ILE . 1.1 mt -81.85 148.32 28.89 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.223 -0.923 . . . . 0.0 110.45 -179.733 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -62.77 -44.84 95.14 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.373 -0.829 . . . . 0.0 109.953 179.818 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -56.52 -36.28 69.02 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.276 -0.89 . . . . 0.0 109.869 179.744 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.517 ' O ' ' N ' ' A' ' 32' ' ' GLU . 0.6 OUTLIER -62.73 -42.22 99.56 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.416 -0.803 . . . . 0.0 109.681 179.742 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.743 HD13 ' HB3' ' A' ' 41' ' ' CYS . 17.5 mt -58.32 -34.2 70.33 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.272 -0.892 . . . . 0.0 109.532 179.634 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 9.6 mtm-85 -66.92 -38.68 86.65 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.343 -0.848 . . . . 0.0 109.828 179.597 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.76 -12.16 24.06 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.297 -0.877 . . . . 0.0 110.665 -179.754 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.517 ' N ' ' O ' ' A' ' 28' ' ' GLU . 11.3 mm-40 -96.76 -23.55 16.36 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.095 -1.003 . . . . 0.0 110.451 -179.819 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.598 ' CD2' HG22 ' B' ' 17' ' ' VAL . 1.4 mt -136.75 157.03 75.72 Favored Pre-proline 0 C--N 1.306 -1.317 0 O-C-N 121.166 -0.959 . . . . 0.0 110.102 -179.769 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.548 ' HD2' HD23 ' A' ' 33' ' ' LEU . 32.7 Cg_exo -46.25 171.21 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.735 0 O-C-N 123.861 1.453 . . . . 0.0 110.075 179.777 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_endo -64.77 -41.92 16.96 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 O-C-N 123.921 1.485 . . . . 0.0 110.305 -179.89 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.95 -40.89 91.73 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.34 -0.85 . . . . 0.0 110.548 -179.795 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.51 ' HG2' HG22 ' B' ' 17' ' ' VAL . 12.9 mp0 -69.33 -37.94 77.95 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.142 -0.974 . . . . 0.0 110.394 -179.739 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.79 -45.96 90.69 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.264 -0.898 . . . . 0.0 110.33 -179.94 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.463 ' O ' ' HB2' ' A' ' 43' ' ' LYS . 14.1 tt0 -66.1 -43.76 86.32 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.142 -0.974 . . . . 0.0 110.51 -179.873 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.8 -42.2 95.2 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.26 -0.9 . . . . 0.0 110.401 -179.766 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.743 ' HB3' HD13 ' A' ' 29' ' ' LEU . 31.1 m -63.09 -46.89 85.28 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.298 -0.876 . . . . 0.0 110.578 -179.666 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.644 ' CG1' HD12 ' A' ' 29' ' ' LEU . 74.5 mt -72.98 -13.72 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.126 -0.984 . . . . 0.0 110.519 -179.644 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 39' ' ' GLN . 0.1 OUTLIER -76.29 -21.19 56.56 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.163 -0.961 . . . . 0.0 110.461 -179.707 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.606 ' HB3' ' CG ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -113.0 -48.99 2.95 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.123 -0.986 . . . . 0.0 110.344 -180.0 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.523 ' HE1' ' CB ' ' A' ' 60' ' ' TYR . 2.0 ttm -34.62 96.77 0.11 Allowed Pre-proline 0 N--CA 1.494 1.764 0 O-C-N 121.695 -0.628 . . . . 0.0 111.071 -179.975 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.471 ' HD2' ' O ' ' A' ' 59' ' ' ASP . 27.1 Cg_exo -59.08 -153.79 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.716 0 O-C-N 123.995 1.524 . . . . 0.0 110.026 179.765 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.43 ' O ' ' C ' ' A' ' 48' ' ' TYR . . . -98.32 127.43 44.26 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.27 -0.894 . . . . 0.0 110.371 -179.972 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.657 ' CD2' ' CB ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -42.07 145.82 0.33 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.268 -0.895 . . . . 0.0 110.149 179.879 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 94.3 p -115.52 9.02 15.32 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.154 -0.967 . . . . 0.0 110.43 -179.75 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -99.41 139.31 14.37 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 179.939 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -79.09 154.76 25.6 Favored 'Trans proline' 0 C--N 1.306 -1.681 0 O-C-N 123.899 1.473 . . . . 0.0 110.222 179.904 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.488 ' O ' ' O ' ' A' ' 53' ' ' SER . . . 98.34 -28.67 13.73 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.441 -1.464 . . . . 0.0 109.441 -179.787 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.657 ' CB ' ' CD2' ' A' ' 48' ' ' TYR . 0.3 OUTLIER -55.02 -157.11 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.266 0 O-C-N 121.492 -1.005 . . . . 0.0 110.902 -179.756 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.489 ' CG2' ' HB2' ' A' ' 57' ' ' ALA . 10.8 m -117.37 179.93 0.74 Allowed Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.285 -0.884 . . . . 0.0 110.02 179.649 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -82.56 11.26 3.26 Favored 'Trans proline' 0 C--N 1.305 -1.713 0 O-C-N 123.989 1.52 . . . . 0.0 110.261 179.749 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -142.85 40.84 1.22 Allowed Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 179.897 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.649 ' C ' HD22 ' A' ' 58' ' ' LEU . . . -111.09 133.86 53.14 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.328 -1.101 . . . . 0.0 110.217 -179.931 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.813 HD22 ' N ' ' A' ' 58' ' ' LEU . 2.3 mm? -116.2 160.19 20.75 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.305 -0.872 . . . . 0.0 109.936 179.996 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.486 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.6 OUTLIER -106.8 110.41 22.58 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.041 -1.037 . . . . 0.0 110.445 -179.98 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.624 ' CD1' ' N ' ' A' ' 61' ' ' ALA . 17.2 p90 -75.91 -26.31 56.86 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.259 -0.9 . . . . 0.0 109.966 179.601 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.624 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.15 -39.59 72.54 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.327 -0.858 . . . . 0.0 110.023 -179.806 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.463 ' CB ' ' HG2' ' A' ' 46' ' ' PRO . . . -65.56 -39.55 91.81 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.177 -0.952 . . . . 0.0 109.831 179.667 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.606 ' CG ' ' HB3' ' A' ' 44' ' ' ARG . 2.0 t80 -71.9 -35.05 69.59 Favored 'General case' 0 C--N 1.298 -1.647 0 O-C-N 121.572 -0.705 . . . . 0.0 110.137 179.68 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.579 ' O ' ' CD2' ' A' ' 68' ' ' TYR . 17.4 m -56.19 -49.9 72.73 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.343 -0.848 . . . . 0.0 110.554 -179.692 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.5 p -55.65 -44.42 77.16 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.211 -0.931 . . . . 0.0 110.461 -179.754 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.16 -39.08 74.54 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.149 -0.97 . . . . 0.0 110.481 -179.802 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.513 ' CD2' ' HB2' ' B' ' 23' ' ' ALA . 18.3 mt -60.25 -38.52 83.72 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.188 -0.945 . . . . 0.0 110.292 -179.894 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.868 ' OH ' HG21 ' A' ' 10' ' ' VAL . 10.3 m-85 -86.48 -22.44 26.44 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.315 -0.866 . . . . 0.0 110.215 -179.641 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 108.02 -43.5 1.69 Allowed Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.964 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -171.95 95.63 0.16 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.264 -1.139 . . . . 0.0 110.28 -179.995 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.71 -67.92 0.37 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.286 -0.884 . . . . 0.0 110.137 179.993 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -70.6 103.54 2.55 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.248 -0.908 . . . . 0.0 110.134 179.941 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.641 0 O-C-N 121.298 -0.876 . . . . 0.0 110.191 -179.91 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.258 0 N-CA-C 109.541 -1.424 . . . . 0.0 109.541 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 11.4 ptpt -173.36 33.35 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.255 -1.144 . . . . 0.0 110.192 179.993 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 15.8 ttmt -58.55 -41.87 86.6 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.221 -0.925 . . . . 0.0 110.161 -179.969 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.16 -35.74 77.94 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.235 -0.916 . . . . 0.0 110.011 179.927 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.86 -42.62 94.72 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.343 -0.848 . . . . 0.0 110.128 179.998 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . 0.526 ' HB2' HD12 ' A' ' 16' ' ' ILE . . . -63.17 -35.78 81.44 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.141 -0.974 . . . . 0.0 110.018 179.83 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.633 ' O ' HG23 ' B' ' 17' ' ' VAL . 72.8 t -61.61 -42.34 93.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.28 -0.887 . . . . 0.0 110.075 179.892 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.51 -44.26 93.16 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.309 -0.87 . . . . 0.0 110.234 179.955 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 37.0 m -64.57 -49.12 72.43 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.301 -0.875 . . . . 0.0 110.33 -180.0 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.571 HG11 HD11 ' A' ' 33' ' ' LEU . 86.2 t -60.99 -43.98 97.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.183 -0.948 . . . . 0.0 110.298 -179.966 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.633 HG23 ' O ' ' B' ' 13' ' ' VAL . 90.2 t -63.18 -47.17 93.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.327 -0.858 . . . . 0.0 110.2 -179.886 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.54 -43.25 75.65 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.25 -0.906 . . . . 0.0 110.165 -179.975 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.5 -44.09 83.53 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.309 -0.869 . . . . 0.0 110.161 179.989 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.41 HG23 ' O ' ' B' ' 16' ' ' VAL . 75.1 t -66.07 -44.96 91.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.226 -0.921 . . . . 0.0 110.192 179.956 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.746 ' O ' HG23 ' B' ' 25' ' ' VAL . 5.4 t0 -57.16 -34.81 68.81 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.276 -0.89 . . . . 0.0 110.24 -179.96 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.9 tm0? -61.18 -49.83 75.62 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.2 -0.938 . . . . 0.0 110.162 -179.914 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.513 ' HB2' ' CD2' ' A' ' 67' ' ' LEU . . . -60.81 -35.4 76.4 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.291 -0.881 . . . . 0.0 110.353 -179.922 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 21.5 ttp85 -70.59 -32.22 69.5 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.15 -0.968 . . . . 0.0 110.487 179.979 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . 0.746 HG23 ' O ' ' B' ' 21' ' ' ASP . 63.8 t -54.89 -24.01 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.175 -0.953 . . . . 0.0 110.536 -179.589 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.503 ' HG2' ' O ' ' B' ' 23' ' ' ALA . 9.1 ptm180 -102.67 19.54 18.93 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.341 -0.85 . . . . 