data_1yyj_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 1yyj _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 . . . . . 0 N--CA 1.493 1.722 0 CA-C-O 121.649 0.737 . . . . 0.0 109.088 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 44.4 mt -88.93 -50.08 6.41 Favored 'General case' 0 C--N 1.295 -1.771 0 CA-C-O 121.556 0.694 . . . . 0.0 109.172 -179.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.796 ' CD ' ' CB ' ' A' ' 4' ' ' GLU . . . -65.75 -26.34 67.68 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 178.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -76.87 -45.14 29.35 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.701 -179.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.566 HD21 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -52.33 -46.8 66.21 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 -179.19 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.566 ' N ' HD21 ' A' ' 6' ' ' ASN . 10.8 m95 -51.73 -57.76 8.33 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 179.588 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -58.5 -29.54 66.33 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 178.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.0 m -69.03 -55.41 10.91 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 119.328 -0.949 . . . . 0.0 108.986 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.8 mt -53.68 -40.82 66.27 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 106.845 -1.539 . . . . 0.0 106.845 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -68.21 -60.94 2.09 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 120.058 -0.657 . . . . 0.0 109.678 178.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -58.59 -13.6 6.14 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.394 -0.816 . . . . 0.0 110.153 -179.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -75.72 -54.69 6.55 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 179.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.4 mt -56.37 -28.58 59.59 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.296 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.2 ttpt -71.97 -42.71 66.22 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 120.802 -1.186 . . . . 0.0 108.942 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.573 ' O ' ' N ' ' A' ' 20' ' ' ALA . 72.5 t -59.33 -24.56 28.21 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.538 0 C-N-CA 119.323 -0.951 . . . . 0.0 109.256 -179.41 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.456 ' O ' ' N ' ' A' ' 20' ' ' ALA . 10.4 mt -70.94 -72.19 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.171 -0.956 . . . . 0.0 109.669 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -46.55 -28.3 1.38 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.249 -0.907 . . . . 0.0 109.139 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.69 1.98 32.55 Favored 'General case' 0 N--CA 1.504 2.234 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 179.082 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.573 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -57.08 -47.5 80.86 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.897 -1.127 . . . . 0.0 108.011 179.273 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.484 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 0.5 OUTLIER 67.13 -13.51 0.2 Allowed 'General case' 0 C--N 1.297 -1.711 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.728 179.659 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.649 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -146.17 146.41 30.82 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 120.842 -1.161 . . . . 0.0 110.029 179.043 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -58.62 -24.11 60.36 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.863 -0.523 . . . . 0.0 110.966 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.3 -51.29 64.21 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.0 -1.063 . . . . 0.0 110.017 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.519 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 7.0 mt-30 -69.33 -18.31 63.8 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.194 -0.941 . . . . 0.0 110.473 -179.502 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 61.6 t -71.17 -49.04 51.32 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 120.887 -1.133 . . . . 0.0 108.337 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.463 ' O ' ' N ' ' A' ' 31' ' ' THR . 8.4 mtpt -56.53 -55.26 35.99 Favored 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 106.754 -1.573 . . . . 0.0 106.754 179.024 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -51.13 -40.12 57.78 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 114.675 -1.148 . . . . 0.0 109.244 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.02 -63.33 1.08 Allowed 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.387 -0.821 . . . . 0.0 109.402 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 86.7 mt -62.95 -24.54 67.93 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.249 -0.907 . . . . 0.0 109.68 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.463 ' N ' ' O ' ' A' ' 27' ' ' LYS . 53.6 m -61.19 -39.68 91.09 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.942 -1.099 . . . . 0.0 108.344 179.284 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 39.3 mtpt -74.0 -30.68 62.59 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' MET . . . . . 0.402 ' C ' ' N ' ' A' ' 35' ' ' ALA . 34.5 mtp -66.23 -73.15 0.14 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.106 -0.996 . . . . 0.0 109.293 178.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.664 HH21 ' CB ' ' A' ' 73' ' ' ASP . 0.0 OUTLIER -46.04 -26.47 0.74 Allowed 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -179.168 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.402 ' N ' ' C ' ' A' ' 33' ' ' MET . . . -73.42 -63.36 1.21 Allowed 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 119.896 -0.722 . . . . 0.0 109.36 179.625 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.43 -28.0 69.5 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.073 -1.017 . . . . 0.0 109.426 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.35 -45.51 93.21 Favored 'General case' 0 N--CA 1.487 1.421 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 14.8 mt -65.77 -24.25 66.9 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 179.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -83.15 -47.86 11.16 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 179.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.431 ' O ' ' CB ' ' A' ' 43' ' ' ALA . . . -60.0 -9.78 3.48 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.389 -0.819 . . . . 0.0 109.465 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.496 ' C ' ' H ' ' A' ' 43' ' ' ALA . 1.3 tm0? -50.76 -57.1 9.17 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 120.683 -1.26 . . . . 0.0 108.017 179.233 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.32 32.2 0.09 Allowed 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.496 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -77.3 137.91 39.06 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.969 -1.082 . . . . 0.0 109.992 -179.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.63 ' N ' ' CD ' ' A' ' 45' ' ' PRO . 12.4 t -156.91 40.05 0.1 Allowed Pre-proline 0 N--CA 1.489 1.509 0 O-C-N 121.529 -0.732 . . . . 0.0 110.188 179.059 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.63 ' CD ' ' N ' ' A' ' 44' ' ' THR . 6.0 Cg_exo -45.28 -36.01 12.08 Favored 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 122.484 2.123 . . . . 0.0 113.923 178.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.48 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 46.7 Cg_endo -95.06 -12.93 0.79 Allowed 'Trans proline' 0 C--N 1.321 -0.872 0 C-N-CA 122.497 2.131 . . . . 0.0 111.333 -178.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.527 ' O ' ' NZ ' ' A' ' 51' ' ' LYS . 10.7 mtpt 82.89 105.93 0.06 Allowed 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.1 mt -79.59 4.38 16.09 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.361 -0.837 . . . . 0.0 108.971 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -98.55 18.79 15.86 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -147.0 42.59 1.13 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.801 -0.562 . . . . 0.0 110.067 -179.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.527 ' NZ ' ' O ' ' A' ' 47' ' ' LYS . 9.9 ptpp? -171.3 -143.07 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 108.636 -0.875 . . . . 0.0 108.636 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 28.5 t -76.74 116.28 55.38 Favored Pre-proline 0 N--CA 1.485 1.295 0 O-C-N 120.658 -1.276 . . . . 0.0 109.431 179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -85.76 -12.35 6.34 Favored 'Trans proline' 0 N--CA 1.492 1.402 0 C-N-CA 122.359 2.039 . . . . 0.0 111.471 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.427 ' OD1' ' N ' ' A' ' 54' ' ' ASP . 1.2 m-20 65.89 -126.73 0.29 Allowed 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 -178.508 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.614 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 0.7 OUTLIER -170.43 -37.44 0.0 OUTLIER Pre-proline 0 N--CA 1.488 1.442 0 O-C-N 120.614 -1.304 . . . . 0.0 111.972 -179.904 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.614 ' CD ' ' H ' ' A' ' 55' ' ' SER . 86.8 Cg_exo -54.02 48.56 0.03 OUTLIER 'Trans proline' 0 N--CA 1.504 2.118 0 C-N-CA 122.756 2.304 . . . . 0.0 113.606 -179.337 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.608 ' N ' ' O ' ' A' ' 55' ' ' SER . 1.2 mp0 45.58 29.71 0.67 Allowed 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 -179.15 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.447 ' O ' ' N ' ' A' ' 61' ' ' PHE . 7.6 mtm 63.73 -6.59 0.23 Allowed 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -178.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.593 ' H ' ' C ' ' A' ' 57' ' ' GLU . 0.0 OUTLIER -48.37 -39.23 21.57 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 122.065 0.936 . . . . 0.0 108.921 178.929 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.42 -21.32 64.01 Favored 'General case' 0 C--N 1.289 -2.05 0 O-C-N 121.365 -0.834 . . . . 0.0 108.868 -179.318 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.447 ' N ' ' O ' ' A' ' 58' ' ' MET . 3.0 t80 -74.94 -54.35 7.37 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.296 -0.877 . . . . 0.0 109.632 179.031 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.429 ' NH2' ' NE2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -65.4 -33.82 76.85 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.994 -1.066 . . . . 0.0 108.791 179.838 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . 0.427 ' O ' ' N ' ' A' ' 67' ' ' ILE . 1.9 t60 -58.15 -38.91 77.52 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.83 -31.84 82.26 Favored Glycine 0 N--CA 1.483 1.823 0 N-CA-C 108.309 -1.917 . . . . 0.0 108.309 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 -82.39 -39.27 22.94 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.316 -1.108 . . . . 0.0 108.145 178.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -70.45 -47.04 62.58 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 178.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.427 ' N ' ' O ' ' A' ' 63' ' ' HIS . 4.7 mm -55.38 -42.57 67.77 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.357 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 178.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 11.7 tp -57.39 -46.23 83.67 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 179.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.42 ' O ' ' CB ' ' A' ' 73' ' ' ASP . 37.7 t -59.99 -12.91 4.59 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.472 0 O-C-N 121.098 -1.001 . . . . 0.0 108.659 179.176 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -77.4 -44.03 14.26 Favored Glycine 0 N--CA 1.487 2.067 0 C-N-CA 119.812 -1.185 . . . . 0.0 110.597 -179.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.448 ' C ' ' CD ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -76.48 -37.81 56.26 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.889 -1.359 . . . . 0.0 107.555 179.528 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 51.9 mt -68.05 -29.48 44.83 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 N-CA-C 107.015 -1.476 . . . . 0.0 107.015 177.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.664 ' CB ' HH21 ' A' ' 34' ' ' ARG . 0.0 OUTLIER -63.17 -51.65 65.56 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.441 -0.787 . . . . 0.0 109.527 179.777 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -64.18 -32.01 73.43 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.106 -0.996 . . . . 0.0 109.787 -179.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.1 -37.76 64.05 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 120.741 -1.224 . . . . 0.0 108.814 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.95 -27.98 47.77 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 178.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.2 tptt -69.66 -47.23 64.05 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-O 121.667 0.746 . . . . 0.0 109.198 178.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.1 mp -58.69 -32.03 68.77 Favored 'General case' 0 C--N 1.306 -1.294 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.46 -52.83 50.24 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.462 HD21 ' HG2' ' A' ' 27' ' ' LYS . 2.0 t-20 . . . . . 0 N--CA 1.488 1.426 0 O-C-N 121.54 -0.725 . . . . 0.0 . -178.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.214 -0.78 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 98.27 15.22 36.18 Favored Glycine 0 N--CA 1.499 2.896 0 O-C-N 121.189 -0.944 . . . . 0.0 110.796 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 33.9 mmtt -98.57 84.21 3.13 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.071 -1.252 . . . . 0.0 108.675 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 53.6 t -75.33 -63.9 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 -179.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.425 ' HD3' ' H ' ' A' ' 85' ' ' LYS . 0.8 OUTLIER -47.88 -37.31 13.81 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.499 -0.75 . . . . 0.0 109.065 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -68.37 -44.18 75.75 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 178.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.52 -47.01 68.08 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.948 0.88 . . . . 0.0 109.046 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.26 -54.14 48.9 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -56.19 -41.58 75.75 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.069 -1.02 . . . . 0.0 108.906 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.576 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -61.25 -35.85 78.37 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 178.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -47.53 -43.69 25.1 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.059 -1.026 . . . . 0.0 108.717 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -63.1 -26.82 69.0 Favored 'General case' 0 N--CA 1.485 1.313 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 178.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.654 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -72.48 -38.99 68.05 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 106.492 -1.67 . . . . 0.0 106.492 177.615 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 11.1 mp -65.74 -40.48 92.16 Favored 'General case' 0 C--N 1.307 -1.264 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 3.9 mtpt -55.06 -38.24 67.77 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 178.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 6.8 m -69.3 -30.74 68.88 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.477 -0.765 . . . . 0.0 108.945 178.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -60.96 -41.92 97.29 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 18.8 mt -51.6 -38.97 22.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -51.2 61.69 Favored 'General case' 0 C--N 1.302 -1.489 0 C-N-CA 119.152 -1.019 . . . . 0.0 109.057 179.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.35 -21.71 66.71 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.034 -1.042 . . . . 0.0 109.067 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.539 ' OH ' ' CE1' ' A' ' 105' ' ' TYR . 10.5 t80 -72.92 -32.89 65.61 Favored 'General case' 0 C--N 1.298 -1.674 0 N-CA-C 107.327 -1.361 . . . . 0.0 107.327 179.168 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.533 ' ND2' ' O ' ' A' ' 102' ' ' ASN . 0.3 OUTLIER -64.1 -30.48 71.55 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 178.327 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.633 ' NE2' ' N ' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -65.43 -27.21 68.37 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 104.95 -2.241 . . . . 0.0 104.95 177.931 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.633 ' N ' ' NE2' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -79.34 -47.25 16.12 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 105.414 -2.069 . . . . 0.0 105.414 176.489 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.539 ' CE1' ' OH ' ' A' ' 101' ' ' TYR . 0.6 OUTLIER -86.2 30.86 0.66 Allowed 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 177.191 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.495 2.578 0 CA-C-O 117.964 -1.465 . . . . 0.0 109.517 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.489 0.662 . . . . 0.0 109.673 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 25.5 mt -88.5 -49.53 6.85 Favored 'General case' 0 C--N 1.296 -1.724 0 O-C-N 121.489 -0.757 . . . . 0.0 109.085 -179.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -62.83 -23.48 67.3 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 106.56 -1.644 . . . . 0.0 106.56 178.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.73 -53.22 9.64 Favored 'General case' 0 C--N 1.299 -1.622 0 C-N-CA 119.778 -0.769 . . . . 0.0 109.295 -179.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.586 HD21 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -53.71 -44.15 69.6 Favored 'General case' 0 N--CA 1.485 1.324 0 O-C-N 121.243 -0.911 . . . . 0.0 108.673 -179.306 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.586 ' N ' HD21 ' A' ' 6' ' ' ASN . 7.6 m95 -50.06 -54.43 20.35 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.103 -0.998 . . . . 0.0 109.241 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -53.7 -25.57 18.95 Favored 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.237 -0.914 . . . . 0.0 109.308 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.2 m -68.37 -65.06 0.75 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.073 -1.017 . . . . 