0.0 110.037 179.913 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -106.98 145.16 30.54 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.268 -0.895 . . . . 0.0 110.027 179.89 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -86.89 92.66 0.53 Allowed 'Trans proline' 0 C--N 1.305 -1.735 0 O-C-N 123.906 1.477 . . . . 0.0 110.274 179.921 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.567 0 O-C-N 121.255 -0.903 . . . . 0.0 110.207 -179.94 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 121.215 0.531 . . . . 0.0 110.264 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -165.12 -149.83 0.12 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.22 -0.925 . . . . 0.0 110.109 179.995 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.416 ' O ' ' OG1' ' A' ' 4' ' ' THR . 2.0 p-10 -165.03 124.9 1.87 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.227 -0.921 . . . . 0.0 110.229 179.944 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.416 ' OG1' ' O ' ' A' ' 3' ' ' ASP . 40.7 p 43.48 74.0 0.13 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.226 -0.921 . . . . 0.0 110.05 -179.997 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.509 ' O ' ' N ' ' A' ' 7' ' ' ALA . 1.5 m-20 -123.91 -72.42 0.68 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.245 -0.909 . . . . 0.0 110.278 -179.967 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.928 HG22 ' CE2' ' A' ' 68' ' ' TYR . 3.3 m 66.02 -63.36 0.23 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.283 -0.885 . . . . 0.0 110.196 -179.958 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.509 ' N ' ' O ' ' A' ' 5' ' ' ASP . . . -66.94 -45.53 77.53 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.22 -0.925 . . . . 0.0 109.823 179.774 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.524 ' HA ' HD12 ' A' ' 11' ' ' ILE . 1.9 tt0 -57.02 -36.65 70.69 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.32 -0.863 . . . . 0.0 109.883 179.694 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -61.38 -47.37 86.15 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.333 -0.854 . . . . 0.0 110.185 -179.853 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 41.6 t -58.26 -41.3 80.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.164 -0.96 . . . . 0.0 109.871 179.755 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.676 HG23 ' HE1' ' A' ' 60' ' ' TYR . 29.8 mt -63.33 -47.92 89.74 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.354 -0.841 . . . . 0.0 109.487 179.547 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.43 -39.01 75.32 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.334 -0.853 . . . . 0.0 108.722 179.018 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.57 ' HB3' HG23 ' B' ' 16' ' ' VAL . 10.6 m -66.91 -40.34 87.65 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 178.71 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.571 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 6.6 m-85 -68.28 -41.23 81.33 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.464 -0.772 . . . . 0.0 109.525 179.219 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -53.1 -44.26 67.49 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.348 -0.845 . . . . 0.0 109.456 179.363 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.608 HD13 ' HB2' ' B' ' 12' ' ' ALA . 48.3 mt -59.74 -43.6 91.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.479 -0.763 . . . . 0.0 109.882 179.467 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 13' ' ' SER . 48.3 mt -65.12 -41.75 94.57 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.289 -0.882 . . . . 0.0 109.949 179.792 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.601 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -83.75 13.97 4.32 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.456 -0.778 . . . . 0.0 110.337 -179.879 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 57.73 70.58 0.64 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.245 -0.91 . . . . 0.0 110.465 179.932 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.8 t70 44.99 54.96 6.51 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.332 -0.855 . . . . 0.0 110.514 179.777 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.552 ' HD2' ' CZ ' ' A' ' 23' ' ' TYR . 7.1 mttm -133.55 141.83 41.71 Favored Pre-proline 0 N--CA 1.491 1.575 0 O-C-N 121.143 -0.973 . . . . 0.0 109.901 179.89 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -68.13 -4.4 12.55 Favored 'Trans proline' 0 C--N 1.305 -1.729 0 O-C-N 124.02 1.537 . . . . 0.0 110.388 179.973 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.587 ' HB3' ' CE1' ' A' ' 48' ' ' TYR . 51.8 p90 -139.18 157.41 45.98 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.213 -0.93 . . . . 0.0 110.306 -179.913 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.794 HD13 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -132.91 138.25 52.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.286 -0.884 . . . . 0.0 109.467 179.581 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.794 ' N ' HD13 ' A' ' 24' ' ' ILE . 1.0 OUTLIER -82.15 139.48 34.32 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.13 -0.981 . . . . 0.0 110.369 -179.48 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.451 ' O ' HD11 ' A' ' 42' ' ' ILE . . . -54.99 -35.22 64.11 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.39 -0.819 . . . . 0.0 110.175 179.945 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 87.6 mt-10 -61.12 -38.56 86.77 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.224 -0.922 . . . . 0.0 109.991 179.9 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.554 ' HB3' HD11 ' A' ' 24' ' ' ILE . 8.4 mt-10 -65.87 -40.48 91.69 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.329 -0.857 . . . . 0.0 109.565 179.627 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.517 HD12 HG12 ' A' ' 42' ' ' ILE . 63.6 mt -59.24 -34.03 71.72 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.433 -0.792 . . . . 0.0 109.476 179.446 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 27.8 mtp180 -68.48 -34.56 76.14 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.388 -0.82 . . . . 0.0 110.047 179.754 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.22 -31.48 13.47 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.3 -0.875 . . . . 0.0 110.499 -179.665 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -83.48 -23.36 32.23 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.074 -1.017 . . . . 0.0 110.431 -179.773 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.914 HD23 ' HD2' ' A' ' 34' ' ' PRO . 1.5 mt -129.85 147.84 67.1 Favored Pre-proline 0 N--CA 1.488 1.461 0 O-C-N 121.082 -1.011 . . . . 0.0 110.329 -179.749 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.914 ' HD2' HD23 ' A' ' 33' ' ' LEU . 1.0 OUTLIER -46.45 167.11 0.07 OUTLIER 'Trans proline' 0 C--N 1.305 -1.76 0 O-C-N 124.021 1.537 . . . . 0.0 110.095 179.665 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -62.44 -36.02 68.57 Favored 'Trans proline' 0 C--N 1.304 -1.794 0 O-C-N 124.03 1.542 . . . . 0.0 110.484 -179.768 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.521 ' OD1' ' N ' ' A' ' 37' ' ' GLN . 1.7 p30 -65.61 -46.4 79.46 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.25 -0.906 . . . . 0.0 110.462 -179.78 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.908 ' NE2' HG13 ' B' ' 17' ' ' VAL . 0.3 OUTLIER -69.45 -40.17 77.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.121 -0.987 . . . . 0.0 110.153 -179.962 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.418 ' O ' HG13 ' A' ' 42' ' ' ILE . . . -58.64 -48.14 82.02 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.289 -0.882 . . . . 0.0 110.185 179.917 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 66.7 tp60 -62.91 -47.52 82.9 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.266 -0.896 . . . . 0.0 110.14 179.888 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -66.21 -46.56 76.84 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.339 -0.851 . . . . 0.0 110.045 179.962 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 89.6 m -64.92 -45.97 83.61 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.356 -0.84 . . . . 0.0 110.332 -179.998 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.517 HG12 HD12 ' A' ' 29' ' ' LEU . 66.2 mt -68.73 -12.46 15.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.245 -0.909 . . . . 0.0 110.424 -179.853 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 19.7 tttm -83.12 -40.23 20.05 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.209 -0.932 . . . . 0.0 110.487 -179.783 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.511 ' O ' ' C ' ' A' ' 45' ' ' MET . 3.2 mtp85 -85.27 -61.61 1.73 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.204 -0.935 . . . . 0.0 110.55 -179.656 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.689 ' HE1' ' HB3' ' A' ' 60' ' ' TYR . 5.8 ttm -28.0 103.32 0.16 Allowed Pre-proline 0 N--CA 1.497 1.919 0 O-C-N 121.84 -0.537 . . . . 0.0 111.598 -179.886 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.545 ' O ' HD12 ' A' ' 58' ' ' LEU . 11.4 Cg_endo -57.03 -160.58 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.713 0 O-C-N 124.058 1.557 . . . . 0.0 110.028 179.691 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.458 ' O ' ' O ' ' A' ' 48' ' ' TYR . . . -98.35 49.52 0.99 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.13 -0.981 . . . . 0.0 110.371 -179.924 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.587 ' CE1' ' HB3' ' A' ' 23' ' ' TYR . 24.9 t80 49.63 177.58 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.25 -0.906 . . . . 0.0 110.369 179.86 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -128.76 178.46 6.34 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.185 -0.947 . . . . 0.0 110.141 -179.974 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 112.05 -170.05 13.42 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 -179.952 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -72.93 -86.5 0.0 OUTLIER 'Trans proline' 0 C--N 1.307 -1.648 0 O-C-N 123.968 1.51 . . . . 0.0 110.261 179.937 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.488 ' O ' ' O ' ' A' ' 53' ' ' SER . . . -125.85 82.69 0.35 Allowed Glycine 0 N--CA 1.49 2.261 0 N-CA-C 109.519 -1.433 . . . . 0.0 109.519 -179.945 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.488 ' O ' ' O ' ' A' ' 52' ' ' GLY . 0.9 OUTLIER -55.61 -156.86 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.29 0 O-C-N 121.361 -1.082 . . . . 0.0 110.702 -179.596 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 1.088 HG22 ' HB2' ' A' ' 57' ' ' ALA . 14.6 m -76.73 -160.09 0.02 OUTLIER Pre-proline 0 N--CA 1.492 1.651 0 O-C-N 121.23 -0.919 . . . . 0.0 110.244 179.996 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.516 ' CD ' ' HB ' ' A' ' 54' ' ' VAL . 24.4 Cg_exo -99.3 52.39 0.06 OUTLIER 'Trans proline' 0 C--N 1.306 -1.67 0 O-C-N 123.898 1.473 . . . . 0.0 110.403 -179.882 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.427 ' O ' HD12 ' A' ' 25' ' ' LEU . . . 141.26 46.83 0.05 OUTLIER Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.941 -1.264 . . . . 0.0 109.941 179.831 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 1.088 ' HB2' HG22 ' A' ' 54' ' ' VAL . . . -100.01 124.14 45.03 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.144 -1.21 . . . . 0.0 110.032 179.694 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.851 HD22 ' N ' ' A' ' 58' ' ' LEU . 1.6 mm? -110.41 154.51 23.47 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.25 -0.906 . . . . 0.0 110.129 -179.846 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.491 ' C ' ' HG3' ' A' ' 45' ' ' MET . 0.4 OUTLIER -106.27 110.64 22.94 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.166 -0.959 . . . . 0.0 110.354 179.837 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.689 ' HB3' ' HE1' ' A' ' 45' ' ' MET . 17.4 p90 -72.56 -18.02 61.66 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.242 -0.911 . . . . 0.0 109.164 179.223 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.434 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.79 -35.47 66.33 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.451 -0.781 . . . . 0.0 109.104 179.571 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.493 ' HB3' ' CD ' ' A' ' 46' ' ' PRO . . . -60.15 -32.68 71.26 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.368 -0.832 . . . . 0.0 109.174 179.185 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.671 ' HE2' HG22 ' B' ' 20' ' ' VAL . 2.6 t80 -63.14 -48.79 76.96 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.785 -0.572 . . . . 0.0 110.203 179.756 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.453 ' O ' ' HB2' ' A' ' 68' ' ' TYR . 41.3 p -63.92 -45.74 87.91 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.216 -0.928 . . . . 0.0 110.401 -179.862 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.495 ' O ' ' CA ' ' A' ' 69' ' ' GLY . 54.0 m -67.06 -39.25 86.86 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.236 -0.915 . . . . 0.0 110.285 -179.897 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.19 -43.86 69.89 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.231 -0.918 . . . . 0.0 110.35 -179.851 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.896 ' CD2' ' HB2' ' B' ' 23' ' ' ALA . 22.5 mt -73.6 -44.6 56.73 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.175 -0.953 . . . . 0.0 110.357 -179.868 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.928 ' CE2' HG22 ' A' ' 6' ' ' THR . 11.7 m-85 -99.44 15.4 26.53 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.222 -0.924 . . . . 0.0 110.286 -179.935 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.495 ' CA ' ' O ' ' A' ' 65' ' ' SER . . . -46.13 112.21 0.79 Allowed Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -179.834 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -119.2 -16.89 9.02 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.309 -1.113 . . . . 0.0 110.181 179.902 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 178.9 107.41 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.247 -0.908 . . . . 0.0 110.22 179.966 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -73.54 136.83 44.09 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.176 -0.952 . . . . 0.0 110.255 179.961 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 O-C-N 121.33 -0.857 . . . . 0.0 110.213 179.967 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.257 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 14.3 ptmt -114.18 36.25 3.81 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.207 -1.172 . . . . 0.0 110.226 -179.965 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.486 ' HA ' HG21 ' A' ' 16' ' ' ILE . 7.3 ttpt -65.2 -45.74 83.55 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.174 -0.954 . . . . 0.0 110.228 -179.879 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.45 -41.94 73.57 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.284 -0.885 . . . . 0.0 110.099 179.859 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -61.07 -41.28 96.34 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.231 -0.918 . . . . 0.0 110.115 179.872 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . 0.608 ' HB2' HD13 ' A' ' 16' ' ' ILE . . . -62.97 -36.43 83.45 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.309 -0.869 . . . . 0.0 110.142 179.94 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.646 ' O ' HG23 ' B' ' 17' ' ' VAL . 55.0 t -65.96 -45.12 91.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.255 -0.903 . . . . 0.0 110.163 179.758 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.04 -39.69 79.06 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.262 -0.899 . . . . 0.0 110.207 179.973 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 15.9 m -70.04 -40.79 74.95 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.317 -0.864 . . . . 0.0 110.21 179.916 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.57 HG23 ' HB3' ' A' ' 13' ' ' SER . 92.4 t -67.08 -45.47 86.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.265 -0.897 . . . . 0.0 110.247 179.986 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.908 HG13 ' NE2' ' A' ' 37' ' ' GLN . 55.0 t -62.77 -44.33 99.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.199 -0.938 . . . . 0.0 110.098 179.935 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.06 -39.19 77.85 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.311 -0.868 . . . . 0.0 110.236 -179.988 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.25 -40.77 86.29 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.194 -0.941 . . . . 0.0 110.221 -179.905 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.671 HG22 ' HE2' ' A' ' 63' ' ' PHE . 91.0 t -66.05 -41.04 88.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.293 -0.879 . . . . 0.0 110.355 -179.982 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 48.6 t0 -61.6 -31.86 71.95 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.245 -0.909 . . . . 0.0 110.247 -179.883 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -39.43 94.19 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.249 -0.907 . . . . 0.0 110.175 -179.9 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.896 ' HB2' ' CD2' ' A' ' 67' ' ' LEU . . . -65.91 -38.35 88.48 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.188 -0.945 . . . . 0.0 110.334 -179.851 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.72 -39.53 81.09 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.174 -0.954 . . . . 0.0 110.398 -179.867 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 56.3 t -62.86 -21.57 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.155 -0.966 . . . . 0.0 110.376 -179.818 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.54 30.79 6.35 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.287 -0.883 . . . . 0.0 110.262 -179.961 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 61.6 tt0 -77.63 106.09 3.38 Favored Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.17 -0.957 . . . . 0.0 110.142 179.894 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -59.93 132.19 43.54 Favored 'Trans proline' 0 C--N 1.305 -1.748 0 O-C-N 124.054 1.555 . . . . 0.0 110.314 -179.769 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 5.1 ttt-85 . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.232 -0.917 . . . . 0.0 110.253 179.893 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ttt . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 121.249 0.547 . . . . 0.0 110.143 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.935 ' HB3' HD11 ' A' ' 11' ' ' ILE . . . -130.1 -143.25 0.25 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.283 -0.886 . . . . 0.0 110.123 179.97 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -90.76 -166.27 1.54 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.291 -0.881 . . . . 0.0 110.25 179.961 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.522 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 7.5 t -100.11 -144.23 0.33 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.169 -0.957 . . . . 0.0 110.198 179.944 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.44 ' CB ' ' O ' ' A' ' 4' ' ' THR . 1.7 t0 66.6 -168.72 0.2 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.277 -0.889 . . . . 0.0 110.196 179.905 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -50.1 -24.11 2.52 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.28 -0.887 . . . . 0.0 110.27 179.933 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.437 ' O ' HG13 ' A' ' 11' ' ' ILE . . . -62.01 -45.26 94.36 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.224 -0.923 . . . . 0.0 109.453 179.754 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.522 ' HB2' ' HA ' ' A' ' 4' ' ' THR . 1.3 tm-20 -56.06 -36.59 68.23 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.437 -0.789 . . . . 0.0 109.682 179.333 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -61.96 -48.41 80.53 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.354 -0.841 . . . . 0.0 110.04 179.866 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 44.0 t -59.44 -46.42 92.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.339 -0.851 . . . . 0.0 109.673 179.695 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.935 HD11 ' HB3' ' A' ' 2' ' ' ALA . 44.7 mt -57.49 -48.49 82.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.293 -0.879 . . . . 0.0 109.431 179.536 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.76 -43.36 85.4 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.223 -0.923 . . . . 0.0 108.811 178.979 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.586 ' O ' ' HB1' ' B' ' 12' ' ' ALA . 6.7 p -63.07 -39.19 93.98 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 178.6 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -68.57 -41.21 80.02 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.512 -0.742 . . . . 0.0 109.576 179.112 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.638 ' NH2' ' CE2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -54.47 -42.61 70.88 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.276 -0.89 . . . . 0.0 109.62 179.486 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.86 HD12 ' HB2' ' B' ' 12' ' ' ALA . 38.0 mt -57.64 -45.05 86.5 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 O-C-N 121.155 -0.965 . . . . 0.0 108.72 179.032 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.464 HD13 ' HA ' ' A' ' 17' ' ' LEU . 4.1 mm? -65.97 -41.7 90.82 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.449 -0.782 . . . . 0.0 109.717 178.905 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.461 ' O ' ' CB ' ' A' ' 19' ' ' SER . . . -72.15 -11.96 60.97 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.475 -0.766 . . . . 0.0 110.091 -179.958 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.461 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 1.7 t 66.32 64.59 0.51 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.339 -0.851 . . . . 0.0 110.249 -179.987 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 51.45 62.36 2.75 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.213 -0.93 . . . . 0.0 110.377 179.902 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.525 ' O ' ' NE ' ' A' ' 15' ' ' ARG . 14.9 mttt -141.76 140.77 20.58 Favored Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.316 -0.865 . . . . 0.0 109.881 179.847 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.584 ' O ' ' CD1' ' A' ' 23' ' ' TYR . 18.5 Cg_endo -62.24 -10.65 19.09 Favored 'Trans proline' 0 C--N 1.303 -1.835 0 O-C-N 123.926 1.488 . . . . 0.0 110.178 179.938 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.584 ' CD1' ' O ' ' A' ' 22' ' ' PRO . 32.0 m-85 -143.06 -173.5 3.93 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.265 -0.897 . . . . 0.0 110.255 -179.974 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.7 tt -143.66 139.37 25.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.376 -0.828 . . . . 0.0 109.993 179.863 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.8 mt -80.17 143.35 33.91 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.276 -0.89 . . . . 0.0 109.95 -179.932 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.657 ' HB2' HD11 ' A' ' 58' ' ' LEU . . . -62.52 -36.49 82.75 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.38 -0.825 . . . . 0.0 110.606 -179.534 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -65.48 -36.44 83.88 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.134 -0.979 . . . . 0.0 110.128 -179.892 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.471 ' O ' ' CG ' ' A' ' 32' ' ' GLU . 28.8 mt-10 -69.1 -51.11 41.97 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.12 -0.988 . . . . 0.0 110.131 -179.876 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.738 HD12 ' C ' ' A' ' 29' ' ' LEU . 2.4 pp -67.62 -33.21 74.53 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.254 -0.904 . . . . 0.0 109.779 179.387 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 1.083 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 10.8 tpt180 -64.71 -34.84 79.26 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.261 -0.9 . . . . 0.0 110.526 -179.846 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 1.4 ttp85 -93.98 -9.05 38.21 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.218 -0.926 . . . . 0.0 110.63 -179.576 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.471 ' CG ' ' O ' ' A' ' 28' ' ' GLU . 8.0 mm-40 -100.13 -23.44 14.85 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.11 -0.994 . . . . 0.0 111.171 -179.313 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.638 HD22 ' HB3' ' A' ' 37' ' ' GLN . 0.3 OUTLIER -110.87 150.43 41.82 Favored Pre-proline 0 N--CA 1.489 1.486 0 O-C-N 120.907 -1.121 . . . . 0.0 110.3 -179.753 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.433 ' HG2' ' HB2' ' A' ' 37' ' ' GLN . 6.3 Cg_exo -47.36 144.44 9.73 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 O-C-N 124.031 1.542 . . . . 0.0 109.879 179.783 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.432 ' C ' ' O ' ' A' ' 34' ' ' PRO . 35.3 Cg_endo -38.1 -47.79 2.25 Favored 'Trans proline' 0 C--N 1.304 -1.78 0 O-C-N 124.192 1.628 . . . . 0.0 110.569 -179.72 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.409 ' OD1' ' HG2' ' A' ' 35' ' ' PRO . 2.4 m-20 -66.31 -47.02 74.9 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.24 -0.912 . . . . 0.0 111.185 -179.563 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.638 ' HB3' HD22 ' A' ' 33' ' ' LEU . 0.9 OUTLIER -69.82 -44.43 70.0 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.062 -1.024 . . . . 0.0 110.575 -179.42 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 1.083 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -59.16 -44.46 92.11 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.28 -0.888 . . . . 