0.0 110.059 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.42 ' CD2' ' H ' ' A' ' 10' ' ' LEU . 0.1 OUTLIER -60.27 -31.25 70.05 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 118.436 -1.305 . . . . 0.0 107.546 179.763 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -69.29 -55.19 11.21 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.982 -1.074 . . . . 0.0 108.487 178.636 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.428 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 42.7 t0 -61.01 -14.81 25.68 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.457 -0.777 . . . . 0.0 110.092 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -72.85 -47.62 44.61 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 178.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.416 HD11 ' HZ3' ' A' ' 95' ' ' LYS . 3.8 mt -57.07 -33.19 67.01 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.738 -178.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 6.4 ttpp -68.32 -42.86 78.74 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 118.862 -1.135 . . . . 0.0 108.563 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.556 ' O ' ' N ' ' A' ' 20' ' ' ALA . 57.3 t -57.87 -24.47 23.27 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 O-C-N 121.304 -0.873 . . . . 0.0 109.379 -179.502 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.489 ' O ' ' N ' ' A' ' 20' ' ' ALA . 12.1 mt -71.31 -72.99 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 121.165 -0.96 . . . . 0.0 110.318 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -46.72 -27.63 1.25 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.941 -1.099 . . . . 0.0 108.985 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -102.52 0.97 34.4 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 179.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.569 ' C ' ' H ' ' A' ' 22' ' ' ASN . . . -58.23 -39.36 78.86 Favored 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 178.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.5 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 9.3 m-20 59.13 -11.0 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.059 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.62 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -147.86 143.28 27.32 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.549 -1.345 . . . . 0.0 110.11 178.949 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.51 -20.58 32.35 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.779 -0.576 . . . . 0.0 111.488 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.08 -50.55 61.32 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.718 -1.239 . . . . 0.0 109.72 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.426 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 4.2 mt-30 -70.22 -19.46 63.15 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.336 -0.853 . . . . 0.0 110.597 -179.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 48.7 t -70.26 -47.27 67.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 120.883 -1.136 . . . . 0.0 108.606 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.474 ' O ' ' OG1' ' A' ' 31' ' ' THR . 8.2 mtpt -55.5 -55.66 29.3 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 106.407 -1.701 . . . . 0.0 106.407 178.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -52.99 -34.08 54.51 Favored 'General case' 0 C--N 1.298 -1.664 0 CA-C-N 114.447 -1.251 . . . . 0.0 109.758 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.61 -65.83 0.65 Allowed 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.26 -0.9 . . . . 0.0 109.54 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 53.9 mt -61.9 -18.65 60.96 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.318 -0.864 . . . . 0.0 109.972 -179.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.474 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 42.8 m -62.65 -51.31 67.74 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.055 -1.028 . . . . 0.0 109.259 179.453 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -69.74 -24.73 63.58 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.663 -0.648 . . . . 0.0 109.307 -179.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 69.1 mtp -66.43 -61.82 1.79 Allowed 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 178.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -47.67 -27.94 2.16 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.86 -66.18 0.82 Allowed 'General case' 0 N--CA 1.488 1.452 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.93 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.71 -30.33 71.34 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.898 -1.126 . . . . 0.0 110.033 -179.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.45 -43.19 93.22 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.052 -1.03 . . . . 0.0 108.502 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 28.3 mt -66.33 -22.12 66.27 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.321 -0.862 . . . . 0.0 108.758 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -83.47 -45.09 14.02 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.216 -0.927 . . . . 0.0 109.739 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.405 ' O ' ' CB ' ' A' ' 43' ' ' ALA . . . -55.2 -22.54 18.02 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.154 -0.966 . . . . 0.0 108.987 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.428 ' C ' ' H ' ' A' ' 43' ' ' ALA . 1.7 tm0? -48.28 -51.34 26.24 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.312 -0.868 . . . . 0.0 109.937 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.418 ' HD3' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -68.89 4.0 1.71 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.166 -0.959 . . . . 0.0 109.628 -179.575 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.428 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -82.43 149.42 27.64 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.013 -1.054 . . . . 0.0 110.234 -179.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 p -151.34 69.61 8.16 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.358 -0.839 . . . . 0.0 108.778 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.444 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 50.1 Cg_exo -45.77 -38.99 18.25 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 C-N-CA 122.647 2.232 . . . . 0.0 114.272 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.444 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 88.6 Cg_endo -98.68 -94.33 0.0 OUTLIER 'Trans proline' 0 C--N 1.318 -1.047 0 C-N-CA 122.447 2.098 . . . . 0.0 112.732 -178.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.57 117.26 0.42 Allowed 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 -179.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.1 tt -81.77 0.91 37.0 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 120.953 -1.092 . . . . 0.0 108.721 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 66.5 mt-10 -99.07 30.59 3.36 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 177.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -147.65 -53.72 0.21 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.65 -0.656 . . . . 0.0 110.496 -178.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -65.23 -161.03 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.071 -1.018 . . . . 0.0 109.388 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 28.1 t -73.95 120.99 84.08 Favored Pre-proline 0 N--CA 1.488 1.457 0 O-C-N 120.804 -1.185 . . . . 0.0 109.352 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -83.32 -22.92 3.72 Favored 'Trans proline' 0 N--CA 1.494 1.507 0 C-N-CA 122.201 1.934 . . . . 0.0 111.899 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.8 t0 64.63 -137.72 0.26 Allowed 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.602 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 0.2 OUTLIER -161.83 -38.92 0.0 OUTLIER Pre-proline 0 N--CA 1.495 1.806 0 O-C-N 120.339 -1.476 . . . . 0.0 112.158 -179.383 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.602 ' CD ' ' H ' ' A' ' 55' ' ' SER . 67.0 Cg_exo -49.21 70.32 0.01 OUTLIER 'Trans proline' 0 N--CA 1.503 2.085 0 C-N-CA 122.7 2.267 . . . . 0.0 114.374 -178.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.59 ' C ' ' H ' ' A' ' 59' ' ' LYS . 91.4 mt-10 39.47 32.22 0.08 Allowed 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.678 -0.639 . . . . 0.0 109.308 179.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.47 ' SD ' ' C ' ' A' ' 57' ' ' GLU . 0.9 OUTLIER 64.73 -8.7 0.21 Allowed 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 -178.46 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.59 ' H ' ' C ' ' A' ' 57' ' ' GLU . 0.6 OUTLIER -48.26 -45.56 34.65 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-O 121.916 0.865 . . . . 0.0 108.93 178.962 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.12 -28.9 27.93 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -179.457 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -74.3 -54.37 7.8 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 177.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.38 -29.06 68.69 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.494 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . 0.466 ' N ' ' O ' ' A' ' 59' ' ' LYS . 2.1 t60 -62.68 -36.75 83.93 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 178.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -63.8 -28.23 72.34 Favored Glycine 0 N--CA 1.487 2.085 0 N-CA-C 107.794 -2.122 . . . . 0.0 107.794 178.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 26.8 m-85 -81.86 -41.03 21.58 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 177.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -73.14 -45.99 53.55 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.445 ' N ' ' O ' ' A' ' 63' ' ' HIS . 19.7 mm -56.69 -48.57 80.59 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.414 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.446 ' CD1' ' C ' ' A' ' 68' ' ' LEU . 2.3 tm? -58.01 -45.04 87.52 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 179.419 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 26.3 t -60.94 -11.4 4.15 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 179.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -76.16 -42.05 25.03 Favored Glycine 0 N--CA 1.487 2.065 0 N-CA-C 109.347 -1.501 . . . . 0.0 109.347 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.504 ' O ' ' NE2' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -67.61 -29.69 69.09 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 178.63 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 46.8 mt -75.91 -32.9 24.28 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.454 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 176.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -59.35 -54.39 47.3 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 121.593 0.711 . . . . 0.0 109.423 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -63.97 -28.81 70.07 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.292 -0.88 . . . . 0.0 109.29 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.65 -32.97 66.27 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 120.807 -1.183 . . . . 0.0 108.355 179.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.77 -32.95 63.9 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 178.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.9 tptt -66.39 -45.51 79.76 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 mp -58.3 -31.72 67.78 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.91 -51.33 62.48 Favored 'General case' 0 C--N 1.3 -1.545 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 177.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.437 HD21 ' HG2' ' A' ' 27' ' ' LYS . 1.9 t-20 -73.33 -11.95 60.67 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.475 -0.766 . . . . 0.0 111.16 -179.055 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -93.79 -11.04 32.18 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 120.719 -1.238 . . . . 0.0 109.556 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.93 11.3 53.55 Favored Glycine 0 N--CA 1.498 2.769 0 N-CA-C 110.654 -0.978 . . . . 0.0 110.654 179.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 39.7 mmtt -94.65 82.13 3.92 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.952 -1.322 . . . . 0.0 108.842 179.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 43.5 t -77.38 -51.22 18.84 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.676 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 -179.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.0 mtmp? -54.15 -39.61 66.67 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.065 -1.022 . . . . 0.0 108.542 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -69.75 -40.97 75.82 Favored 'General case' 0 N--CA 1.486 1.33 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 178.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.66 -51.32 57.48 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 119.528 -0.869 . . . . 0.0 109.114 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.446 ' O ' ' CB ' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -60.08 -46.37 89.81 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 179.383 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -55.11 -34.29 63.57 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 120.957 -1.089 . . . . 0.0 108.109 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.402 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -65.97 -28.71 69.1 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 107.216 -1.402 . . . . 0.0 107.216 178.118 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.446 ' CB ' ' O ' ' A' ' 88' ' ' GLN . . . -50.52 -48.67 57.0 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 178.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.492 ' OE1' ' N ' ' A' ' 92' ' ' GLU . 14.1 mp0 -67.15 -22.1 65.79 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.292 -0.88 . . . . 0.0 109.34 178.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.66 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -71.04 -35.27 71.91 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 105.508 -2.034 . . . . 0.0 105.508 177.164 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.467 ' O ' ' N ' ' A' ' 97' ' ' THR . 7.2 mp -70.94 -39.92 72.35 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 178.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' LYS . . . . . 0.434 ' C ' ' O ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -45.54 -40.45 8.67 Favored 'General case' 0 N--CA 1.498 1.973 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 178.766 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 53.4 m -72.72 -31.32 64.89 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.707 -0.621 . . . . 0.0 109.987 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.467 ' N ' ' O ' ' A' ' 94' ' ' LEU . 1.2 m -56.85 -43.63 81.36 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 49.8 mt -54.79 -46.36 74.68 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.498 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 51.7 ttt180 -62.28 -55.0 32.65 Favored 'General case' 0 C--N 1.308 -1.21 0 O-C-N 121.184 -0.947 . . . . 0.0 110.229 -179.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.54 -28.08 69.07 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.79 -1.194 . . . . 0.0 108.698 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.458 ' CD1' ' C ' ' A' ' 101' ' ' TYR . 3.4 t80 -70.86 -30.49 66.9 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 178.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.54 ' ND2' ' O ' ' A' ' 102' ' ' ASN . 0.1 OUTLIER -64.34 -32.0 73.43 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 119.013 -1.075 . . . . 0.0 108.536 179.416 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.511 ' NE2' ' N ' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -63.99 -26.0 68.38 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 105.105 -2.183 . . . . 0.0 105.105 177.854 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.511 ' N ' ' NE2' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -84.0 -32.46 24.94 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.123 -0.944 . . . . 0.0 108.663 178.012 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.54 ' CD1' ' C ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -95.11 0.82 54.66 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.108 -0.995 . . . . 0.0 109.173 -179.266 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . 0.51 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.494 2.509 0 CA-C-O 117.927 -1.485 . . . . 0.0 109.742 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 . . . . . 0 N--CA 1.489 1.52 0 CA-C-O 121.743 0.782 . . . . 0.0 109.177 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 70.2 mt -87.57 -52.5 5.31 Favored 'General case' 0 C--N 1.296 -1.743 0 O-C-N 121.656 -0.653 . . . . 0.0 109.392 -178.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -62.98 -23.72 67.57 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 179.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.52 -51.87 18.11 Favored 'General case' 0 C--N 1.297 -1.709 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.529 HD21 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -50.61 -40.9 54.08 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 -179.872 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.529 ' N ' HD21 ' A' ' 6' ' ' ASN . 7.0 m95 -51.94 -52.46 50.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.198 -0.939 . . . . 0.0 108.865 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -55.98 -28.58 57.73 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 120.719 -1.238 . . . . 0.0 108.919 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 10.4 m -69.52 -64.67 0.83 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.168 -0.958 . . . . 0.0 109.986 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.6 pp -57.02 -30.8 64.51 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.65 -1.282 . . . . 0.0 107.922 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.28 -55.32 8.28 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.912 -1.118 . . . . 0.0 108.349 178.144 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -58.57 -14.15 7.43 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.501 -0.749 . . . . 0.0 109.551 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -73.12 -50.11 24.62 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 179.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.3 mt -56.86 -30.01 63.43 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.829 -0.544 . . . . 0.0 111.087 -178.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -69.11 -51.39 39.05 Favored 'General case' 0 C--N 1.3 -1.581 0 C-N-CA 118.539 -1.264 . . . . 0.0 109.727 -179.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.624 ' O ' ' N ' ' A' ' 20' ' ' ALA . 