0.0 110.624 -179.534 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -66.09 -43.43 87.31 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.099 -1.001 . . . . 0.0 110.712 -179.643 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -61.31 -43.74 98.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.161 -0.962 . . . . 0.0 110.5 -179.805 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.457 ' O ' ' SD ' ' A' ' 45' ' ' MET . 79.1 m -58.09 -42.41 85.54 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.165 -0.959 . . . . 0.0 110.477 -179.771 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.644 HG13 HD11 ' A' ' 29' ' ' LEU . 36.4 mt -65.49 -21.82 29.88 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.14 -0.975 . . . . 0.0 110.362 -179.854 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.66 -34.5 23.02 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.18 -0.95 . . . . 0.0 110.817 -179.569 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.52 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 2.0 mmp_? -74.72 -69.45 0.46 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.107 -0.996 . . . . 0.0 110.589 -179.521 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.763 ' HE2' ' HB3' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -36.28 118.14 0.69 Allowed Pre-proline 0 N--CA 1.488 1.467 0 O-C-N 121.53 -0.731 . . . . 0.0 111.412 -179.756 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.689 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 9.3 Cg_endo -70.21 -154.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.304 -1.771 0 O-C-N 124.197 1.63 . . . . 0.0 109.342 179.117 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.413 ' O ' ' C ' ' A' ' 48' ' ' TYR . . . -96.93 113.7 25.26 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.082 -1.011 . . . . 0.0 110.331 179.864 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.56 ' CD1' ' O ' ' A' ' 57' ' ' ALA . 12.9 p90 -41.88 144.77 0.39 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.407 -0.808 . . . . 0.0 110.288 -179.997 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -151.73 24.79 0.67 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.294 -0.879 . . . . 0.0 110.192 -179.872 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -106.98 -165.86 22.28 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.445 -1.462 . . . . 0.0 109.445 -179.992 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -72.87 165.31 33.14 Favored 'Trans proline' 0 C--N 1.305 -1.718 0 O-C-N 123.923 1.486 . . . . 0.0 110.261 -179.996 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.517 ' O ' HG13 ' A' ' 54' ' ' VAL . . . 79.01 7.01 88.7 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -179.986 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.451 ' C ' ' O ' ' A' ' 52' ' ' GLY . 0.0 OUTLIER -36.22 139.91 0.15 Allowed 'General case' 0 C--N 1.308 -1.238 0 O-C-N 121.612 -0.934 . . . . 0.0 110.905 -179.71 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 1.056 HG23 ' HB2' ' A' ' 57' ' ' ALA . 1.5 m -142.83 -169.46 0.22 Allowed Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.686 -0.634 . . . . 0.0 109.961 179.595 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.465 ' HD2' ' HB ' ' A' ' 54' ' ' VAL . 11.7 Cg_endo -93.67 115.35 0.26 Allowed 'Trans proline' 0 C--N 1.305 -1.757 0 O-C-N 123.948 1.499 . . . . 0.0 110.832 -179.515 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.87 33.6 26.66 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 110.059 -1.216 . . . . 0.0 110.059 179.458 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 1.056 ' HB2' HG23 ' A' ' 54' ' ' VAL . . . -91.21 137.95 31.97 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.091 -1.24 . . . . 0.0 110.479 -179.988 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.657 HD11 ' HB2' ' A' ' 26' ' ' ALA . 62.3 mt -124.88 159.75 30.41 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.298 -0.876 . . . . 0.0 109.613 179.499 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.454 ' C ' ' HG2' ' A' ' 45' ' ' MET . 3.7 m-20 -106.18 110.76 23.11 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.005 -1.06 . . . . 0.0 111.234 -179.52 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.773 ' HE1' HG23 ' A' ' 11' ' ' ILE . 39.7 p90 -81.49 -29.77 33.55 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.425 -0.797 . . . . 0.0 110.08 179.307 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.528 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.5 -36.65 66.92 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.283 -0.886 . . . . 0.0 109.522 -179.943 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.689 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -68.16 -35.81 78.65 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.344 -0.848 . . . . 0.0 109.862 179.539 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.52 ' CD1' ' HB3' ' A' ' 44' ' ' ARG . 2.6 t80 -72.05 -31.44 66.14 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.576 -0.703 . . . . 0.0 110.303 179.66 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 20.1 m -71.43 -48.5 49.2 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.285 -0.884 . . . . 0.0 110.409 -179.704 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.43 -43.28 97.89 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.199 -0.938 . . . . 0.0 110.37 -179.779 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -61.83 -40.78 96.48 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.196 -0.94 . . . . 0.0 110.404 -179.789 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.86 -40.03 75.39 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.152 -0.968 . . . . 0.0 110.346 -179.804 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -91.73 -24.58 19.41 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.127 -0.983 . . . . 0.0 110.263 -179.995 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.439 ' O ' ' HB3' ' A' ' 70' ' ' GLU . . . 112.97 -70.22 0.22 Allowed Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 179.888 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.439 ' HB3' ' O ' ' A' ' 69' ' ' GLY . 1.1 tp10 62.98 21.62 13.0 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.269 -1.136 . . . . 0.0 110.236 -179.981 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.4 ' O ' HD23 ' A' ' 73' ' ' LEU . 10.9 p -128.0 -76.4 0.57 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.273 -0.892 . . . . 0.0 110.253 -179.985 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.91 122.2 31.24 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.156 -0.965 . . . . 0.0 110.192 179.981 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.4 HD23 ' O ' ' A' ' 71' ' ' SER . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.655 0 O-C-N 121.178 -0.952 . . . . 0.0 110.154 179.959 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.24 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -109.76 -57.47 2.18 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.254 -1.145 . . . . 0.0 110.264 -179.936 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.448 ' CE ' ' OE1' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -59.96 -51.14 70.96 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.217 -0.927 . . . . 0.0 110.153 179.942 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.8 -35.54 68.85 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.216 -0.927 . . . . 0.0 110.059 179.935 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -62.84 -42.55 99.78 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.216 -0.928 . . . . 0.0 110.207 179.932 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . 0.86 ' HB2' HD12 ' A' ' 16' ' ' ILE . . . -67.04 -40.96 87.28 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.294 -0.879 . . . . 0.0 110.073 179.916 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.518 ' O ' HG23 ' B' ' 17' ' ' VAL . 75.1 t -61.24 -44.62 98.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.204 -0.935 . . . . 0.0 109.952 179.895 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.52 -44.33 89.5 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.19 -0.943 . . . . 0.0 110.053 179.809 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 54.3 m -63.55 -43.25 97.63 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.241 -0.912 . . . . 0.0 110.085 179.858 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.424 HG23 ' O ' ' B' ' 12' ' ' ALA . 76.7 t -64.22 -41.99 94.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.298 -0.876 . . . . 0.0 110.054 179.864 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.518 HG23 ' O ' ' B' ' 13' ' ' VAL . 77.6 t -61.04 -44.33 98.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.272 -0.892 . . . . 0.0 110.071 179.84 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.8 -45.97 92.33 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.162 -0.961 . . . . 0.0 110.034 179.939 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.32 -45.44 87.91 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.201 -0.937 . . . . 0.0 110.087 179.826 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 66.5 t -68.04 -40.52 83.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.231 -0.918 . . . . 0.0 110.191 179.937 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.53 ' O ' HG23 ' B' ' 25' ' ' VAL . 41.6 t0 -61.87 -31.5 71.78 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.345 -0.847 . . . . 0.0 110.133 179.934 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -55.82 -50.93 69.19 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.26 -0.9 . . . . 0.0 110.078 -179.995 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.87 -39.66 90.01 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.199 -0.938 . . . . 0.0 110.091 179.785 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 10.6 ttp180 -67.44 -33.67 75.62 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.406 -0.809 . . . . 0.0 110.128 179.857 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . 0.53 HG23 ' O ' ' B' ' 21' ' ' ASP . 25.2 t -59.43 -20.39 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.294 -0.879 . . . . 0.0 110.104 -179.908 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.582 ' NH1' ' HB3' ' B' ' 26' ' ' ARG . 6.9 mtp-105 -82.54 15.3 2.61 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.337 -0.852 . . . . 0.0 110.517 -179.905 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . 0.561 ' O ' ' C ' ' B' ' 28' ' ' PRO . 0.0 OUTLIER -106.3 107.13 59.33 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.369 -0.832 . . . . 0.0 109.383 179.484 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . 0.561 ' C ' ' O ' ' B' ' 27' ' ' GLU . 82.7 Cg_exo -0.68 71.6 0.0 OUTLIER 'Trans proline' 0 N--CA 1.501 1.917 0 O-C-N 124.917 2.009 . . . . 0.0 112.328 -179.369 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . 0.52 ' N ' ' O ' ' B' ' 27' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 O-C-N 121.208 -0.932 . . . . 0.0 110.266 -179.531 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 mtt . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.201 0.524 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -159.22 178.73 9.69 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.289 -0.882 . . . . 0.0 110.356 -179.994 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -171.21 82.35 0.08 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.349 -0.845 . . . . 0.0 109.937 179.973 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 7.6 t -125.83 14.79 8.03 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.329 -0.857 . . . . 0.0 110.526 -179.761 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -140.51 108.72 5.78 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.151 -0.968 . . . . 0.0 110.526 -179.857 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 27.8 m -111.38 -44.59 3.51 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.27 -0.894 . . . . 0.0 109.989 179.75 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.8 ' HB1' ' CE2' ' A' ' 68' ' ' TYR . . . -66.52 -45.78 78.39 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.282 -0.886 . . . . 0.0 109.793 179.644 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -54.69 -36.48 64.7 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.358 -0.838 . . . . 0.0 109.758 179.552 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -61.56 -40.08 93.44 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.34 -0.85 . . . . 0.0 110.047 179.995 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 88.3 t -58.2 -52.35 59.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.178 -0.951 . . . . 0.0 109.935 179.698 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 59.0 mt -55.47 -49.49 72.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.254 -0.904 . . . . 0.0 109.49 179.612 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.83 -40.38 79.91 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.315 -0.866 . . . . 0.0 108.876 179.119 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.401 ' O ' HD23 ' A' ' 17' ' ' LEU . 2.0 p -66.8 -37.78 85.2 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.418 -0.801 . . . . 0.0 109.122 178.941 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.495 ' CE1' ' HE1' ' A' ' 45' ' ' MET . 3.3 m-85 -68.27 -43.66 77.28 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.317 -0.864 . . . . 0.0 109.706 179.363 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.401 ' HD3' ' OH ' ' A' ' 60' ' ' TYR . 0.7 OUTLIER -53.35 -47.99 68.92 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.327 -0.858 . . . . 0.0 109.389 179.515 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.613 HG21 ' HA ' ' B' ' 9' ' ' LYS . 71.3 mt -59.09 -42.36 86.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.403 -0.811 . . . . 0.0 109.607 179.281 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.631 HD12 ' HB3' ' A' ' 32' ' ' GLU . 2.6 mm? -64.79 -39.13 93.09 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.414 -0.804 . . . . 0.0 109.982 179.727 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.746 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -82.95 10.58 7.59 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.319 -0.863 . . . . 0.0 110.249 -179.974 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 61.46 56.35 2.61 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.311 -0.868 . . . . 0.0 110.239 -179.948 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.6 t0 56.85 59.31 3.56 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.225 -0.922 . . . . 0.0 110.225 179.925 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' A' ' 18' ' ' ALA . 18.8 mttm -140.62 144.34 35.96 Favored Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.25 -0.906 . . . . 0.0 110.173 -179.975 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 21' ' ' LYS . 26.6 Cg_exo -75.03 1.06 8.17 Favored 'Trans proline' 0 C--N 1.304 -1.792 0 O-C-N 124.091 1.574 . . . . 0.0 109.998 179.562 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.455 ' CD1' ' O ' ' A' ' 23' ' ' TYR . 8.4 p90 -141.69 150.42 41.85 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.219 -0.925 . . . . 0.0 110.179 179.963 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.746 HG12 ' HB2' ' A' ' 18' ' ' ALA . 0.4 OUTLIER -121.38 144.09 31.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.188 -0.945 . . . . 0.0 110.002 -179.973 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.581 ' H ' HD13 ' A' ' 24' ' ' ILE . 4.4 mm? -85.73 145.24 27.35 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.22 -0.925 . . . . 0.0 110.302 -179.894 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.63 -45.43 94.11 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.279 -0.888 . . . . 0.0 110.181 179.894 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -61.42 -35.72 78.35 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.22 -0.925 . . . . 0.0 109.85 179.889 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -62.4 -47.2 85.17 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.264 -0.897 . . . . 0.0 109.075 179.329 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.584 HD11 HG21 ' A' ' 24' ' ' ILE . 41.8 mt -58.75 -33.46 70.29 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.424 -0.798 . . . . 0.0 109.229 178.971 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.495 ' HA ' ' CB ' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -65.73 -34.68 78.76 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.359 -0.838 . . . . 0.0 110.236 179.999 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -96.68 -31.93 12.44 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.086 -1.009 . . . . 0.0 110.832 -179.745 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.631 ' HB3' HD12 ' A' ' 17' ' ' LEU . 0.4 OUTLIER -76.02 -23.33 55.18 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.058 -1.026 . . . . 0.0 110.587 -179.726 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.683 HD23 ' HD2' ' A' ' 34' ' ' PRO . 0.2 OUTLIER -133.05 158.44 75.81 Favored Pre-proline 0 C--N 1.305 -1.334 0 O-C-N 121.096 -1.003 . . . . 0.0 110.403 -179.627 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.683 ' HD2' HD23 ' A' ' 33' ' ' LEU . 6.3 Cg_exo -50.58 134.02 39.12 Favored 'Trans proline' 0 C--N 1.305 -1.739 0 O-C-N 124.053 1.554 . . . . 0.0 110.056 179.769 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.42 ' C ' ' O ' ' A' ' 34' ' ' PRO . 33.9 Cg_endo -39.24 -35.23 0.66 Allowed 'Trans proline' 0 C--N 1.306 -1.701 0 O-C-N 124.133 1.596 . . . . 0.0 110.723 -179.636 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -65.31 -44.67 87.12 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.164 -0.96 . . . . 0.0 110.585 -179.73 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.517 ' CG ' ' HG2' ' A' ' 34' ' ' PRO . 28.6 mm100 -69.33 -38.11 78.03 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.157 -0.965 . . . . 0.0 110.549 -179.66 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.495 ' CB ' ' HA ' ' A' ' 30' ' ' ARG . . . -56.38 -42.55 78.06 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.212 -0.93 . . . . 0.0 110.549 -179.902 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 40.0 tt0 -64.27 -45.01 89.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.116 -0.99 . . . . 0.0 110.383 -179.759 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.09 -48.33 71.32 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.141 -0.974 . . . . 0.0 110.401 -179.86 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.456 ' O ' ' HG3' ' A' ' 45' ' ' MET . 54.8 m -65.75 -43.59 88.5 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.328 -0.857 . . . . 0.0 110.518 -179.846 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.454 ' CG1' ' O ' ' A' ' 38' ' ' ALA . 61.1 mt -60.26 -22.9 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.236 -0.915 . . . . 0.0 110.782 -179.56 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.96 -31.21 23.7 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.119 -0.988 . . . . 0.0 110.834 -179.509 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.561 ' HG3' ' CE1' ' A' ' 63' ' ' PHE . 0.2 OUTLIER -76.3 -65.15 0.96 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.224 -0.922 . . . . 0.0 110.589 -179.704 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.601 ' CE ' ' CB ' ' A' ' 60' ' ' TYR . 12.0 mtt -39.44 111.12 0.66 Allowed Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.379 -0.825 . . . . 0.0 110.863 -179.737 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.485 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 6.7 Cg_endo -67.2 -155.68 0.03 OUTLIER 'Trans proline' 0 C--N 1.304 -1.775 0 O-C-N 124.018 1.536 . . . . 0.0 109.865 179.497 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -94.51 121.7 36.34 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.109 -0.994 . . . . 0.0 110.263 179.913 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -50.79 -58.78 5.11 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.375 -0.828 . . . . 0.0 110.337 -179.987 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 58.03 162.1 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.183 -0.948 . . . . 0.0 110.236 -179.957 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 164.99 -129.11 1.9 Allowed Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.962 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -92.3 2.48 3.93 Favored 'Trans proline' 0 C--N 1.305 -1.729 0 O-C-N 124.019 1.536 . . . . 0.0 110.276 179.944 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.476 ' O ' ' O ' ' A' ' 53' ' ' SER . . . 151.96 41.8 0.02 OUTLIER Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.942 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.476 ' O ' ' O ' ' A' ' 52' ' ' GLY . 12.7 p -54.39 -161.75 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.289 0 O-C-N 121.403 -1.057 . . . . 0.0 110.642 -179.633 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.42 ' HA ' ' HD3' ' A' ' 55' ' ' PRO . 30.1 m -134.22 154.29 79.94 Favored Pre-proline 0 N--CA 1.492 1.657 0 O-C-N 121.267 -0.896 . . . . 0.0 110.2 179.893 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 54' ' ' VAL . 21.3 Cg_exo -67.47 87.79 0.34 Allowed 'Trans proline' 0 C--N 1.305 -1.721 0 O-C-N 124.076 1.566 . . . . 0.0 110.34 -179.966 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 157.92 -27.95 0.46 Allowed Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.43 -1.468 . . . . 0.0 109.43 -179.936 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.78 107.45 4.59 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.374 -1.074 . . . . 0.0 110.151 179.974 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.535 ' HB3' ' CB ' ' A' ' 45' ' ' MET . 80.3 mt -104.11 155.72 18.47 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.211 -0.931 . . . . 0.0 110.266 179.974 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -98.97 111.14 23.62 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.249 -0.907 . . . . 0.0 110.546 -179.852 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.601 ' CB ' ' CE ' ' A' ' 45' ' ' MET . 31.7 p90 -76.22 -28.79 57.33 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.276 -0.89 . . . . 0.0 110.268 179.708 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.571 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -56.06 -41.41 75.02 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.233 -0.917 . . . . 0.0 110.135 -179.67 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.485 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -65.61 -35.56 81.17 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.238 -0.913 . . . . 0.0 109.791 179.823 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.566 ' O ' ' CD1' ' A' ' 63' ' ' PHE . 1.5 t80 -72.28 -36.34 68.95 Favored 'General case' 0 C--N 1.298 -1.659 0 O-C-N 121.607 -0.683 . . . . 0.0 110.242 179.807 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.567 ' O ' ' CE2' ' A' ' 68' ' ' TYR . 2.7 p -63.67 -49.85 71.59 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.211 -0.93 . . . . 0.0 110.455 -179.683 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.613 ' HA ' ' CD2' ' A' ' 68' ' ' TYR . 43.3 m -60.11 -47.56 85.39 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.168 -0.957 . . . . 0.0 110.264 -179.869 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -55.98 -36.68 68.15 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.189 -0.944 . . . . 0.0 110.204 -179.971 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.882 HD21 ' O ' ' B' ' 19' ' ' ALA . 0.2 OUTLIER -54.73 -32.54 59.84 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.288 -0.882 . . . . 0.0 110.232 -179.952 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.8 ' CE2' ' HB1' ' A' ' 7' ' ' ALA . 1.5 m-85 -84.98 -31.78 23.36 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.238 -0.914 . . . . 0.0 110.205 -179.692 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -81.57 171.41 52.83 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.769 -1.332 . . . . 0.0 109.769 -179.81 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -115.34 6.54 14.9 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.233 -1.157 . . . . 0.0 110.218 179.928 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.7 m -157.87 110.42 2.38 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.238 -0.914 . . . . 0.0 110.193 -179.961 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -92.3 139.31 30.73 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.21 -0.932 . . . . 0.0 110.254 -179.927 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.622 0 O-C-N 121.296 -0.877 . . . . 0.0 110.194 179.922 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.322 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 1.8 pttt -94.1 50.52 1.41 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.229 -1.159 . . . . 0.0 110.185 -179.976 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.613 ' HA ' HG21 ' A' ' 16' ' ' ILE . 0.4 OUTLIER -63.26 -48.88 76.3 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.249 -0.907 . . . . 0.0 110.172 -179.99 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.34 -39.42 69.99 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.198 -0.939 . . . . 0.0 110.009 179.91 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -63.45 -39.78 95.39 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.314 -0.867 . . . . 0.0 110.14 179.836 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.28 -42.39 99.3 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.181 -0.949 . . . . 0.0 109.95 -179.985 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.456 HG13 ' HG ' ' A' ' 33' ' ' LEU . 98.4 t -59.6 -40.4 82.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.164 -0.96 . . . . 