15.4 m -55.74 -20.92 9.22 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 C-N-CA 118.458 -1.297 . . . . 0.0 110.105 -179.35 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.445 ' O ' ' N ' ' A' ' 20' ' ' ALA . 11.5 mt -70.16 -73.51 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 O-C-N 120.442 -1.412 . . . . 0.0 108.947 179.085 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -46.94 -28.66 1.69 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.311 -0.868 . . . . 0.0 109.007 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.37 1.46 35.5 Favored 'General case' 0 N--CA 1.496 1.867 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.624 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -56.9 -44.11 82.02 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 107.453 -1.314 . . . . 0.0 107.453 179.473 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.48 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 0.4 OUTLIER 67.76 -15.02 0.2 Allowed 'General case' 0 C--N 1.297 -1.678 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.949 179.437 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.647 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -148.21 142.79 26.51 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.653 -1.279 . . . . 0.0 110.051 178.576 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.86 -21.22 10.71 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.987 -0.446 . . . . 0.0 111.463 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.34 -52.13 55.94 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.857 -1.152 . . . . 0.0 109.601 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.501 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 5.4 mt-30 -69.76 -18.31 63.49 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.281 -0.887 . . . . 0.0 110.425 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.6 t -70.02 -48.95 59.87 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 O-C-N 120.925 -1.109 . . . . 0.0 108.388 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.473 ' O ' ' OG1' ' A' ' 31' ' ' THR . 7.0 mtpt -56.27 -55.12 37.27 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 178.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -50.78 -37.46 42.5 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-N 114.711 -1.132 . . . . 0.0 109.45 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.73 -68.71 0.39 Allowed 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.335 -0.853 . . . . 0.0 110.042 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 95.9 mt -60.28 -20.87 60.87 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.379 -0.826 . . . . 0.0 109.696 -179.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.473 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 7.8 m -62.42 -45.64 92.2 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.096 -1.002 . . . . 0.0 108.523 179.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 40.9 mtmt -72.81 -27.16 61.8 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.764 -0.585 . . . . 0.0 109.475 -179.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 29.5 mtp -63.98 -67.93 0.39 Allowed 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 178.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 15.8 ttt-85 -47.11 -26.4 1.09 Allowed 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.67 -57.9 3.61 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 120.009 -0.676 . . . . 0.0 109.344 178.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.25 -39.93 95.99 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.111 -0.993 . . . . 0.0 110.078 -179.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.92 -39.02 71.04 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.019 -1.051 . . . . 0.0 108.891 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 26.5 mt -66.01 -33.78 76.58 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.23 -0.919 . . . . 0.0 108.937 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -86.33 -41.94 14.12 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.096 -1.003 . . . . 0.0 109.549 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.424 ' O ' ' CB ' ' A' ' 43' ' ' ALA . . . -58.84 -14.53 9.16 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.318 -0.864 . . . . 0.0 109.761 -179.674 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.487 ' C ' ' H ' ' A' ' 43' ' ' ALA . 2.2 tm0? -48.49 -51.57 26.57 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 120.963 -1.086 . . . . 0.0 109.692 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 2.1 mppt? -71.0 14.24 0.16 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.345 -0.847 . . . . 0.0 109.706 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.487 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -78.04 151.27 33.58 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.887 -1.133 . . . . 0.0 108.719 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -152.31 69.18 7.38 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.171 -0.956 . . . . 0.0 109.564 -179.392 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.442 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 33.3 Cg_exo -49.31 -40.05 43.54 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.586 2.191 . . . . 0.0 113.878 178.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.442 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 69.7 Cg_endo -95.98 -14.58 0.51 Allowed 'Trans proline' 0 N--CA 1.483 0.862 0 C-N-CA 122.467 2.111 . . . . 0.0 112.635 -178.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 43.3 mttm 71.83 101.69 0.07 Allowed 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.8 mp -84.33 22.98 1.15 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.122 -0.986 . . . . 0.0 108.791 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -107.04 26.41 10.17 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 107.416 -1.327 . . . . 0.0 107.416 178.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -144.26 -59.5 0.38 Allowed 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 -179.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -65.99 -162.96 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.585 0 O-C-N 121.325 -0.859 . . . . 0.0 108.888 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.3 t -75.11 145.12 80.14 Favored Pre-proline 0 N--CA 1.485 1.313 0 O-C-N 120.722 -1.236 . . . . 0.0 109.029 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.448 ' O ' ' CB ' ' A' ' 54' ' ' ASP . 43.4 Cg_endo -80.78 -14.57 11.19 Favored 'Trans proline' 0 N--CA 1.499 1.835 0 C-N-CA 122.719 2.28 . . . . 0.0 112.309 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.448 ' CB ' ' O ' ' A' ' 53' ' ' PRO . 10.3 t0 76.27 -143.99 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.73 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 40.4 t -162.36 -26.62 0.0 OUTLIER Pre-proline 0 N--CA 1.495 1.817 0 O-C-N 120.379 -1.451 . . . . 0.0 113.801 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.73 ' CD ' ' H ' ' A' ' 55' ' ' SER . 73.2 Cg_exo -56.43 40.91 0.04 OUTLIER 'Trans proline' 0 N--CA 1.503 2.043 0 C-N-CA 121.981 1.788 . . . . 0.0 113.021 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.578 ' N ' ' O ' ' A' ' 55' ' ' SER . 7.1 tp10 49.87 25.56 1.64 Allowed 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 -178.655 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.51 ' O ' ' N ' ' A' ' 61' ' ' PHE . 2.1 mtp 63.95 -5.08 0.32 Allowed 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 -177.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.571 ' H ' ' C ' ' A' ' 57' ' ' GLU . 0.5 OUTLIER -46.59 -50.37 17.52 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.346 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -54.03 -24.91 18.77 Favored 'General case' 0 C--N 1.297 -1.693 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.51 ' N ' ' O ' ' A' ' 58' ' ' MET . 3.8 t80 -77.25 -54.18 6.8 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 107.134 -1.432 . . . . 0.0 107.134 177.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.8 mtt-85 -62.54 -31.02 71.74 Favored 'General case' 0 N--CA 1.489 1.512 0 CA-C-O 121.328 0.585 . . . . 0.0 109.474 178.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . 0.448 ' O ' ' N ' ' A' ' 67' ' ' ILE . 1.6 t60 -59.6 -40.89 88.99 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.67 -31.32 80.51 Favored Glycine 0 C--N 1.296 -1.649 0 N-CA-C 108.702 -1.759 . . . . 0.0 108.702 179.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -81.07 -41.46 22.55 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.055 -1.262 . . . . 0.0 108.062 178.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -71.26 -46.19 61.51 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.448 ' N ' ' O ' ' A' ' 63' ' ' HIS . 5.3 mm -55.78 -44.72 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 179.28 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 5.4 tp -58.04 -52.94 63.44 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.598 -0.689 . . . . 0.0 109.756 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 46.0 t -61.08 -15.76 12.9 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 O-C-N 121.281 -0.887 . . . . 0.0 110.692 -178.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -78.19 -43.79 12.72 Favored Glycine 0 N--CA 1.49 2.236 0 C-N-CA 119.25 -1.453 . . . . 0.0 110.382 -178.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.535 ' O ' ' NE2' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -70.77 -30.8 67.38 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 120.681 -1.482 . . . . 0.0 107.429 179.47 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 27.9 mt -75.42 -30.11 21.94 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.558 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -59.87 -53.18 60.95 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 119.47 -0.892 . . . . 0.0 109.03 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.445 ' OD1' ' O ' ' A' ' 71' ' ' GLN . 0.4 OUTLIER -66.31 -32.53 73.99 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.071 -1.018 . . . . 0.0 109.297 179.909 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.44 -27.12 64.0 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 120.709 -1.245 . . . . 0.0 107.916 179.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.95 -34.15 67.75 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 105.797 -1.927 . . . . 0.0 105.797 177.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 9.2 tptt -69.73 -49.04 57.0 Favored 'General case' 0 C--N 1.305 -1.333 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.596 179.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 8.5 mp -55.1 -37.18 66.52 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.55 -50.29 71.9 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.313 -0.867 . . . . 0.0 108.902 178.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.441 HD21 ' HG2' ' A' ' 27' ' ' LYS . 1.9 t-20 -73.23 -12.37 60.84 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.504 -0.747 . . . . 0.0 111.389 -178.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -94.16 -9.57 35.96 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 120.672 -1.268 . . . . 0.0 109.58 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.67 11.29 54.0 Favored Glycine 0 N--CA 1.497 2.751 0 O-C-N 121.131 -0.981 . . . . 0.0 110.662 178.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 5.7 mmtp -94.21 83.26 4.22 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.921 -1.341 . . . . 0.0 108.464 179.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 57.9 t -77.55 -54.0 13.46 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.773 0 O-C-N 121.786 -0.571 . . . . 0.0 109.653 -179.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -53.42 -39.7 64.56 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 120.954 -1.092 . . . . 0.0 108.604 179.329 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -67.25 -42.33 84.13 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 178.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.05 -51.87 49.23 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 119.564 -0.854 . . . . 0.0 109.1 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -59.95 -48.29 82.32 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 179.585 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -55.87 -33.42 64.56 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -67.04 -27.58 67.51 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 178.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.41 ' N ' ' O ' ' A' ' 88' ' ' GLN . . . -53.06 -50.78 63.64 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 179.059 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -63.42 -24.65 67.93 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 178.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.639 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -75.23 -36.16 61.35 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 177.859 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.431 ' CD1' ' OE1' ' A' ' 71' ' ' GLN . 4.1 mp -64.78 -49.15 71.86 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 178.646 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -50.32 -42.92 53.49 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 24.4 m -71.32 -35.27 71.17 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.165 -0.96 . . . . 0.0 109.125 179.005 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.2 m -60.79 -44.89 96.24 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 179.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 86.2 mt -51.26 -37.89 18.77 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.374 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.2 tpm_? -56.27 -54.49 44.69 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-O 121.907 0.86 . . . . 0.0 109.571 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.491 ' O ' ' N ' ' A' ' 103' ' ' GLN . . . -63.37 -53.89 45.43 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 120.434 -1.416 . . . . 0.0 108.184 179.222 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.491 ' O ' ' CG ' ' A' ' 104' ' ' LYS . 0.6 OUTLIER -53.33 -21.75 6.16 Favored 'General case' 0 C--N 1.297 -1.688 0 O-C-N 120.697 -1.252 . . . . 0.0 107.724 179.366 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.543 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -65.85 -28.25 68.83 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 176.917 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.491 ' N ' ' O ' ' A' ' 100' ' ' ALA . 1.4 pp0? -61.83 -18.93 61.84 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 105.358 -2.09 . . . . 0.0 105.358 178.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.491 ' CG ' ' O ' ' A' ' 101' ' ' TYR . 0.0 OUTLIER -79.63 -28.12 40.93 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 177.476 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.485 ' O ' ' CG ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -101.96 3.5 39.04 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 107.756 -1.201 . . . . 0.0 107.756 178.544 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . 0.488 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.491 2.351 0 N-CA-C 109.312 -1.515 . . . . 0.0 109.312 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 . . . . . 0 N--CA 1.492 1.673 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 48.9 mt -89.57 -49.12 6.85 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -62.64 -22.29 66.33 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 178.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -72.99 -49.54 28.4 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.618 HD21 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -50.13 -44.17 52.2 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.207 -0.933 . . . . 0.0 108.683 -179.73 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.618 ' N ' HD21 ' A' ' 6' ' ' ASN . 16.2 m95 -54.7 -49.21 71.27 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.187 -0.946 . . . . 0.0 109.367 -179.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -55.41 -29.49 58.65 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 120.875 -1.14 . . . . 0.0 109.083 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 35.4 m -69.39 -65.46 0.71 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 119.289 -0.965 . . . . 0.0 109.789 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.1 pp -58.55 -28.86 65.88 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.776 -1.202 . . . . 0.0 108.566 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -71.74 -59.7 2.61 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.932 -1.105 . . . . 0.0 109.268 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -57.25 -13.77 3.58 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.45 -0.781 . . . . 0.0 109.378 -179.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -74.25 -54.27 8.04 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 13.4 mt -55.53 -27.55 49.48 Favored 'General case' 0 N--CA 1.49 1.548 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.574 -178.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 9.0 ttpp -70.16 -46.64 64.24 Favored 'General case' 0 C--N 1.298 -1.672 0 C-N-CA 118.919 -1.112 . . . . 0.0 108.569 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.523 ' O ' ' N ' ' A' ' 20' ' ' ALA . 71.9 t -55.84 -26.69 21.06 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.579 0 O-C-N 121.415 -0.803 . . . . 0.0 109.944 -179.301 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.526 ' O ' ' N ' ' A' ' 20' ' ' ALA . 7.1 mt -71.23 -71.25 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 O-C-N 121.053 -1.03 . . . . 0.0 110.468 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -46.75 -28.78 1.63 Allowed 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.931 -1.106 . . . . 0.0 108.789 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.43 ' O ' ' OD2' ' A' ' 21' ' ' ASP . 1.0 OUTLIER -99.96 -1.47 37.07 Favored 'General case' 0 N--CA 1.498 1.928 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 179.522 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.57 ' O ' ' NE2' ' A' ' 25' ' ' GLN . . . -58.26 -59.93 4.55 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.893 -1.129 . . . . 0.0 108.299 178.713 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.43 ' OD2' ' O ' ' A' ' 19' ' ' LYS . 1.4 m-20 69.55 -7.62 0.85 Allowed 'General case' 0 C--N 1.295 -1.765 0 O-C-N 121.75 -0.594 . . . . 0.0 110.566 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.57 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -142.96 143.05 31.8 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 120.724 -1.235 . . . . 0.0 109.569 178.048 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.94 -27.78 46.08 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.714 -0.616 . . . . 0.0 111.101 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.2 -51.61 62.9 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.029 -1.044 . . . . 0.0 110.887 -178.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.57 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 9.4 mt-30 -68.37 -24.07 64.75 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 120.955 -1.091 . . . . 0.0 110.884 -178.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 49.1 t -70.78 -47.74 61.58 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.036 0 O-C-N 120.693 -1.254 . . . . 0.0 108.99 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.47 ' O ' ' OG1' ' A' ' 31' ' ' THR . 12.7 mtpt -54.91 -55.11 34.11 Favored 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 106.376 -1.712 . . . . 0.0 106.376 179.048 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.474 ' N ' ' OD1' ' A' ' 28' ' ' ASP . 2.6 m-20 -52.14 -37.99 56.13 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-N 114.33 -1.305 . . . . 0.0 109.574 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.81 -64.09 0.95 Allowed 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.357 -0.839 . . . . 0.0 110.333 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 90.0 mt -60.15 -23.37 63.87 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.165 -0.959 . . . . 0.0 109.955 -179.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.47 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 48.1 m -61.86 -46.11 90.87 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.036 -1.04 . . . . 0.0 108.93 179.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 50.5 mttm -72.26 -28.71 63.3 Favored 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.809 -0.557 . . . . 0.0 109.623 -179.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' MET . . . . . 0.416 ' C ' ' N ' ' A' ' 35' ' ' ALA . 48.6 mtp -65.36 -63.46 1.09 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.808 -1.183 . . . . 0.0 108.557 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.8 ttt-85 -50.06 -22.92 1.8 Allowed 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.416 ' N ' ' C ' ' A' ' 33' ' ' MET . . . -75.11 -58.7 3.12 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.643 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.414 ' O ' ' N ' ' A' ' 40' ' ' ALA . . . -62.89 -31.0 71.96 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.169 -0.957 . . . . 0.0 109.64 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.83 -44.12 90.85 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.165 -0.959 . . . . 0.0 108.82 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 17.2 mt -64.79 -32.24 73.83 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.366 -0.834 . . . . 0.0 109.227 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -84.69 -23.87 29.21 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.125 -0.984 . . . . 0.0 109.138 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.507 ' O ' ' N ' ' A' ' 43' ' ' ALA . . . -61.8 -34.01 75.14 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.428 -0.795 . . . . 0.0 110.348 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.533 ' C ' ' H ' ' A' ' 43' ' ' ALA . 0.8 OUTLIER -40.33 -63.06 0.67 Allowed 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.33 -0.856 . . . . 0.0 110.077 -179.885 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 67.7 mmtt -57.62 1.05 0.04 OUTLIER 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.523 -0.736 . . . . 0.0 110.459 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.533 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -84.12 145.57 28.35 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.817 -1.177 . . . . 0.0 110.842 -179.151 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 m -159.37 90.22 1.96 Allowed Pre-proline 0 N--CA 1.49 1.544 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.417 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 23.3 Cg_exo -53.57 -43.68 55.63 Favored 'Trans proline' 0 N--CA 1.49 1.297 0 C-N-CA 121.601 1.534 . . . . 0.0 112.367 -179.105 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.417 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 96.6 Cg_endo -84.96 -90.6 0.0 OUTLIER 'Trans proline' 0 C--N 1.317 -1.087 0 C-N-CA 121.372 1.382 . . . . 0.0 110.574 178.424 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.404 ' H ' ' HG2' ' A' ' 46' ' ' PRO . 2.7 pttt -176.6 122.23 0.15 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.076 -1.015 . . . . 0.0 109.829 179.276 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.452 ' C ' ' N ' ' A' ' 50' ' ' ASP . 0.7 OUTLIER -80.34 -174.71 4.73 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 178.575 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 50.74 18.83 0.53 Allowed 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.007 -1.058 . . . . 0.0 108.165 -179.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.452 ' N ' ' C ' ' A' ' 48' ' ' LEU . 33.4 m-20 -148.61 -55.0 0.19 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.733 -0.604 . . . . 0.0 110.054 -179.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.7 ptpp? -65.69 -162.59 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.537 0 O-C-N 120.974 -1.079 . . . . 0.0 109.289 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 3.7 m -79.36 115.82 55.93 Favored Pre-proline 0 N--CA 1.487 1.415 0 O-C-N 121.095 -1.003 . . . . 0.0 109.0 179.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.441 ' O ' ' CB ' ' A' ' 54' ' ' ASP . 31.1 Cg_endo -86.72 -17.22 3.38 Favored 'Trans proline' 0 N--CA 1.493 1.496 0 C-N-CA 122.356 2.038 . . . . 0.0 111.441 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.441 ' CB ' ' O ' ' A' ' 53' ' ' PRO . 6.2 t0 75.4 164.22 0.26 Allowed 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.264 -1.014 . . . . 0.0 108.264 -178.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.675 ' O ' ' N ' ' A' ' 57' ' ' GLU . 0.1 OUTLIER -80.28 -47.4 1.33 Allowed Pre-proline 0 N--CA 1.497 1.898 0 O-C-N 120.638 -1.289 . . . . 0.0 112.18 -178.405 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.6 ' O ' ' N ' ' A' ' 59' ' ' LYS . 30.2 Cg_exo -39.98 62.58 0.0 OUTLIER 'Trans proline' 0 N--CA 1.505 2.154 0 C-N-CA 123.523 2.816 . . . . 0.0 115.363 -178.356 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.675 ' N ' ' O ' ' A' ' 55' ' ' SER . 30.3 mt-10 36.63 29.08 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.038 0 CA-C-O 121.437 0.637 . . . . 0.0 109.477 179.273 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.534 ' N ' ' O ' ' A' ' 56' ' ' PRO . 0.1 OUTLIER 65.16 -8.07 0.26 Allowed 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -177.902 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.609 ' H ' ' C ' ' A' ' 57' ' ' GLU . 4.2 tmtm? -50.2 -40.79 48.26 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-O 121.704 0.764 . . . . 0.0 109.015 179.021 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -56.65 -27.31 58.27 Favored 'General case' 0 C--N 1.296 -1.724 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -179.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -73.17 -53.61 10.54 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 177.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -62.85 -32.47 73.71 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.661 179.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -61.7 -38.08 86.54 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.154 -0.966 . . . . 0.0 108.542 179.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.1 -30.67 78.42 Favored Glycine 0 N--CA 1.481 1.675 0 N-CA-C 108.381 -1.888 . . . . 0.0 108.381 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.515 ' CE2' ' NZ ' ' A' ' 104' ' ' LYS . 56.2 m-85 -84.01 -39.51 19.57 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.35 -1.088 . . . . 0.0 108.26 178.292 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -69.34 -46.4 67.14 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 178.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 5.6 mm -56.69 -38.87 59.99 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 179.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.72 -48.17 82.08 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.404 -0.81 . . . . 0.0 109.545 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 53.7 t -60.94 -17.33 15.55 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 O-C-N 121.65 -0.656 . . . . 0.0 109.632 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -78.55 -43.61 12.01 Favored Glycine 0 N--CA 1.487 2.087 0 C-N-CA 119.609 -1.281 . . . . 0.0 110.792 -178.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.462 ' NE2' ' C ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -71.7 -30.74 65.99 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.557 -1.555 . . . . 0.0 107.501 179.713 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 12.0 mt -74.01 -31.35 29.98 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 177.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -62.83 -57.52 10.57 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.252 -0.905 . . . . 0.0 110.099 -179.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -62.69 -29.2 70.47 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.132 -0.98 . . . . 0.0 109.746 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.32 -29.29 61.54 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 120.645 -1.284 . . . . 0.0 108.355 179.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.49 -33.18 65.72 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 106.171 -1.789 . . . . 0.0 106.171 178.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.4 tptt -69.03 -42.37 76.45 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.422 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 8.1 mp -59.51 -37.62 78.79 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.37 -0.831 . . . . 0.0 108.85 -178.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.4 -51.33 66.24 Favored 'General case' 0 C--N 1.298 -1.642 0 O-C-N 121.272 -0.893 . . . . 0.0 109.23 178.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.431 HD21 ' HG2' ' A' ' 27' ' ' LYS . 1.8 t-20 -72.6 -11.07 60.5 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.418 -0.802 . . . . 0.0 111.012 -178.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -95.04 -10.86 29.56 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 120.904 -1.122 . . . . 0.0 109.513 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.83 12.92 48.62 Favored Glycine 0 N--CA 1.496 2.651 0 N-CA-C 110.693 -0.963 . . . . 0.0 110.693 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp -95.22 77.43 3.46 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.971 -1.311 . . . . 0.0 108.43 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 71.2 t -75.63 -52.01 19.3 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.747 0 O-C-N 121.864 -0.523 . . . . 0.0 109.646 -179.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.7 mptt -53.74 -37.15 63.08 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.091 -1.078 . . . . 0.0 108.091 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -70.24 -42.61 72.0 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 178.334 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.65 -53.74 37.24 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 119.627 -0.829 . . . . 0.0 109.18 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.69 -46.03 90.31 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -58.62 -39.22 79.83 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.117 -0.99 . . . . 0.0 108.403 179.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.528 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -64.73 -29.58 70.56 Favored 'General case' 0 N--CA 1.485 1.31 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 178.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -49.17 -47.43 45.85 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.983 -1.073 . . . . 0.0 108.16 178.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -62.37 -27.06 68.81 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 178.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.628 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -72.64 -36.39 67.99 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 177.939 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.0 mp -65.57 -48.24 73.06 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.459 -1.312 . . . . 0.0 107.459 178.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 3.6 mtpt -52.81 -48.37 66.99 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.371 -0.83 . . . . 0.0 109.189 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 45.4 m -69.28 -34.27 74.49 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.163 -0.961 . . . . 0.0 109.674 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.449 ' HG1' ' NE2' ' A' ' 93' ' ' GLN . 3.4 m -58.52 -48.04 82.16 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 4.2 mm -50.32 -33.7 10.67 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.312 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.22 -42.05 76.62 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 179.217 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.41 -28.18 69.07 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.609 -0.682 . . . . 0.0 109.48 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -67.83 -35.66 78.99 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 179.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.544 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -61.6 -32.77 72.9 Favored 'General case' 0 C--N 1.303 -1.451 0 C-N-CA 119.052 -1.059 . . . . 0.0 108.358 179.584 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.552 ' NE2' ' N ' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -64.04 -23.45 67.34 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 105.178 -2.156 . . . . 0.0 105.178 177.846 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.552 ' N ' ' NE2' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -83.86 -33.8 24.76 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 177.577 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.538 ' CD1' ' C ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -89.98 4.77 49.13 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 120.947 -1.096 . . . . 0.0 108.55 179.39 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.395 0 CA-C-O 117.94 -1.478 . . . . 0.0 109.519 179.714 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 121.546 0.689 . . . . 0.0 109.419 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 69.2 mt -88.36 -51.94 5.47 Favored 'General case' 0 C--N 1.295 -1.762 0 O-C-N 121.608 -0.682 . . . . 0.0 109.326 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -64.47 -25.11 67.86 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -73.41 -43.4 60.55 Favored 'General case' 0 C--N 1.296 -1.741 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.565 HD21 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -57.82 -40.61 80.44 Favored 'General case' 0 C--N 1.307 -1.264 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -179.886 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.565 ' N ' HD21 ' A' ' 6' ' ' ASN . 8.2 m95 -52.67 -53.01 53.33 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.165 -0.959 . . . . 0.0 108.702 -179.347 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 51.1 tt0 -59.38 -30.84 68.71 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 120.918 -1.114 . . . . 0.0 108.434 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.3 m -67.98 -54.28 19.77 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 119.451 -0.899 . . . . 0.0 108.79 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.4 mt -58.27 -37.27 74.64 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 178.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -69.34 -60.86 2.06 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.385 -0.822 . . . . 0.0 109.809 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -55.67 -14.72 2.37 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.347 -0.846 . . . . 0.0 109.349 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -74.6 -54.62 7.11 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 107.637 -1.245 . . . . 0.0 107.637 179.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.5 mt -55.92 -22.38 25.62 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.537 -0.727 . . . . 0.0 110.312 -178.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.466 ' NZ ' ' HZ3' ' A' ' 19' ' ' LYS . 11.7 tttp -70.21 -57.61 4.72 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.068 -1.02 . . . . 0.0 109.102 179.531 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.617 ' O ' ' N ' ' A' ' 20' ' ' ALA . 14.9 m -52.68 -22.76 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 C-N-CA 118.864 -1.135 . . . . 0.0 110.316 -178.449 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 9.4 mt -70.2 -74.87 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 120.441 -1.412 . . . . 0.0 109.926 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -47.67 -28.57 2.46 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.143 -0.973 . . . . 0.0 108.724 -179.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.466 ' HZ3' ' NZ ' ' A' ' 15' ' ' LYS . 0.0 OUTLIER -103.13 4.33 36.87 Favored 'General case' 0 N--CA 1.495 1.809 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.836 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.617 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -57.65 -38.45 75.09 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 179.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.529 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 0.6 OUTLIER 63.57 -17.6 0.06 Allowed 'General case' 0 N--CA 1.494 1.753 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.225 179.744 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.63 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -146.6 144.23 29.4 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.749 -1.219 . . . . 0.0 109.787 179.773 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -56.06 -15.75 4.04 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.721 -0.612 . . . . 0.0 110.106 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.51 -55.54 13.13 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.215 -0.928 . . . . 0.0 109.568 -179.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -68.34 -19.04 64.63 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.557 -0.714 . . . . 0.0 110.609 -179.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 47.5 t -70.8 -46.71 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 O-C-N 120.936 -1.102 . . . . 0.0 108.589 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.467 ' O ' ' OG1' ' A' ' 31' ' ' THR . 14.0 mtpt -55.58 -56.74 16.78 Favored 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 178.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -51.8 -34.14 38.64 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-N 114.403 -1.271 . . . . 0.0 109.64 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.84 -69.66 0.33 Allowed 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.289 -0.882 . . . . 