0.0 109.712 179.5 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.41 -36.84 76.61 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.279 -0.888 . . . . 0.0 109.898 179.746 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 25.0 m -67.62 -42.77 81.85 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.275 -0.89 . . . . 0.0 110.14 179.914 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.807 ' O ' HG23 ' B' ' 20' ' ' VAL . 94.0 t -64.52 -40.42 88.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.299 -0.876 . . . . 0.0 110.28 179.968 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 67.8 t -63.07 -50.19 80.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.295 -0.878 . . . . 0.0 110.51 -179.684 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.33 -39.89 94.81 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.2 -0.938 . . . . 0.0 110.716 -179.598 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.882 ' O ' HD21 ' A' ' 67' ' ' LEU . . . -67.28 -41.57 85.26 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.187 -0.946 . . . . 0.0 110.613 -179.509 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.807 HG23 ' O ' ' B' ' 16' ' ' VAL . 63.7 t -67.45 -39.0 81.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.23 -0.919 . . . . 0.0 110.681 -179.526 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.02 -33.01 75.03 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.234 -0.916 . . . . 0.0 110.495 -179.744 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -56.3 -45.52 80.2 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.261 -0.899 . . . . 0.0 110.459 -179.702 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.87 -38.4 88.7 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.196 -0.94 . . . . 0.0 110.422 -179.768 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 8.4 ttt-85 -67.09 -47.93 69.74 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.193 -0.942 . . . . 0.0 110.21 -179.867 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 89.7 t -64.23 -21.14 28.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.312 -0.868 . . . . 0.0 110.292 -179.867 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 25.2 ttt85 -87.78 -87.55 0.15 Allowed 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.311 -0.868 . . . . 0.0 110.165 179.962 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -100.72 134.65 20.41 Favored Pre-proline 0 C--N 1.29 -2.021 0 O-C-N 121.695 -0.628 . . . . 0.0 110.224 179.995 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -89.79 93.03 0.31 Allowed 'Trans proline' 0 C--N 1.306 -1.677 0 O-C-N 124.036 1.545 . . . . 0.0 110.408 179.975 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.156 -0.965 . . . . 0.0 110.185 179.845 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 tpp . . . . . 0 N--CA 1.49 1.573 0 CA-C-O 121.205 0.526 . . . . 0.0 110.275 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -129.71 -168.01 1.89 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.211 -0.93 . . . . 0.0 110.299 -179.935 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -147.78 -61.43 0.26 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.256 -0.902 . . . . 0.0 110.245 179.896 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.4 t -155.89 -174.41 4.95 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.23 -0.919 . . . . 0.0 110.298 179.988 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.49 ' O ' ' N ' ' A' ' 7' ' ' ALA . 8.8 p-10 -60.51 178.53 0.21 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.294 -0.878 . . . . 0.0 110.299 -179.993 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.46 ' CB ' ' O ' ' A' ' 5' ' ' ASP . 1.8 m 67.07 -58.46 0.41 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.28 -0.888 . . . . 0.0 110.128 -179.813 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.49 ' N ' ' O ' ' A' ' 5' ' ' ASP . . . -66.59 -44.51 81.98 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.279 -0.888 . . . . 0.0 109.703 179.627 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -55.74 -36.92 67.8 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.314 -0.866 . . . . 0.0 109.702 179.618 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.406 ' O ' ' OG ' ' A' ' 13' ' ' SER . 2.9 tt0 -62.12 -48.33 80.64 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.261 -0.899 . . . . 0.0 110.08 179.957 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.51 HG12 ' HD2' ' A' ' 14' ' ' PHE . 73.1 t -59.86 -46.83 93.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.159 -0.963 . . . . 0.0 109.89 179.864 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.75 HG23 ' HE1' ' A' ' 60' ' ' TYR . 79.0 mt -56.92 -48.34 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.366 -0.834 . . . . 0.0 109.607 179.586 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.425 ' O ' HG13 ' A' ' 16' ' ' ILE . . . -57.49 -39.55 76.7 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.316 -0.865 . . . . 0.0 109.095 179.172 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.501 ' HA ' ' HB1' ' B' ' 12' ' ' ALA . 1.1 m -68.79 -39.06 80.33 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.481 -0.762 . . . . 0.0 109.124 178.955 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.536 ' CG ' ' HB2' ' A' ' 60' ' ' TYR . 4.9 m-85 -68.55 -45.24 72.68 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.43 -0.794 . . . . 0.0 109.793 179.425 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.3 ttt-85 -53.02 -41.09 64.36 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.299 -0.876 . . . . 0.0 109.495 179.496 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.621 HD12 ' HB2' ' B' ' 12' ' ' ALA . 42.0 mt -63.47 -43.79 98.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.272 -0.892 . . . . 0.0 109.985 179.723 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.471 HD22 ' HB3' ' A' ' 32' ' ' GLU . 75.8 mt -62.98 -41.71 99.63 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.109 -0.995 . . . . 0.0 109.691 179.561 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.709 ' HB2' HG12 ' A' ' 24' ' ' ILE . . . -75.77 1.14 15.6 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.342 -0.849 . . . . 0.0 110.132 179.757 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.463 ' O ' ' CB ' ' A' ' 20' ' ' ASP . 0.1 OUTLIER 66.69 55.16 0.79 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.177 -0.952 . . . . 0.0 110.099 -179.897 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.463 ' CB ' ' O ' ' A' ' 19' ' ' SER . 13.6 t0 65.82 65.02 0.54 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.241 -0.912 . . . . 0.0 110.14 -179.97 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.625 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 26.8 mttt -148.79 143.76 17.52 Favored Pre-proline 0 N--CA 1.49 1.537 0 O-C-N 121.255 -0.903 . . . . 0.0 110.145 -179.968 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.546 ' O ' ' CD1' ' A' ' 23' ' ' TYR . 11.3 Cg_endo -73.32 -0.73 9.6 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 O-C-N 124.083 1.57 . . . . 0.0 110.068 179.495 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.546 ' CD1' ' O ' ' A' ' 22' ' ' PRO . 25.9 m-85 -139.98 158.85 43.41 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.247 -0.908 . . . . 0.0 109.842 179.863 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.77 HD13 ' H ' ' A' ' 25' ' ' LEU . 0.4 OUTLIER -124.39 150.77 29.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.115 -0.991 . . . . 0.0 109.942 179.984 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.77 ' H ' HD13 ' A' ' 24' ' ' ILE . 15.6 mt -92.74 145.61 24.28 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.067 -1.021 . . . . 0.0 110.26 -179.842 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.45 -45.39 80.84 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.221 -0.924 . . . . 0.0 110.278 -179.862 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -61.14 -35.7 77.79 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.208 -0.932 . . . . 0.0 109.917 179.871 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.557 ' HB3' HD11 ' A' ' 24' ' ' ILE . 21.9 mm-40 -60.15 -45.2 93.86 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.344 -0.847 . . . . 0.0 109.796 179.795 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.406 HD13 ' CB ' ' A' ' 41' ' ' CYS . 26.2 mt -63.15 -34.27 77.26 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.359 -0.838 . . . . 0.0 109.827 179.68 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.537 ' HA ' ' HB2' ' A' ' 38' ' ' ALA . 24.3 mtt-85 -68.88 -38.26 79.58 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.356 -0.84 . . . . 0.0 110.219 -179.927 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.5 -26.24 18.04 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.291 -0.881 . . . . 0.0 110.831 -179.568 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.471 ' HB3' HD22 ' A' ' 17' ' ' LEU . 75.4 mm-40 -89.88 -23.74 21.56 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.098 -1.001 . . . . 0.0 110.658 -179.69 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.773 HD21 HG23 ' B' ' 17' ' ' VAL . 1.3 mt -128.73 155.85 78.53 Favored Pre-proline 0 N--CA 1.488 1.451 0 O-C-N 121.19 -0.944 . . . . 0.0 110.056 -179.797 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.769 ' HD2' HD23 ' A' ' 33' ' ' LEU . 47.9 Cg_exo -52.56 144.4 41.86 Favored 'Trans proline' 0 C--N 1.304 -1.793 0 O-C-N 124.009 1.531 . . . . 0.0 110.302 179.972 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -41.87 -45.13 6.92 Favored 'Trans proline' 0 C--N 1.305 -1.744 0 O-C-N 124.003 1.528 . . . . 0.0 110.589 -179.842 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -58.36 -43.66 88.49 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.196 -0.94 . . . . 0.0 110.434 -179.771 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.688 ' HG3' HG22 ' B' ' 17' ' ' VAL . 75.3 mm-40 -68.97 -40.75 78.65 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.213 -0.929 . . . . 0.0 110.16 -179.959 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.537 ' HB2' ' HA ' ' A' ' 30' ' ' ARG . . . -56.54 -47.13 80.08 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.299 -0.876 . . . . 0.0 110.39 -179.956 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.2 tp60 -65.85 -46.72 77.43 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.159 -0.963 . . . . 0.0 110.252 -179.858 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -64.04 -48.01 77.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.28 -0.887 . . . . 0.0 110.209 -179.96 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.413 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 77.5 m -65.13 -47.7 76.19 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.219 -0.926 . . . . 0.0 110.159 -179.946 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 54.5 mt -58.34 -23.49 22.34 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.255 -0.903 . . . . 0.0 110.234 179.935 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.48 -41.31 16.7 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.242 -0.912 . . . . 0.0 110.33 -179.809 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.63 ' CB ' ' CD2' ' A' ' 63' ' ' PHE . 1.0 OUTLIER -64.11 -73.93 0.11 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.109 -0.994 . . . . 0.0 109.975 -179.916 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.594 ' CG ' ' HA ' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -38.47 117.21 0.96 Allowed Pre-proline 0 N--CA 1.488 1.427 0 O-C-N 121.382 -0.824 . . . . 0.0 111.473 179.847 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.424 ' HD2' ' HA ' ' A' ' 45' ' ' MET . 7.7 Cg_endo -72.39 -154.47 0.04 OUTLIER 'Trans proline' 0 C--N 1.302 -1.871 0 O-C-N 123.829 1.436 . . . . 0.0 108.51 178.33 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.435 ' O ' ' C ' ' A' ' 48' ' ' TYR . . . -100.43 115.6 30.43 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.77 -1.206 . . . . 0.0 110.176 179.653 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.487 ' CE1' ' CZ ' ' A' ' 23' ' ' TYR . 3.7 t80 -39.65 -60.02 1.04 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.565 -0.709 . . . . 0.0 110.295 -179.946 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 61.91 160.31 0.07 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.191 -0.943 . . . . 0.0 110.07 -179.875 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 148.07 -159.02 27.9 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 179.996 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -71.06 83.57 0.93 Allowed 'Trans proline' 0 C--N 1.305 -1.721 0 O-C-N 123.97 1.511 . . . . 0.0 110.207 179.93 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.498 ' O ' ' O ' ' A' ' 53' ' ' SER . . . 109.84 -89.47 0.55 Allowed Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.918 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.498 ' O ' ' O ' ' A' ' 52' ' ' GLY . 0.7 OUTLIER 49.78 169.63 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.287 0 O-C-N 121.579 -0.953 . . . . 