0.0 110.32 -179.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 93.0 mt -57.1 -19.99 22.79 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.52 -0.738 . . . . 0.0 109.414 -178.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.467 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 39.4 m -64.17 -40.76 96.81 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 178.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 58.2 mttt -73.94 -32.07 63.33 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 36.8 mtp -66.67 -69.09 0.33 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 120.988 -1.07 . . . . 0.0 108.74 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.3 ttt-85 -45.9 -29.18 1.31 Allowed 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.32 -64.76 0.95 Allowed 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 120.049 -0.66 . . . . 0.0 109.843 179.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.66 -33.17 73.5 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.043 -1.036 . . . . 0.0 109.224 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.25 -38.07 82.36 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 179.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.5 mt -65.68 -26.32 67.73 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 179.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 61.0 t0 -84.66 -37.42 21.05 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.12 -0.987 . . . . 0.0 110.041 -179.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.563 ' O ' ' N ' ' A' ' 42' ' ' LYS . . . -58.46 -69.34 0.19 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.07 -1.019 . . . . 0.0 109.607 -179.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.639 ' C ' ' H ' ' A' ' 43' ' ' ALA . 0.0 OUTLIER 11.78 -78.42 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.606 0 CA-C-O 121.702 0.763 . . . . 0.0 111.354 -179.581 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.563 ' N ' ' O ' ' A' ' 40' ' ' ALA . 44.7 mmtt -56.26 13.0 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.926 -0.483 . . . . 0.0 110.682 179.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.639 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -75.42 148.38 39.18 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.432 -1.418 . . . . 0.0 110.236 -178.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -153.58 76.51 6.11 Favored Pre-proline 0 N--CA 1.492 1.648 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.421 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 46.9 Cg_exo -49.67 -39.79 46.89 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.537 2.158 . . . . 0.0 113.89 179.781 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.421 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 88.6 Cg_endo -93.1 -93.72 0.0 OUTLIER 'Trans proline' 0 C--N 1.32 -0.967 0 C-N-CA 121.848 1.699 . . . . 0.0 111.589 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.444 ' NZ ' ' CB ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -177.78 103.06 0.05 OUTLIER 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.157 -0.965 . . . . 0.0 110.227 179.899 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.414 ' C ' ' N ' ' A' ' 50' ' ' ASP . 0.5 OUTLIER -82.85 -175.05 5.61 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 107.019 -1.474 . . . . 0.0 107.019 178.17 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 51.35 20.38 0.95 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.796 -1.19 . . . . 0.0 108.36 -179.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.414 ' N ' ' C ' ' A' ' 48' ' ' LEU . 7.7 m-20 -143.16 -61.33 0.42 Allowed 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 7.9 ptpp? -66.64 -146.98 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 178.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 25.9 t -77.96 131.92 68.83 Favored Pre-proline 0 C--N 1.307 -1.273 0 O-C-N 120.65 -1.281 . . . . 0.0 108.279 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -80.99 -11.61 12.27 Favored 'Trans proline' 0 N--CA 1.496 1.656 0 C-N-CA 122.354 2.036 . . . . 0.0 111.468 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 69.02 -128.2 0.1 Allowed 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 -178.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.711 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 24.2 t -168.27 -28.45 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.714 0 C-N-CA 118.645 -1.222 . . . . 0.0 113.523 -179.42 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.711 ' CD ' ' H ' ' A' ' 55' ' ' SER . 73.4 Cg_exo -54.75 45.65 0.03 OUTLIER 'Trans proline' 0 N--CA 1.503 2.081 0 C-N-CA 122.277 1.985 . . . . 0.0 113.205 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.63 ' N ' ' O ' ' A' ' 55' ' ' SER . 38.6 mt-10 46.98 27.94 0.8 Allowed 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 -179.383 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 8.9 mtm 65.4 -8.25 0.28 Allowed 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 -177.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.626 ' H ' ' C ' ' A' ' 57' ' ' GLU . 1.0 OUTLIER -50.21 -46.65 54.69 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-O 121.716 0.769 . . . . 0.0 109.875 179.191 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -52.31 -17.81 1.32 Allowed 'General case' 0 C--N 1.293 -1.875 0 O-C-N 121.089 -1.007 . . . . 0.0 109.331 -178.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -74.74 -68.07 0.58 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.166 -0.959 . . . . 0.0 109.265 178.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.576 ' NH2' HE22 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -58.46 -27.11 64.09 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 -179.644 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . 0.466 ' O ' ' N ' ' A' ' 67' ' ' ILE . 3.5 t60 -60.99 -45.61 94.11 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.874 -0.788 . . . . 0.0 108.874 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -60.54 -32.09 76.9 Favored Glycine 0 N--CA 1.484 1.889 0 C-N-CA 118.89 -1.624 . . . . 0.0 109.214 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -82.0 -41.98 19.98 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.106 -1.232 . . . . 0.0 108.258 178.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 51.9 t0 -69.5 -46.41 66.64 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 179.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.466 ' N ' ' O ' ' A' ' 63' ' ' HIS . 17.7 mm -54.59 -47.08 72.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 178.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.9 tp -60.53 -47.28 86.88 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.459 -0.776 . . . . 0.0 108.964 179.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 55.3 t -62.45 -21.77 27.94 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 O-C-N 121.181 -0.949 . . . . 0.0 110.072 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -77.19 -49.4 7.5 Favored Glycine 0 N--CA 1.49 2.286 0 C-N-CA 119.686 -1.245 . . . . 0.0 110.471 -178.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.522 ' O ' ' NE2' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -67.32 -28.01 67.64 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 120.67 -1.488 . . . . 0.0 107.519 179.743 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 4.5 mt -74.58 -33.06 31.19 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.474 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 176.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -60.27 -53.79 53.49 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.527 -0.733 . . . . 0.0 109.708 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -64.14 -31.53 72.76 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.439 -0.788 . . . . 0.0 109.764 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.25 -31.56 67.69 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 120.434 -1.416 . . . . 0.0 107.801 179.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.59 -33.38 66.16 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 178.087 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 5.8 tptt -67.13 -43.52 82.2 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-O 121.724 0.773 . . . . 0.0 109.526 178.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.9 mp -59.78 -32.04 70.23 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.11 -55.22 23.56 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.587 -0.696 . . . . 0.0 109.372 178.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.404 HD21 ' HG2' ' A' ' 27' ' ' LYS . 2.7 t-20 -73.37 -10.63 59.94 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.431 -0.793 . . . . 0.0 111.494 -178.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -92.41 -10.91 36.35 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 120.791 -1.193 . . . . 0.0 109.575 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.22 12.39 51.96 Favored Glycine 0 N--CA 1.496 2.681 0 N-CA-C 110.299 -1.12 . . . . 0.0 110.299 178.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 17.3 mmtp -93.86 82.56 4.28 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.064 -1.257 . . . . 0.0 108.001 179.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 19.4 t -76.69 -60.45 2.31 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.809 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.956 -178.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.6 mptt -49.43 -38.0 27.67 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.03 -1.044 . . . . 0.0 109.084 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.516 ' OE1' ' N ' ' A' ' 86' ' ' GLU . 35.3 mp0 -68.02 -46.3 71.57 Favored 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 179.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.2 -45.51 80.55 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 119.194 -1.003 . . . . 0.0 108.971 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.94 -58.82 6.43 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 179.488 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -53.4 -37.68 62.72 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.056 -1.027 . . . . 0.0 108.805 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.581 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -63.32 -35.08 79.19 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 178.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -48.24 -41.97 29.09 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -65.43 -26.41 67.95 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 178.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.647 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -73.45 -39.91 64.6 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 177.741 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.495 ' CD1' ' OE1' ' A' ' 71' ' ' GLN . 11.3 mp -62.81 -42.89 99.91 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 107.456 -1.312 . . . . 0.0 107.456 178.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 3.6 mtpt -54.89 -47.96 73.63 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 87.0 m -69.38 -32.25 71.15 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.244 -0.91 . . . . 0.0 109.515 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.9 m -60.83 -48.12 83.25 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.094 -1.004 . . . . 0.0 108.457 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 95.9 mt -51.23 -36.71 17.07 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -53.29 -43.55 67.6 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.32 -37.03 86.06 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.351 -0.843 . . . . 0.0 109.048 179.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.458 ' CD1' ' C ' ' A' ' 101' ' ' TYR . 0.5 OUTLIER -65.95 -28.21 68.74 Favored 'General case' 0 C--N 1.297 -1.682 0 O-C-N 120.26 -1.525 . . . . 0.0 107.832 179.41 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.53 ' ND2' ' O ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -66.6 -32.1 73.22 Favored 'General case' 0 C--N 1.298 -1.636 0 C-N-CA 119.152 -1.019 . . . . 0.0 110.084 -179.541 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.498 ' NE2' ' C ' ' A' ' 103' ' ' GLN . 0.9 OUTLIER -66.84 -20.94 66.03 Favored 'General case' 0 N--CA 1.485 1.325 0 N-CA-C 104.71 -2.329 . . . . 0.0 104.71 177.999 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.487 ' CA ' HE21 ' A' ' 103' ' ' GLN . 0.0 OUTLIER -80.77 -36.37 31.96 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 177.289 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.551 ' CD1' ' C ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -94.49 6.84 47.56 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.064 -1.023 . . . . 0.0 108.475 179.335 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . 0.503 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.49 2.3 0 CA-C-O 117.943 -1.476 . . . . 0.0 109.612 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.631 0.729 . . . . 0.0 109.186 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 43.7 mt -89.08 -49.83 6.52 Favored 'General case' 0 C--N 1.295 -1.766 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -65.32 -23.78 67.1 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 179.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -74.39 -51.86 13.78 Favored 'General case' 0 C--N 1.298 -1.658 0 C-N-CA 119.796 -0.762 . . . . 0.0 108.969 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.532 ' C ' ' ND2' ' A' ' 6' ' ' ASN . 0.0 OUTLIER -53.39 -37.6 62.62 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 -179.77 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.529 ' N ' HD21 ' A' ' 6' ' ' ASN . 11.9 m0 -53.41 -52.85 58.02 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.227 -0.921 . . . . 0.0 108.556 -179.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -56.46 -29.44 61.71 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.289 -0.882 . . . . 0.0 109.2 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 59.4 m -69.46 -63.76 1.01 Allowed 'General case' 0 N--CA 1.486 1.354 0 O-C-N 121.076 -1.015 . . . . 0.0 110.164 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.3 pp -59.05 -30.54 68.12 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 118.382 -1.327 . . . . 0.0 108.026 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -70.91 -58.16 3.87 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.94 -1.1 . . . . 0.0 108.931 178.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -58.96 -11.41 3.35 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.502 -0.749 . . . . 0.0 109.886 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -74.44 -53.24 9.93 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 107.594 -1.261 . . . . 0.0 107.594 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.16 -37.17 69.16 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.711 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.72 -40.92 84.2 Favored 'General case' 0 C--N 1.296 -1.718 0 C-N-CA 118.51 -1.276 . . . . 0.0 108.74 -179.286 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.553 ' O ' ' N ' ' A' ' 20' ' ' ALA . 69.3 t -60.25 -23.93 29.14 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 O-C-N 120.98 -1.075 . . . . 0.0 109.52 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.466 ' O ' ' N ' ' A' ' 20' ' ' ALA . 12.6 mt -70.41 -70.77 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.875 0 O-C-N 121.021 -1.049 . . . . 0.0 109.93 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -48.25 -25.18 1.42 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.12 -0.987 . . . . 0.0 108.893 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.38 -1.14 29.1 Favored 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 179.228 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.564 ' C ' ' H ' ' A' ' 22' ' ' ASN . . . -57.78 -38.13 74.92 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 107.686 -1.227 . . . . 0.0 107.686 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.505 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 8.9 m-20 58.13 -8.73 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.264 179.431 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.603 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -147.11 144.2 28.86 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 120.574 -1.329 . . . . 0.0 109.745 178.636 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.07 -22.23 37.65 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.861 -0.524 . . . . 0.0 111.016 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.8 -54.96 19.96 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.138 -0.976 . . . . 0.0 110.351 -179.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -67.35 -16.57 64.33 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.147 -0.971 . . . . 0.0 110.614 -179.035 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 48.9 t -71.11 -48.38 55.56 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.019 0 O-C-N 120.916 -1.115 . . . . 0.0 108.39 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.462 ' O ' ' OG1' ' A' ' 31' ' ' THR . 5.8 mppt? -55.59 -50.94 68.76 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 179.068 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.437 ' N ' ' OD1' ' A' ' 28' ' ' ASP . 6.2 m-20 -54.67 -39.58 68.22 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-N 114.782 -1.099 . . . . 0.0 109.654 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.77 -62.08 1.54 Allowed 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.31 -0.868 . . . . 0.0 110.284 -179.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 85.3 mt -62.95 -24.88 68.09 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.11 -0.994 . . . . 0.0 110.514 -179.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.462 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 31.6 m -60.86 -45.72 93.42 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.895 -1.128 . . . . 0.0 108.714 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 16.3 mmtm -71.44 -28.99 64.36 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-O 121.305 0.574 . . . . 0.0 109.517 -179.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' MET . . . . . 0.403 ' C ' ' N ' ' A' ' 35' ' ' ALA . 62.9 mtp -64.62 -67.66 0.42 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.153 -0.967 . . . . 0.0 108.812 178.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.473 ' O ' ' CD2' ' A' ' 38' ' ' LEU . 12.3 ttt-85 -48.72 -23.38 1.03 Allowed 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -179.323 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.403 ' N ' ' C ' ' A' ' 33' ' ' MET . . . -77.76 -58.27 3.36 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.95 -28.56 67.57 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.83 -1.169 . . . . 0.0 110.223 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -57.87 -58.77 6.92 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.98 -1.075 . . . . 0.0 108.609 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.473 ' CD2' ' O ' ' A' ' 34' ' ' ARG . 0.6 OUTLIER -62.34 -18.33 61.17 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.432 -0.793 . . . . 0.0 109.253 179.48 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -84.14 -39.15 19.8 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.773 -1.204 . . . . 0.0 108.248 178.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.47 -19.72 62.34 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.463 -0.773 . . . . 0.0 109.705 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.513 ' O ' ' N ' ' A' ' 43' ' ' ALA . 1.6 tm0? -46.43 -56.82 5.34 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.22 74.6 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.753 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.538 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.513 ' N ' ' O ' ' A' ' 41' ' ' GLN . . . -160.61 149.81 17.12 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.485 -1.384 . . . . 0.0 110.292 -179.223 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -154.91 74.35 5.66 Favored Pre-proline 0 N--CA 1.494 1.729 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.436 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 50.3 Cg_exo -46.8 -38.59 23.14 Favored 'Trans proline' 0 C--N 1.306 -1.688 0 C-N-CA 122.552 2.168 . . . . 0.0 114.315 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.436 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 73.0 Cg_endo -96.9 -92.01 0.0 OUTLIER 'Trans proline' 0 C--N 1.317 -1.111 0 C-N-CA 122.442 2.095 . . . . 0.0 112.149 -179.25 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 10.1 pttp -175.64 102.4 0.07 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.218 -0.927 . . . . 0.0 109.731 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.43 -177.34 6.46 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 178.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 52.07 22.37 1.85 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.751 -1.218 . . . . 0.0 108.291 -178.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -145.6 -56.8 0.31 Allowed 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -68.0 -163.79 0.04 OUTLIER 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.22 -0.925 . . . . 0.0 108.782 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.3 t -76.55 117.32 63.76 Favored Pre-proline 0 N--CA 1.486 1.363 0 O-C-N 120.998 -1.064 . . . . 0.0 108.948 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.615 ' C ' ' H ' ' A' ' 55' ' ' SER . 41.6 Cg_endo -83.25 -9.89 10.28 Favored 'Trans proline' 0 N--CA 1.496 1.645 0 C-N-CA 122.325 2.016 . . . . 0.0 111.494 -179.68 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.554 ' O ' ' CB ' ' A' ' 55' ' ' SER . 6.7 t0 63.14 -24.37 0.06 Allowed 'General case' 0 N--CA 1.491 1.577 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.595 -178.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.769 ' O ' ' N ' ' A' ' 57' ' ' GLU . 4.5 t 102.47 -26.44 0.0 OUTLIER Pre-proline 0 N--CA 1.52 3.029 0 N-CA-C 115.557 1.688 . . . . 0.0 115.557 177.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.55 ' O ' ' N ' ' A' ' 59' ' ' LYS . 85.7 Cg_exo -45.98 36.86 0.01 OUTLIER 'Trans proline' 0 N--CA 1.511 2.529 0 C-N-CA 122.677 2.251 . . . . 0.0 114.943 179.262 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.769 ' N ' ' O ' ' A' ' 55' ' ' SER . 25.3 tt0 50.41 23.4 1.25 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 120.426 -1.421 . . . . 0.0 107.189 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.503 ' SD ' ' O ' ' A' ' 57' ' ' GLU . 0.8 OUTLIER 66.41 -3.9 0.78 Allowed 'General case' 0 C--N 1.307 -1.282 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 -178.281 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.576 ' H ' ' C ' ' A' ' 57' ' ' GLU . 0.1 OUTLIER -52.93 -42.45 65.42 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 121.953 0.883 . . . . 0.0 109.396 179.514 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -55.39 -17.95 5.86 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 108.498 -0.926 . . . . 0.0 108.498 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.443 ' CD1' ' NZ ' ' A' ' 104' ' ' LYS . 30.8 t80 -75.11 -63.93 1.16 Allowed 'General case' 0 N--CA 1.492 1.627 0 CA-C-O 122.061 0.934 . . . . 0.0 109.44 178.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.583 ' O ' ' N ' ' A' ' 66' ' ' ASP . 0.0 OUTLIER -63.02 -31.88 73.11 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 -179.655 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . 0.476 ' O ' ' N ' ' A' ' 67' ' ' ILE . 4.8 t60 -54.84 -38.9 68.01 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -65.63 -34.7 89.72 Favored Glycine 0 C--N 1.293 -1.848 0 N-CA-C 108.137 -1.985 . . . . 0.0 108.137 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -82.98 -32.97 26.75 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.304 -1.115 . . . . 0.0 108.517 178.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.583 ' N ' ' O ' ' A' ' 62' ' ' ARG . 14.6 t0 -72.25 -44.89 62.19 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 177.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.476 ' N ' ' O ' ' A' ' 63' ' ' HIS . 5.5 mm -63.13 -35.86 73.52 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.524 0 O-C-N 121.287 -0.883 . . . . 0.0 109.094 178.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.8 tp -54.18 -61.34 2.37 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 122.153 0.978 . . . . 0.0 108.96 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.416 ' O ' ' NE ' ' A' ' 34' ' ' ARG . 31.0 m -57.87 -13.32 2.45 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.835 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.548 -178.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -78.19 -54.82 4.26 Favored Glycine 0 N--CA 1.494 2.506 0 C-N-CA 119.806 -1.188 . . . . 0.0 111.172 -179.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.446 ' O ' ' NE2' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -67.08 -29.12 68.79 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.316 -1.697 . . . . 0.0 107.9 -179.837 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 14.4 mt -71.05 -31.43 44.92 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 177.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -58.14 -52.22 66.45 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 119.205 -0.998 . . . . 0.0 109.347 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -64.4 -31.98 73.42 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.361 -0.837 . . . . 0.0 109.471 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.12 -30.22 63.47 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 120.698 -1.251 . . . . 0.0 108.389 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.81 -33.81 64.78 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 178.292 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.4 tptt -68.65 -46.54 68.89 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.33 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 8.1 mp -58.0 -33.41 68.9 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 -178.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.08 -50.07 69.82 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.35 -0.844 . . . . 0.0 108.862 178.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.426 HD21 ' HG2' ' A' ' 27' ' ' LYS . 2.1 t-20 -74.2 -13.58 60.82 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.591 -0.693 . . . . 0.0 111.447 -178.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 82.5 mt-10 -93.09 -10.43 36.05 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.602 -1.311 . . . . 0.0 110.128 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 95.57 15.62 42.79 Favored Glycine 0 N--CA 1.496 2.641 0 N-CA-C 110.264 -1.134 . . . . 0.0 110.264 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.1 mmtt -96.44 75.66 2.89 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.205 -1.173 . . . . 0.0 108.312 179.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 22.0 t -73.29 -59.32 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.778 -0.576 . . . . 0.0 109.638 -179.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.434 ' H ' ' HD2' ' A' ' 85' ' ' LYS . 0.0 OUTLIER -48.41 -35.99 13.85 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.216 -0.927 . . . . 0.0 108.517 179.378 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.526 ' OE1' ' N ' ' A' ' 86' ' ' GLU . 27.2 mp0 -71.65 -47.84 51.68 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 178.432 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.34 -42.74 98.95 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.482 ' O ' ' N ' ' A' ' 91' ' ' ALA . 0.1 OUTLIER -60.75 -61.42 2.6 Favored 'General case' 0 C--N 1.296 -1.726 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 178.654 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -49.0 -37.59 20.81 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.154 -0.966 . . . . 0.0 109.07 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.547 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -63.08 -36.56 84.0 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 178.246 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.482 ' N ' ' O ' ' A' ' 88' ' ' GLN . . . -45.96 -46.97 16.58 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.456 ' OE1' ' O ' ' A' ' 88' ' ' GLN . 2.3 mp0 -62.76 -27.18 69.11 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.14 -0.975 . . . . 0.0 108.444 178.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.686 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -72.69 -41.22 65.54 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 177.915 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.5 mp -63.44 -43.09 98.42 Favored 'General case' 0 C--N 1.305 -1.354 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 179.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 3.9 mtpt -56.27 -40.9 74.98 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.29 -0.881 . . . . 0.0 108.813 178.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 13.5 m -67.47 -31.75 72.12 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.15 -0.969 . . . . 0.0 108.868 179.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.24 -42.61 98.92 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 178.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.2 mt -53.81 -32.92 22.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.9 tpt180 -58.64 -45.4 89.38 Favored 'General case' 0 C--N 1.302 -1.496 0 C-N-CA 119.023 -1.071 . . . . 0.0 108.414 179.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.64 -24.96 67.75 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.461 -0.774 . . . . 0.0 109.18 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.408 ' O ' ' N ' ' A' ' 105' ' ' TYR . 6.2 t80 -74.72 -32.11 62.04 Favored 'General case' 0 C--N 1.297 -1.711 0 O-C-N 120.557 -1.34 . . . . 0.0 108.028 179.287 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.546 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.2 OUTLIER -65.5 -40.94 93.62 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 120.991 -1.068 . . . . 0.0 110.72 -179.096 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.629 HE21 ' N ' ' A' ' 104' ' ' LYS . 1.3 pp0? -64.87 -22.26 66.96 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 105.514 -2.032 . . . . 0.0 105.514 179.136 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.629 ' N ' HE21 ' A' ' 103' ' ' GLN . 0.0 OUTLIER -81.82 -33.31 30.82 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 176.631 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.568 ' CD1' ' C ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -90.61 3.77 53.18 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.117 -0.989 . . . . 0.0 108.59 179.7 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.491 2.342 0 CA-C-O 117.955 -1.469 . . . . 0.0 109.537 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.494 1.734 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 15.1 mt -87.38 -51.2 6.08 Favored 'General case' 0 C--N 1.296 -1.73 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 -179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -64.36 -22.72 67.05 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -72.73 -44.78 61.24 Favored 'General case' 0 C--N 1.298 -1.657 0 C-N-CA 119.568 -0.853 . . . . 0.0 108.742 -179.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.639 HD21 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -54.83 -44.11 73.61 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 -179.856 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.639 ' N ' HD21 ' A' ' 6' ' ' ASN . 11.6 m95 -53.13 -48.08 68.18 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.556 -0.715 . . . . 0.0 109.524 -179.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -56.32 -33.0 65.17 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 120.805 -1.185 . . . . 0.0 108.163 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.3 m -68.19 -52.12 37.95 Favored 'General case' 0 C--N 1.306 -1.301 0 C-N-CA 119.185 -1.006 . . . . 0.0 108.371 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 25.9 mt -58.96 -38.84 80.0 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 178.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -68.33 -52.78 29.64 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.576 -0.849 . . . . 0.0 108.902 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -61.53 -15.39 37.88 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.599 -0.688 . . . . 0.0 109.628 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -74.94 -51.82 12.77 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 179.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.2 mt -57.61 -33.01 67.77 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-O 120.995 0.426 . . . . 0.0 111.425 -178.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -67.8 -47.62 68.58 Favored 'General case' 0 C--N 1.296 -1.754 0 O-C-N 121.066 -1.022 . . . . 0.0 108.654 -179.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.523 ' O ' ' N ' ' A' ' 20' ' ' ALA . 55.6 t -55.88 -25.49 19.01 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 C-N-CA 119.304 -0.958 . . . . 0.0 109.755 -179.1 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.487 ' O ' ' N ' ' A' ' 20' ' ' ALA . 7.2 mt -71.28 -72.48 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.181 0 O-C-N 120.936 -1.103 . . . . 0.0 110.213 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -46.8 -27.4 1.2 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.893 -1.129 . . . . 0.0 109.201 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -101.02 -4.07 28.16 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.474 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.548 ' O ' ' ND2' ' A' ' 22' ' ' ASN . . . -57.49 -54.56 45.43 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 178.525 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.465 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 39.8 m-20 66.11 -0.92 1.27 Allowed 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.007 179.084 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.593 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -144.63 142.48 30.16 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.587 -1.321 . . . . 0.0 109.19 177.55 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -56.0 -19.38 12.37 Favored 'General case' 0 C--N 1.295 -1.792 0 O-C-N 121.599 -0.688 . . . . 0.0 110.794 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -71.41 -58.89 3.1 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.176 -0.953 . . . . 0.0 111.055 -179.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.515 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 5.0 mt-30 -64.3 -17.58 63.78 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.319 -0.863 . . . . 0.0 111.281 -177.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 55.4 t -70.7 -48.06 60.27 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 120.895 -1.128 . . . . 0.0 108.479 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.485 ' O ' ' OG1' ' A' ' 31' ' ' THR . 4.1 mtpt -56.27 -51.44 68.15 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 179.267 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.473 ' N ' ' OD1' ' A' ' 28' ' ' ASP . 2.8 m-20 -52.56 -38.03 59.03 Favored 'General case' 0 C--N 1.296 -1.741 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.754 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.52 -64.36 0.88 Allowed 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 119.663 -0.815 . . . . 0.0 110.009 -179.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 18.1 mt -61.13 -24.45 66.27 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.295 -0.878 . . . . 0.0 110.126 -178.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.485 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 53.3 m -59.7 -41.11 90.01 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 178.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.0 mtpm? -72.87 -32.08 65.16 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.359 -179.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' MET . . . . . 0.409 ' C ' ' N ' ' A' ' 35' ' ' ALA . 46.8 mtp -67.16 -68.09 0.4 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.01 -1.056 . . . . 0.0 108.956 178.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 12.9 ttt-85 -45.73 -26.44 0.64 Allowed 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -179.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.409 ' N ' ' C ' ' A' ' 33' ' ' MET . . . -74.79 -66.18 0.78 Allowed 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 178.389 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.91 -27.55 68.93 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.145 -0.972 . . . . 0.0 109.819 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.03 -42.15 84.73 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.01 -1.056 . . . . 0.0 108.401 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 25.6 mt -65.57 -30.18 70.88 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -82.53 -35.72 27.01 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.175 -0.953 . . . . 0.0 109.04 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -53.73 -26.16 21.98 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.42 ' C ' ' NE2' ' A' ' 41' ' ' GLN . 0.8 OUTLIER -52.14 -46.1 65.26 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.669 -0.644 . . . . 0.0 109.764 179.383 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 4.6 mptt -68.17 3.99 1.43 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.164 -0.96 . . . . 0.0 110.09 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.402 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -80.99 144.41 31.83 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.839 -1.163 . . . . 0.0 109.337 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.7 m -154.19 67.9 5.82 Favored Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.147 -0.971 . . . . 