0.0 111.17 179.38 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 28.8 m -145.73 154.93 52.46 Favored Pre-proline 0 C--N 1.299 -1.601 0 O-C-N 121.32 -0.863 . . . . 0.0 110.262 -179.636 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -63.92 84.67 0.14 Allowed 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 124.01 1.532 . . . . 0.0 110.305 179.877 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.463 ' O ' HD23 ' A' ' 58' ' ' LEU . . . 169.44 -37.21 0.19 Allowed Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 -179.987 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -77.31 110.99 12.5 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.189 -1.183 . . . . 0.0 110.207 -179.886 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.59 HD11 HG22 ' A' ' 24' ' ' ILE . 0.6 OUTLIER -114.89 160.87 19.0 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.318 -0.864 . . . . 0.0 110.131 179.874 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -99.47 115.86 30.27 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.306 -0.871 . . . . 0.0 111.45 -179.17 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.75 ' HE1' HG23 ' A' ' 11' ' ' ILE . 9.1 p90 -78.43 -21.66 48.87 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.429 -0.794 . . . . 0.0 110.145 179.114 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.564 ' N ' ' CD1' ' A' ' 60' ' ' TYR . . . -55.85 -33.11 64.23 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.212 -0.93 . . . . 0.0 109.753 179.973 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.434 ' O ' ' CB ' ' A' ' 66' ' ' ALA . . . -65.2 -32.36 74.0 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.284 -0.885 . . . . 0.0 109.486 179.451 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.63 ' CD2' ' CB ' ' A' ' 44' ' ' ARG . 5.9 t80 -65.89 -41.94 90.92 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.742 -0.599 . . . . 0.0 110.223 179.884 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 70.1 p -68.52 -49.58 58.54 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.269 -0.895 . . . . 0.0 110.37 -179.854 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.9 m -68.51 -35.5 77.58 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.273 -0.892 . . . . 0.0 110.381 -179.881 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.434 ' CB ' ' O ' ' A' ' 62' ' ' ALA . . . -67.08 -44.01 81.14 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.241 -0.912 . . . . 0.0 110.386 -179.838 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.549 ' CD1' ' HB2' ' B' ' 23' ' ' ALA . 3.6 mm? -68.39 -41.93 79.81 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.179 -0.951 . . . . 0.0 110.633 -179.745 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -98.98 15.37 25.95 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.068 -1.02 . . . . 0.0 110.56 -179.759 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -55.27 123.2 29.07 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.346 -1.501 . . . . 0.0 109.346 179.879 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -159.23 105.94 1.74 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.23 -1.159 . . . . 0.0 110.342 -179.966 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 66.8 m 43.75 48.01 6.7 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.268 -0.895 . . . . 0.0 110.34 179.977 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -65.85 132.22 48.16 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.168 -0.958 . . . . 0.0 110.183 179.89 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.611 0 O-C-N 121.222 -0.923 . . . . 0.0 110.243 -179.953 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 7' ' ' GLY . . . . . 0.5 ' O ' ' N ' ' B' ' 9' ' ' LYS . . . . . . . . 0 N--CA 1.489 2.194 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.442 ' CB ' ' O ' ' B' ' 7' ' ' GLY . 4.0 tptp 66.29 -63.95 0.23 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.29 -1.123 . . . . 0.0 110.16 179.966 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.704 ' O ' HG23 ' B' ' 13' ' ' VAL . 7.7 ttmt -66.87 -37.51 84.56 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.251 -0.906 . . . . 0.0 110.184 179.993 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.65 -37.24 80.85 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.249 -0.907 . . . . 0.0 110.09 179.855 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -66.02 -41.77 90.52 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.295 -0.878 . . . . 0.0 109.97 179.895 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . 0.621 ' HB2' HD12 ' A' ' 16' ' ' ILE . . . -65.59 -40.03 92.24 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.402 -0.811 . . . . 0.0 109.958 179.752 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.704 HG23 ' O ' ' B' ' 9' ' ' LYS . 57.5 t -59.72 -44.83 94.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.352 -0.843 . . . . 0.0 110.077 179.751 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.62 -39.23 93.14 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.147 -0.971 . . . . 0.0 109.946 179.875 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.71 -47.61 80.41 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.357 -0.839 . . . . 0.0 110.07 179.864 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.681 ' O ' HG23 ' B' ' 20' ' ' VAL . 58.8 t -63.65 -45.51 97.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.285 -0.884 . . . . 0.0 110.028 179.884 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.773 HG23 HD21 ' A' ' 33' ' ' LEU . 24.2 t -60.74 -50.87 78.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.3 -0.875 . . . . 0.0 110.003 179.891 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.96 -40.91 67.24 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.271 -0.893 . . . . 0.0 110.091 179.815 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.79 -45.54 78.09 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.266 -0.896 . . . . 0.0 110.023 179.853 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.681 HG23 ' O ' ' B' ' 16' ' ' VAL . 42.5 t -67.21 -43.1 88.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.287 -0.883 . . . . 0.0 110.049 179.855 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.606 ' O ' HG23 ' B' ' 25' ' ' VAL . 35.7 t70 -57.3 -37.38 72.35 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.278 -0.888 . . . . 0.0 110.053 179.966 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -49.03 76.89 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.29 -0.881 . . . . 0.0 110.143 -179.987 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.549 ' HB2' ' CD1' ' A' ' 67' ' ' LEU . . . -59.04 -36.06 74.38 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.221 -0.924 . . . . 0.0 110.11 -179.927 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.66 -37.57 87.82 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.319 -0.863 . . . . 0.0 110.08 179.849 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . 0.606 HG23 ' O ' ' B' ' 21' ' ' ASP . 25.2 t -60.04 -21.41 21.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.253 -0.904 . . . . 0.0 110.034 179.897 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 55.52 56.69 6.01 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.389 -0.819 . . . . 0.0 110.379 179.79 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . 0.402 ' HA ' ' HD3' ' B' ' 28' ' ' PRO . 0.5 OUTLIER -77.54 151.0 80.06 Favored Pre-proline 0 N--CA 1.489 1.484 0 O-C-N 121.202 -0.937 . . . . 0.0 110.118 179.901 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' B' ' 27' ' ' GLU . 35.9 Cg_exo -71.54 148.86 54.68 Favored 'Trans proline' 0 C--N 1.306 -1.673 0 O-C-N 123.911 1.48 . . . . 0.0 110.287 -179.965 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 28.8 ttp85 . . . . . 0 N--CA 1.492 1.641 0 O-C-N 121.245 -0.91 . . . . 0.0 110.204 179.934 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 121.145 0.498 . . . . 0.0 110.206 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -172.08 73.56 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.254 -0.904 . . . . 0.0 110.38 179.948 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.424 ' O ' ' O ' ' A' ' 4' ' ' THR . 30.1 t70 -160.86 66.53 0.31 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.216 -0.928 . . . . 0.0 110.309 179.775 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.424 ' O ' ' O ' ' A' ' 3' ' ' ASP . 0.2 OUTLIER 58.29 111.15 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.198 -0.939 . . . . 0.0 110.123 -179.982 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.444 ' HB3' ' HB3' ' A' ' 8' ' ' GLU . 32.6 t0 -148.45 162.25 39.98 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.285 -0.884 . . . . 0.0 110.266 -179.935 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.512 ' CG2' ' CZ ' ' A' ' 68' ' ' TYR . 2.5 m -98.63 -41.91 7.5 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.303 -0.873 . . . . 0.0 110.304 -179.937 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -65.38 -47.4 76.5 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.239 -0.913 . . . . 0.0 109.867 179.896 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.444 ' HB3' ' HB3' ' A' ' 5' ' ' ASP . 37.8 tt0 -56.02 -35.54 66.95 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.402 -0.811 . . . . 0.0 109.993 179.626 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 16.7 tp60 -60.62 -38.94 86.4 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.191 -0.943 . . . . 0.0 109.841 -179.931 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.891 HG12 ' CD2' ' A' ' 14' ' ' PHE . 53.9 t -61.16 -41.03 87.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 121.162 -0.961 . . . . 0.0 109.192 179.242 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.469 HG23 ' HE1' ' A' ' 60' ' ' TYR . 11.9 mm -55.26 -49.78 69.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.351 -0.843 . . . . 0.0 109.615 179.452 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.83 -43.61 94.48 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.362 -0.836 . . . . 0.0 109.324 179.331 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.41 ' CB ' HG23 ' B' ' 16' ' ' VAL . 2.7 m -66.69 -40.56 88.57 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.383 -0.823 . . . . 0.0 109.314 179.215 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.891 ' CD2' HG12 ' A' ' 10' ' ' VAL . 1.2 m-85 -68.38 -40.92 81.24 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.333 -0.855 . . . . 0.0 109.587 179.323 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.08 -50.19 64.9 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.362 -0.836 . . . . 0.0 109.561 179.538 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 68.1 mt -60.06 -40.88 84.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.295 -0.878 . . . . 0.0 109.711 179.424 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.743 HD11 HG22 ' B' ' 13' ' ' VAL . 0.6 OUTLIER -65.06 -36.2 83.6 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.396 -0.815 . . . . 0.0 109.894 179.684 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.659 ' HB2' ' HB ' ' A' ' 24' ' ' ILE . . . -89.67 8.22 32.66 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.344 -0.847 . . . . 0.0 110.172 -179.912 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.474 ' CB ' ' O ' ' A' ' 18' ' ' ALA . 0.4 OUTLIER 67.75 55.66 0.59 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.196 -0.94 . . . . 0.0 110.254 179.991 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.425 ' N ' ' OD1' ' A' ' 20' ' ' ASP . 5.8 m-20 52.28 56.67 7.39 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.285 -0.884 . . . . 0.0 110.397 179.733 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' A' ' 19' ' ' SER . 68.2 mttt -138.52 140.39 27.76 Favored Pre-proline 0 N--CA 1.49 1.551 0 O-C-N 121.19 -0.944 . . . . 0.0 109.951 179.777 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.61 -11.76 18.48 Favored 'Trans proline' 0 C--N 1.305 -1.749 0 O-C-N 124.051 1.553 . . . . 0.0 110.11 179.901 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.57 ' O ' ' HB1' ' A' ' 18' ' ' ALA . 47.8 p90 -135.46 171.25 14.71 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.264 -0.897 . . . . 0.0 110.05 179.805 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.659 ' HB ' ' HB2' ' A' ' 18' ' ' ALA . 8.9 tt -146.72 158.01 10.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.231 -0.918 . . . . 0.0 110.241 -179.917 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.5 mp -91.25 145.14 24.91 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.226 -0.921 . . . . 0.0 110.197 -179.939 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.538 ' HA ' ' CD2' ' A' ' 29' ' ' LEU . . . -59.7 -39.52 84.86 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.303 -0.873 . . . . 0.0 110.328 -179.955 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.73 -35.88 81.14 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.183 -0.948 . . . . 