0.0 109.932 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.419 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 22.9 Cg_exo -56.64 -42.71 62.25 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 C-N-CA 122.305 2.003 . . . . 0.0 113.527 179.043 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.419 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 65.4 Cg_endo -83.43 -14.18 8.21 Favored 'Trans proline' 0 N--CA 1.494 1.534 0 C-N-CA 121.985 1.79 . . . . 0.0 112.23 -179.231 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 24.0 mtpt 74.2 109.84 0.07 Allowed 'General case' 0 N--CA 1.498 1.955 0 CA-C-O 121.581 0.705 . . . . 0.0 109.539 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.55 ' C ' ' H ' ' A' ' 50' ' ' ASP . 1.5 tt -87.05 -48.06 8.4 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.589 -0.694 . . . . 0.0 109.791 -179.144 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -68.34 40.53 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.082 -1.011 . . . . 0.0 109.381 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.55 ' H ' ' C ' ' A' ' 48' ' ' LEU . 5.6 t0 -146.55 -70.09 0.25 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.251 -0.906 . . . . 0.0 109.598 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.403 ' O ' ' O ' ' A' ' 50' ' ' ASP . 21.9 pttp -64.28 -141.16 0.0 OUTLIER 'General case' 0 C--N 1.298 -1.664 0 O-C-N 121.351 -0.843 . . . . 0.0 108.958 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 38.5 t -74.22 133.51 78.02 Favored Pre-proline 0 N--CA 1.485 1.314 0 O-C-N 120.594 -1.317 . . . . 0.0 109.378 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.41 ' O ' ' CB ' ' A' ' 54' ' ' ASP . 31.4 Cg_endo -83.47 -16.82 6.69 Favored 'Trans proline' 0 N--CA 1.499 1.836 0 C-N-CA 122.489 2.126 . . . . 0.0 112.627 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.41 ' CB ' ' O ' ' A' ' 53' ' ' PRO . 1.0 OUTLIER 77.47 -133.85 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.611 -0.681 . . . . 0.0 109.768 -179.053 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.696 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 12.6 p -167.97 -30.02 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.581 0 O-C-N 120.745 -1.222 . . . . 0.0 113.454 -179.269 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.696 ' CD ' ' H ' ' A' ' 55' ' ' SER . 73.2 Cg_exo -55.63 41.74 0.03 OUTLIER 'Trans proline' 0 N--CA 1.503 2.065 0 C-N-CA 122.243 1.962 . . . . 0.0 113.435 -179.421 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.626 ' N ' ' O ' ' A' ' 55' ' ' SER . 13.2 tt0 50.32 23.63 1.28 Allowed 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 -179.212 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.418 ' N ' ' C ' ' A' ' 56' ' ' PRO . 1.1 mpt? 67.94 -5.78 0.8 Allowed 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 -178.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.542 ' H ' ' C ' ' A' ' 57' ' ' GLU . 0.2 OUTLIER -47.75 -51.95 20.4 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-O 121.735 0.779 . . . . 0.0 108.963 178.902 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -52.41 -25.48 10.07 Favored 'General case' 0 C--N 1.3 -1.579 0 C-N-CA 120.497 -0.481 . . . . 0.0 109.842 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -75.81 -57.1 4.08 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 178.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -61.98 -33.83 75.03 Favored 'General case' 0 C--N 1.302 -1.479 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.683 179.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . 0.444 ' O ' ' N ' ' A' ' 67' ' ' ILE . 1.3 t60 -61.34 -38.97 88.85 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.242 -0.911 . . . . 0.0 108.925 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.58 -32.04 82.89 Favored Glycine 0 N--CA 1.484 1.891 0 N-CA-C 108.874 -1.69 . . . . 0.0 108.874 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -81.34 -41.64 21.74 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.185 -1.185 . . . . 0.0 107.995 178.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -69.96 -45.38 67.54 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 179.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.444 ' N ' ' O ' ' A' ' 63' ' ' HIS . 4.6 mm -55.1 -49.86 68.38 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 178.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 14.0 tp -59.03 -41.95 89.03 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 41.7 t -60.89 -18.96 18.55 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 178.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -79.6 -46.49 7.9 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 110.567 -1.013 . . . . 0.0 110.567 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.533 ' O ' ' NE2' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -67.73 -31.26 71.07 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 120.426 -1.632 . . . . 0.0 106.943 179.506 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 14.3 mt -72.84 -32.47 40.36 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.493 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 176.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -63.18 -52.04 63.93 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.454 -0.778 . . . . 0.0 110.013 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.52 -28.53 69.71 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.166 -0.959 . . . . 0.0 109.756 -179.048 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.57 -35.28 67.91 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 120.529 -1.357 . . . . 0.0 108.038 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.1 -33.04 64.72 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 178.349 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 6.8 tptt -67.48 -46.14 73.82 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 178.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 mp -58.48 -33.6 69.97 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.92 -50.59 68.08 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.416 HD21 ' HG2' ' A' ' 27' ' ' LYS . 1.9 t-20 -74.43 -12.61 60.55 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.639 -0.663 . . . . 0.0 111.395 -178.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -93.76 -10.63 33.57 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 120.622 -1.299 . . . . 0.0 110.536 -178.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 99.31 11.14 46.11 Favored Glycine 0 N--CA 1.498 2.772 0 C-N-CA 119.92 -1.133 . . . . 0.0 110.368 179.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.4 mmtp -95.91 85.06 3.98 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.094 -1.239 . . . . 0.0 108.282 179.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 30.9 t -77.22 -59.4 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.225 -178.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.8 mptt -54.49 -37.08 64.86 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 120.771 -1.206 . . . . 0.0 109.221 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -66.93 -42.71 84.85 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 178.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.11 -49.09 68.72 Favored 'General case' 0 C--N 1.306 -1.316 0 C-N-CA 119.404 -0.918 . . . . 0.0 108.805 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.43 ' O ' ' OE1' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -61.55 -48.49 80.75 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 179.442 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -54.52 -33.11 59.38 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 120.978 -1.076 . . . . 0.0 108.419 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.514 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -66.39 -32.92 74.6 Favored 'General case' 0 C--N 1.306 -1.286 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 178.55 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -48.19 -50.32 29.54 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.485 ' OE1' ' N ' ' A' ' 92' ' ' GLU . 19.7 mp0 -60.57 -27.96 68.1 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 178.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.702 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -74.22 -40.24 62.57 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 106.896 -1.52 . . . . 0.0 106.896 178.404 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.457 ' CD1' ' OE1' ' A' ' 71' ' ' GLN . 8.7 mp -64.07 -42.19 97.06 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 179.264 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 6.2 mtpt -57.94 -44.48 86.96 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.885 -1.135 . . . . 0.0 108.256 178.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 23.9 m -66.96 -27.79 67.75 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.154 -0.967 . . . . 0.0 109.214 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.21 -40.55 96.48 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 178.435 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 69.4 mt -49.83 -39.73 15.33 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.45 -43.95 80.02 Favored 'General case' 0 C--N 1.302 -1.466 0 C-N-CA 118.31 -1.356 . . . . 0.0 108.046 179.213 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.482 ' O ' ' OE1' ' A' ' 103' ' ' GLN . . . -65.83 -27.44 68.25 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.841 0.829 . . . . 0.0 109.305 179.316 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.44 ' O ' ' N ' ' A' ' 105' ' ' TYR . 12.4 t80 -71.71 -27.89 63.32 Favored 'General case' 0 C--N 1.294 -1.821 0 O-C-N 120.384 -1.448 . . . . 0.0 107.794 179.515 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.548 ' C ' HD21 ' A' ' 102' ' ' ASN . 0.4 OUTLIER -67.39 -41.84 84.33 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.109 -0.994 . . . . 0.0 110.229 -179.65 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.553 ' C ' HE21 ' A' ' 103' ' ' GLN . 0.0 OUTLIER -62.09 -21.74 65.23 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 105.403 -2.073 . . . . 0.0 105.403 178.663 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.408 ' N ' ' NE2' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -84.48 -34.95 23.27 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 177.247 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.558 ' CD1' ' C ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -88.54 8.24 29.15 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.921 -1.112 . . . . 0.0 109.018 -179.617 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.317 0 CA-C-O 117.958 -1.468 . . . . 0.0 109.485 179.868 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 . . . . . 0 N--CA 1.493 1.688 0 CA-C-O 121.64 0.733 . . . . 0.0 109.37 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 17.3 mt -89.07 -49.2 6.9 Favored 'General case' 0 C--N 1.295 -1.777 0 CA-C-O 121.631 0.729 . . . . 0.0 109.083 -178.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -66.86 -23.83 66.07 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 179.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -76.2 -49.91 15.92 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.851 -179.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.619 HD21 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -52.03 -42.81 63.36 Favored 'General case' 0 C--N 1.307 -1.245 0 O-C-N 121.252 -0.905 . . . . 0.0 108.695 -179.091 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.619 ' N ' HD21 ' A' ' 6' ' ' ASN . 11.0 m95 -57.61 -51.13 70.74 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.1 -1.0 . . . . 0.0 109.245 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -58.61 -30.16 67.03 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.131 -0.981 . . . . 0.0 108.726 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 46.5 m -67.96 -54.51 18.07 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 119.257 -0.977 . . . . 0.0 108.601 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.8 mt -59.05 -37.76 77.8 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 106.966 -1.494 . . . . 0.0 106.966 178.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -68.3 -55.07 13.38 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 119.725 -0.79 . . . . 0.0 109.104 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -59.05 -16.4 18.57 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.562 -0.711 . . . . 0.0 109.626 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -74.53 -53.55 9.23 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 179.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.9 mt -58.07 -30.69 66.41 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 122.011 -0.431 . . . . 0.0 111.278 -178.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.9 ttpp -69.15 -43.11 74.96 Favored 'General case' 0 C--N 1.295 -1.794 0 C-N-CA 118.622 -1.231 . . . . 0.0 108.963 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.532 ' O ' ' N ' ' A' ' 20' ' ' ALA . 53.7 t -57.93 -26.35 28.25 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.61 0 O-C-N 121.11 -0.994 . . . . 0.0 109.52 -179.498 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.489 ' O ' ' N ' ' A' ' 20' ' ' ALA . 9.6 mt -71.66 -72.25 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.084 -1.01 . . . . 0.0 110.499 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -47.12 -27.46 1.41 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.017 -1.052 . . . . 0.0 109.139 -179.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.74 2.47 30.33 Favored 'General case' 0 N--CA 1.5 2.061 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 178.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.629 ' C ' ' H ' ' A' ' 22' ' ' ASN . . . -56.66 -40.44 75.5 Favored 'General case' 0 N--CA 1.491 1.579 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 178.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.496 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 0.9 OUTLIER 57.25 -13.28 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.988 -0.445 . . . . 0.0 110.84 179.889 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.643 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -146.83 145.57 29.92 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 120.656 -1.278 . . . . 0.0 108.814 178.834 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -53.98 -35.44 61.83 Favored 'General case' 0 C--N 1.296 -1.747 0 O-C-N 121.901 -0.5 . . . . 0.0 111.761 -179.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.77 -49.36 76.84 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 120.987 -1.07 . . . . 0.0 110.671 -178.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.547 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 18.9 mt-30 -67.3 -17.68 64.87 Favored 'General case' 0 C--N 1.3 -1.551 0 O-C-N 121.038 -1.039 . . . . 0.0 110.271 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 47.2 t -73.05 -51.05 28.05 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.078 -1.014 . . . . 0.0 108.587 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.468 ' O ' ' OG1' ' A' ' 31' ' ' THR . 3.2 mppt? -54.21 -44.65 71.84 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -53.89 -38.79 65.16 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.046 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.77 -65.03 0.79 Allowed 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.483 -0.761 . . . . 0.0 110.452 -179.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 26.3 mt -61.7 -27.86 69.0 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.144 -0.972 . . . . 0.0 110.392 -178.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.468 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 33.7 m -62.25 -40.38 95.99 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 178.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 12.2 mmmt -72.39 -30.36 64.59 Favored 'General case' 0 C--N 1.296 -1.719 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.386 -179.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' MET . . . . . 0.409 ' O ' ' C ' ' A' ' 34' ' ' ARG . 48.7 mtt -63.71 -67.55 0.42 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.024 -1.048 . . . . 0.0 108.797 178.731 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.691 HH21 ' CB ' ' A' ' 73' ' ' ASP . 0.3 OUTLIER -44.01 -29.89 0.65 Allowed 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 -179.243 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.24 -59.1 2.89 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 178.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.77 -34.81 78.73 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.119 -0.988 . . . . 0.0 109.451 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.55 -38.46 71.93 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.194 -0.941 . . . . 0.0 108.697 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 11.9 mt -67.8 -29.0 68.07 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -85.11 -38.78 18.69 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.077 -1.015 . . . . 0.0 109.336 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.413 ' O ' ' CB ' ' A' ' 43' ' ' ALA . . . -56.5 -23.13 37.4 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.159 -0.963 . . . . 0.0 108.719 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.534 HE21 ' C ' ' A' ' 41' ' ' GLN . 0.6 OUTLIER -52.19 -51.55 57.42 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.264 -0.898 . . . . 0.0 108.94 179.315 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -67.04 10.11 0.16 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.406 -0.809 . . . . 0.0 109.444 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.515 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -79.37 128.71 33.67 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.878 -1.139 . . . . 0.0 108.772 179.682 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.43 ' O ' ' CG2' ' A' ' 44' ' ' THR . 12.2 t -154.56 61.93 3.4 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.335 -0.853 . . . . 0.0 109.637 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.453 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 86.4 Cg_exo -43.06 -37.31 6.36 Favored 'Trans proline' 0 C--N 1.304 -1.788 0 C-N-CA 122.716 2.277 . . . . 0.0 114.284 179.049 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.453 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 23.1 Cg_endo -93.75 -16.28 0.72 Allowed 'Trans proline' 0 N--CA 1.483 0.86 0 C-N-CA 122.566 2.177 . . . . 0.0 111.847 -179.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 21.3 mttm 80.06 98.29 0.06 Allowed 'General case' 0 N--CA 1.5 2.027 0 CA-C-O 121.25 0.547 . . . . 0.0 109.659 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -84.28 9.19 13.61 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.371 -0.831 . . . . 0.0 109.323 -179.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -99.61 27.82 5.08 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -148.87 -50.33 0.15 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.385 -0.822 . . . . 