0.0 109.921 179.742 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -69.61 -51.17 37.52 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.338 -0.851 . . . . 0.0 109.554 179.65 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.745 HD12 ' C ' ' A' ' 29' ' ' LEU . 1.7 pp -67.75 -33.53 75.04 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.31 -0.869 . . . . 0.0 109.595 179.192 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.629 ' HA ' ' HB1' ' A' ' 38' ' ' ALA . 0.0 OUTLIER -62.89 -34.47 77.48 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.352 -0.842 . . . . 0.0 110.132 179.79 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -83.68 -31.38 26.16 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.252 -0.905 . . . . 0.0 110.173 179.93 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -76.4 -23.6 54.03 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.266 -0.896 . . . . 0.0 110.287 -179.944 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.784 HD22 ' HB3' ' A' ' 37' ' ' GLN . 1.4 mt -112.92 151.3 43.96 Favored Pre-proline 0 C--N 1.305 -1.357 0 O-C-N 121.197 -0.939 . . . . 0.0 110.061 -179.929 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.462 ' CB ' ' HD2' ' A' ' 35' ' ' PRO . 35.2 Cg_exo -55.0 172.28 0.39 Allowed 'Trans proline' 0 C--N 1.304 -1.815 0 O-C-N 124.033 1.544 . . . . 0.0 110.232 179.946 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.462 ' HD2' ' CB ' ' A' ' 34' ' ' PRO . 30.8 Cg_endo -59.02 -45.8 26.14 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 123.952 1.501 . . . . 0.0 110.311 -179.83 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -66.3 -43.02 87.45 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.323 -0.861 . . . . 0.0 110.77 -179.807 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.784 ' HB3' HD22 ' A' ' 33' ' ' LEU . 4.1 mp0 -69.63 -42.64 74.05 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.156 -0.965 . . . . 0.0 110.381 -179.616 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.629 ' HB1' ' HA ' ' A' ' 30' ' ' ARG . . . -57.26 -48.66 78.29 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.297 -0.877 . . . . 0.0 110.36 -179.726 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 14.2 tm0? -66.82 -43.32 84.06 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.261 -0.899 . . . . 0.0 110.777 -179.78 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -64.91 -42.32 94.82 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.104 -0.997 . . . . 0.0 110.503 -179.521 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.492 ' O ' ' HG2' ' A' ' 45' ' ' MET . 73.6 m -65.22 -51.32 61.68 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.111 -0.993 . . . . 0.0 110.709 -179.687 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.533 HG13 HD11 ' A' ' 29' ' ' LEU . 50.6 mt -53.72 -23.6 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.181 -0.95 . . . . 0.0 110.757 -179.588 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.36 -19.14 31.89 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.117 -0.989 . . . . 0.0 110.649 -179.65 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.608 ' HB3' ' CD1' ' A' ' 63' ' ' PHE . 18.4 mmt180 -89.56 -69.99 0.69 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.228 -0.92 . . . . 0.0 110.834 -179.495 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.517 ' CB ' ' O ' ' A' ' 59' ' ' ASP . 9.4 ptp -46.89 110.02 1.18 Allowed Pre-proline 0 N--CA 1.488 1.464 0 O-C-N 121.136 -0.978 . . . . 0.0 110.639 -179.408 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.833 ' HD2' ' HB3' ' A' ' 62' ' ' ALA . 9.6 Cg_endo -63.37 -157.64 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.622 0 O-C-N 124.132 1.596 . . . . 0.0 110.184 179.882 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.45 ' O ' ' C ' ' A' ' 48' ' ' TYR . . . -75.57 128.77 35.99 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.22 -0.925 . . . . 0.0 110.369 -179.794 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.565 ' CE2' ' HB2' ' A' ' 53' ' ' SER . 28.7 p90 -39.24 -39.93 0.69 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.536 -0.727 . . . . 0.0 110.502 179.858 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.52 ' N ' ' CG ' ' A' ' 48' ' ' TYR . 0.1 OUTLIER 60.47 93.1 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.205 -0.935 . . . . 0.0 110.204 -179.943 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -165.26 179.1 39.95 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 -179.919 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -87.66 -66.76 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.759 0 O-C-N 124.096 1.577 . . . . 0.0 110.195 179.954 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.481 ' O ' ' O ' ' A' ' 53' ' ' SER . . . -81.88 61.92 4.6 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 179.896 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.565 ' HB2' ' CE2' ' A' ' 48' ' ' TYR . 38.8 t -54.5 -159.93 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.387 -1.067 . . . . 0.0 111.011 -179.53 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.815 ' CG2' ' HB2' ' A' ' 57' ' ' ALA . 15.7 m -155.64 169.47 10.32 Favored Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.424 -0.798 . . . . 0.0 109.795 179.836 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.466 ' HD2' ' HB ' ' A' ' 54' ' ' VAL . 2.7 Cg_endo -52.22 87.94 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.754 0 O-C-N 123.946 1.498 . . . . 0.0 110.224 179.861 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.519 ' N ' ' O ' ' A' ' 54' ' ' VAL . . . 73.54 94.11 0.11 Allowed Glycine 0 N--CA 1.492 2.382 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 -179.975 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.815 ' HB2' ' CG2' ' A' ' 54' ' ' VAL . . . -121.12 140.75 51.55 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.276 -1.131 . . . . 0.0 110.575 -179.973 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.501 HD11 ' HB2' ' A' ' 26' ' ' ALA . 2.3 mt -129.88 160.39 33.67 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.374 -0.829 . . . . 0.0 109.81 179.582 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.517 ' O ' ' CB ' ' A' ' 45' ' ' MET . 1.3 t70 -110.39 110.76 21.66 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.063 -1.023 . . . . 0.0 110.673 -179.789 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.574 ' HB2' ' CD2' ' A' ' 14' ' ' PHE . 40.6 p90 -75.86 -24.24 55.73 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.211 -0.931 . . . . 0.0 109.33 179.231 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.429 ' HB3' ' OD2' ' A' ' 59' ' ' ASP . . . -62.54 -44.4 96.45 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.469 -0.769 . . . . 0.0 109.617 179.67 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.833 ' HB3' ' HD2' ' A' ' 46' ' ' PRO . . . -61.56 -32.81 72.91 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.254 -0.904 . . . . 0.0 109.917 179.682 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.642 ' HZ ' HG22 ' B' ' 20' ' ' VAL . 1.2 t80 -71.4 -39.78 70.94 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.52 -0.737 . . . . 0.0 110.241 179.881 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.476 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 3.6 t -61.05 -50.1 74.7 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.264 -0.898 . . . . 0.0 110.609 -179.69 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.43 -35.3 77.41 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.216 -0.928 . . . . 0.0 110.447 -179.783 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.0 -46.3 68.35 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.208 -0.933 . . . . 0.0 110.786 -179.542 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.761 HD11 ' CD2' ' A' ' 68' ' ' TYR . 2.5 pp -70.84 -33.01 70.21 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.097 -1.002 . . . . 0.0 110.752 -179.477 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.761 ' CD2' HD11 ' A' ' 67' ' ' LEU . 0.4 OUTLIER -99.55 7.73 45.07 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.26 -0.9 . . . . 0.0 110.391 179.975 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -116.75 133.36 10.64 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 -179.995 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -106.74 175.35 5.53 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.268 -1.136 . . . . 0.0 110.19 179.998 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -82.96 -33.74 26.61 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.269 -0.895 . . . . 0.0 110.162 179.994 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -98.38 119.72 37.56 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.229 -0.919 . . . . 0.0 110.2 -179.926 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.579 0 O-C-N 121.16 -0.963 . . . . 0.0 110.124 179.938 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.251 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -164.64 40.23 0.08 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.242 -1.152 . . . . 0.0 110.139 179.901 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.749 ' O ' HG23 ' B' ' 13' ' ' VAL . 1.5 tttp -62.26 -48.84 78.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.244 -0.91 . . . . 0.0 110.089 179.892 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.67 -45.55 77.71 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.329 -0.857 . . . . 0.0 110.213 179.881 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -63.45 -41.13 98.65 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.317 -0.864 . . . . 0.0 110.068 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.25 -33.7 76.07 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.309 -0.869 . . . . 0.0 110.167 -179.965 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.749 HG23 ' O ' ' B' ' 9' ' ' LYS . 58.6 t -64.36 -41.96 93.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.278 -0.889 . . . . 0.0 110.093 -179.973 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.04 -35.65 79.23 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.228 -0.92 . . . . 0.0 110.415 -179.974 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 28.7 m -62.31 -44.01 97.5 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.175 -0.953 . . . . 0.0 110.522 -179.862 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.41 HG23 ' CB ' ' A' ' 13' ' ' SER . 84.2 t -68.74 -42.54 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.201 -0.937 . . . . 0.0 110.578 -179.728 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.546 HG23 ' O ' ' B' ' 13' ' ' VAL . 89.9 t -58.28 -44.83 88.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.098 -1.001 . . . . 0.0 110.503 -179.86 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.91 -38.49 91.27 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.316 -0.865 . . . . 0.0 110.285 -179.823 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.99 -46.06 82.99 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.169 -0.957 . . . . 0.0 110.39 -179.935 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.642 HG22 ' HZ ' ' A' ' 63' ' ' PHE . 76.1 t -65.45 -42.33 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.239 -0.913 . . . . 0.0 110.309 -179.86 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -58.48 -41.62 85.68 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.25 -0.906 . . . . 0.0 110.202 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.87 ' O ' HG12 ' B' ' 25' ' ' VAL . 3.5 tm0? -60.49 -47.84 84.38 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.219 -0.925 . . . . 0.0 110.005 -179.944 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.88 -35.09 80.01 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.296 -0.877 . . . . 0.0 110.195 179.875 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . 0.448 ' HG2' ' NH1' ' B' ' 24' ' ' ARG . 17.8 ttp85 -63.62 -45.27 91.08 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.233 -0.917 . . . . 0.0 110.456 -179.857 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . 0.87 HG12 ' O ' ' B' ' 22' ' ' GLN . 2.7 p -62.71 -20.8 26.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.178 -0.952 . . . . 0.0 110.306 -179.881 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 1.2 mtm180 -93.22 -45.62 7.77 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-O 122.001 0.905 . . . . 0.0 110.677 -179.649 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . 0.485 ' HA ' ' HD3' ' B' ' 28' ' ' PRO . 39.2 tt0 -90.12 133.61 33.18 Favored Pre-proline 0 C--N 1.285 -2.197 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.281 -179.61 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . 0.485 ' HD3' ' HA ' ' B' ' 27' ' ' GLU . 3.1 Cg_exo -82.56 118.02 2.79 Favored 'Trans proline' 0 C--N 1.306 -1.682 0 O-C-N 124.044 1.549 . . . . 0.0 110.184 179.981 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.139 -0.976 . . . . 0.0 110.225 179.971 . . . . . . . . 0 0 . 1 stop_ save_