0.0 110.324 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -65.56 -160.55 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.181 -0.95 . . . . 0.0 109.377 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 20.8 t -73.13 129.99 85.4 Favored Pre-proline 0 N--CA 1.485 1.312 0 O-C-N 120.908 -1.12 . . . . 0.0 109.184 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -82.67 -9.11 11.19 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 122.64 2.227 . . . . 0.0 111.437 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 72.59 -114.48 0.05 Allowed 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 -178.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.651 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 1.4 t -167.87 -32.45 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.719 0 O-C-N 120.2 -1.563 . . . . 0.0 113.288 -179.498 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.651 ' CD ' ' H ' ' A' ' 55' ' ' SER . 68.1 Cg_exo -56.44 40.98 0.04 OUTLIER 'Trans proline' 0 N--CA 1.502 2.024 0 C-N-CA 122.068 1.845 . . . . 0.0 112.774 -179.739 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.645 ' N ' ' O ' ' A' ' 55' ' ' SER . 41.1 tt0 50.79 23.18 1.32 Allowed 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 106.999 -1.482 . . . . 0.0 106.999 -178.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.476 ' SD ' ' O ' ' A' ' 57' ' ' GLU . 0.3 OUTLIER 66.38 -3.51 0.83 Allowed 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 -178.272 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.588 ' H ' ' C ' ' A' ' 57' ' ' GLU . 0.9 OUTLIER -48.43 -48.38 37.41 Favored 'General case' 0 N--CA 1.487 1.404 0 CA-C-O 121.851 0.834 . . . . 0.0 109.424 178.984 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -51.13 -26.6 6.88 Favored 'General case' 0 C--N 1.295 -1.792 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 -179.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -77.93 -57.1 3.98 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 120.842 -1.161 . . . . 0.0 107.924 177.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.6 mtt-85 -58.44 -30.6 67.04 Favored 'General case' 0 N--CA 1.488 1.435 0 CA-C-O 121.366 0.603 . . . . 0.0 109.483 179.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . 0.465 ' O ' ' N ' ' A' ' 67' ' ' ILE . 1.8 t60 -63.65 -39.74 95.1 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.276 -0.89 . . . . 0.0 109.041 179.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -61.51 -31.92 79.32 Favored Glycine 0 N--CA 1.486 2.009 0 C-N-CA 118.737 -1.697 . . . . 0.0 109.132 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -81.8 -40.08 23.08 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.054 -1.262 . . . . 0.0 108.291 178.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -70.73 -48.62 53.55 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 178.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.465 ' N ' ' O ' ' A' ' 63' ' ' HIS . 20.5 mm -56.49 -39.06 59.42 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 15.8 tp -56.99 -44.3 82.58 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 20.3 t -63.01 -17.22 18.99 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.45 0 O-C-N 120.918 -1.114 . . . . 0.0 109.095 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -76.24 -40.91 27.75 Favored Glycine 0 N--CA 1.487 2.079 0 C-N-CA 119.859 -1.162 . . . . 0.0 111.011 -178.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.556 ' C ' HE21 ' A' ' 71' ' ' GLN . 0.0 OUTLIER -78.38 -32.67 49.02 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.998 -1.295 . . . . 0.0 107.841 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 7.0 mt -74.19 -30.45 26.98 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.679 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 177.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.691 ' CB ' HH21 ' A' ' 34' ' ' ARG . 0.0 OUTLIER -61.1 -52.57 64.36 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 119.679 -0.808 . . . . 0.0 109.528 -179.658 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -62.27 -32.11 72.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.032 -1.042 . . . . 0.0 108.978 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.46 -34.55 65.44 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 120.87 -1.144 . . . . 0.0 108.252 179.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.71 -30.34 55.64 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 106.943 -1.503 . . . . 0.0 106.943 178.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.6 tptt -70.85 -48.94 51.23 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-O 121.657 0.742 . . . . 0.0 109.66 178.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 8.1 mp -56.93 -34.66 68.19 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.62 -49.7 70.02 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.447 HD21 ' HG2' ' A' ' 27' ' ' LYS . 2.2 t-20 -73.08 -14.31 61.37 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.634 -0.666 . . . . 0.0 111.314 -179.055 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -94.55 -10.1 33.18 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.801 -1.187 . . . . 0.0 110.312 -178.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 97.38 12.6 47.84 Favored Glycine 0 N--CA 1.499 2.877 0 C-N-CA 120.237 -0.982 . . . . 0.0 110.77 178.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 14.3 mmtp -94.94 83.84 4.04 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.009 -1.289 . . . . 0.0 108.687 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 26.1 t -77.34 -56.45 7.87 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 O-C-N 121.79 -0.569 . . . . 0.0 110.009 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.418 ' H ' ' HD2' ' A' ' 85' ' ' LYS . 8.6 mptt -49.64 -39.42 35.94 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.221 -0.924 . . . . 0.0 108.648 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.547 ' OE1' ' N ' ' A' ' 86' ' ' GLU . 47.7 mp0 -70.18 -44.55 68.52 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 121.402 -0.811 . . . . 0.0 109.007 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.13 -38.91 86.38 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 119.359 -0.936 . . . . 0.0 109.338 -179.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.425 ' O ' ' N ' ' A' ' 91' ' ' ALA . 0.1 OUTLIER -61.39 -62.77 1.59 Allowed 'General case' 0 C--N 1.294 -1.825 0 CA-C-O 121.632 0.729 . . . . 0.0 109.607 179.796 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -49.76 -34.95 20.68 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.097 -1.002 . . . . 0.0 109.583 -179.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.531 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -62.03 -35.13 77.67 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 178.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.425 ' N ' ' O ' ' A' ' 88' ' ' GLN . . . -50.22 -43.43 52.78 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.027 -1.046 . . . . 0.0 108.204 178.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -62.8 -23.91 67.48 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 178.4 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.628 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -73.8 -37.92 64.77 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 106.441 -1.688 . . . . 0.0 106.441 177.87 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.29 -45.46 72.98 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -50.26 -38.99 43.63 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 107.85 -1.166 . . . . 0.0 107.85 179.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 34.7 m -72.79 -32.07 65.31 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.425 -0.797 . . . . 0.0 109.238 177.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.9 m -58.65 -46.97 85.99 Favored 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 4.3 mm -49.15 -40.91 13.76 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 179.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 10.1 ttt180 -64.5 -55.36 21.22 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 119.22 -0.992 . . . . 0.0 109.294 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.554 ' O ' ' NE2' ' A' ' 103' ' ' GLN . . . -63.4 -19.25 64.52 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.181 -0.949 . . . . 0.0 109.021 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.422 ' CD1' ' C ' ' A' ' 101' ' ' TYR . 9.1 t80 -74.56 -31.11 61.98 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 178.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.551 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -66.67 -42.36 86.7 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.998 -1.064 . . . . 0.0 110.096 -179.908 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.656 ' NE2' ' N ' ' A' ' 104' ' ' LYS . 2.0 pp0? -63.2 -15.76 57.99 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 116.808 -1.957 . . . . 0.0 105.778 179.443 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.656 ' N ' ' NE2' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -82.27 -34.19 28.84 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 106.759 -1.571 . . . . 0.0 106.759 175.572 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.527 ' CG ' ' O ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -91.76 6.36 46.28 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 179.338 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.32 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 179.63 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 . . . . . 0 N--CA 1.491 1.595 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.7 pp -88.53 -32.14 18.33 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 107.175 -1.417 . . . . 0.0 107.175 179.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -67.94 -25.1 65.29 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 105.579 -2.008 . . . . 0.0 105.579 177.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -72.95 -36.52 67.18 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.577 HD21 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -56.95 -41.28 78.0 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 179.452 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.577 ' N ' HD21 ' A' ' 6' ' ' ASN . 16.9 m95 -57.88 -46.91 84.16 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.079 -1.013 . . . . 0.0 108.841 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -63.2 -28.89 70.35 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 120.884 -1.135 . . . . 0.0 108.548 179.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 89.0 m -68.55 -62.86 1.2 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.464 -0.773 . . . . 0.0 109.733 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.2 pp -57.25 -31.3 65.41 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 118.451 -1.3 . . . . 0.0 108.181 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -70.03 -62.59 1.33 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.072 -1.018 . . . . 0.0 109.651 178.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -58.11 -11.89 2.97 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.368 -0.832 . . . . 0.0 109.79 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -72.65 -53.23 12.36 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 179.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.2 mt -56.75 -24.85 52.92 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.667 -178.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -68.67 -54.99 12.92 Favored 'General case' 0 C--N 1.301 -1.52 0 C-N-CA 118.414 -1.314 . . . . 0.0 109.166 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.636 ' O ' ' N ' ' A' ' 20' ' ' ALA . 12.5 m -55.01 -20.96 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 120.731 -1.23 . . . . 0.0 110.448 -179.048 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.498 ' O ' ' N ' ' A' ' 20' ' ' ALA . 10.6 mt -71.53 -72.88 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 O-C-N 120.373 -1.454 . . . . 0.0 109.622 179.416 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -47.71 -27.37 1.93 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.837 -1.164 . . . . 0.0 108.749 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.4 -0.19 32.94 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.636 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -57.99 -49.0 78.34 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 179.405 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.476 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 0.5 OUTLIER 67.88 -12.33 0.31 Allowed 'General case' 0 C--N 1.296 -1.742 0 O-C-N 121.772 -0.58 . . . . 0.0 109.926 179.336 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.642 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -144.84 143.8 30.8 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.946 -1.096 . . . . 0.0 109.554 178.925 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.21 -24.91 57.7 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 121.882 -0.511 . . . . 0.0 111.193 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.46 -51.61 64.92 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.073 -1.017 . . . . 0.0 109.965 -179.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.509 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 9.4 mt-30 -68.46 -17.55 64.22 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.285 -0.885 . . . . 0.0 110.548 -179.475 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 48.9 t -71.74 -50.23 40.2 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 O-C-N 120.962 -1.087 . . . . 0.0 108.661 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.439 ' HG2' HD21 ' A' ' 80' ' ' ASN . 5.1 mppt? -54.5 -53.22 57.27 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 106.954 -1.498 . . . . 0.0 106.954 179.164 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -52.36 -38.87 59.86 Favored 'General case' 0 C--N 1.296 -1.738 0 CA-C-N 114.717 -1.129 . . . . 0.0 109.453 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.58 -67.75 0.46 Allowed 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.468 -0.77 . . . . 0.0 110.433 -179.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 33.9 mt -59.16 -25.77 64.2 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.345 -0.847 . . . . 0.0 109.913 -178.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 20.8 m -61.39 -38.98 89.01 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 179.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 33.1 mttm -74.17 -31.06 62.54 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 41.2 mtp -66.65 -65.38 0.69 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.993 -1.067 . . . . 0.0 108.173 178.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 34' ' ' ARG . 18.2 ttt-85 -47.68 -25.56 1.24 Allowed 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.0 -60.12 2.41 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 119.843 -0.743 . . . . 0.0 109.025 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.78 -33.21 75.15 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.018 -1.051 . . . . 0.0 109.826 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.48 -39.73 73.72 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.087 -1.008 . . . . 0.0 108.795 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.5 mt -65.96 -32.11 73.41 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.405 -0.809 . . . . 0.0 108.878 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -86.22 -36.61 19.33 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.224 -0.922 . . . . 0.0 109.986 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.02 -22.24 62.36 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.151 -0.968 . . . . 0.0 110.461 -179.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.619 ' C ' ' H ' ' A' ' 43' ' ' ALA . 1.1 tm0? -48.84 -66.54 0.38 Allowed 'General case' 0 C--N 1.3 -1.556 0 O-C-N 120.879 -1.138 . . . . 0.0 109.335 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.557 ' NZ ' ' NE2' ' A' ' 41' ' ' GLN . 2.8 mptp? -53.96 5.04 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.625 -0.672 . . . . 0.0 110.71 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.619 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -78.48 134.47 37.32 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.607 -1.308 . . . . 0.0 109.515 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -152.18 72.1 7.74 Favored Pre-proline 0 N--CA 1.492 1.656 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.44 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 52.0 Cg_exo -46.81 -39.12 23.91 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.521 2.147 . . . . 0.0 113.905 -179.305 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.44 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 89.5 Cg_endo -97.63 -95.75 0.0 OUTLIER 'Trans proline' 0 C--N 1.319 -1.02 0 C-N-CA 122.426 2.084 . . . . 0.0 111.852 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 4.0 pttt -175.6 116.57 0.15 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.283 -0.886 . . . . 0.0 110.005 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.547 ' CD2' ' H ' ' A' ' 49' ' ' GLU . 0.4 OUTLIER -83.86 -172.66 4.28 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 178.116 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.547 ' H ' ' CD2' ' A' ' 48' ' ' LEU . 59.8 mt-10 49.27 23.3 0.79 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.76 -1.212 . . . . 0.0 108.814 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.403 ' N ' ' C ' ' A' ' 48' ' ' LEU . 4.3 m-20 -140.49 -70.5 0.38 Allowed 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.426 ' HG3' ' N ' ' A' ' 52' ' ' SER . 17.5 pttp -66.96 -121.69 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 178.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' SER . . . . . 0.426 ' N ' ' HG3' ' A' ' 51' ' ' LYS . 9.1 t -81.89 114.1 47.91 Favored Pre-proline 0 N--CA 1.488 1.446 0 O-C-N 120.539 -1.351 . . . . 0.0 109.581 179.134 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -90.19 -16.24 1.8 Allowed 'Trans proline' 0 N--CA 1.491 1.372 0 C-N-CA 122.452 2.101 . . . . 0.0 112.023 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 65.05 -131.6 0.27 Allowed 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 -178.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.658 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 7.5 t -170.06 -33.84 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 120.859 -1.151 . . . . 0.0 112.363 179.632 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.658 ' CD ' ' H ' ' A' ' 55' ' ' SER . 95.0 Cg_exo -51.52 59.35 0.02 OUTLIER 'Trans proline' 0 N--CA 1.505 2.178 0 C-N-CA 122.608 2.205 . . . . 0.0 114.116 -178.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.634 ' N ' ' O ' ' A' ' 55' ' ' SER . 93.5 mt-10 42.42 29.51 0.16 Allowed 'General case' 0 N--CA 1.493 1.725 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.473 ' SD ' ' C ' ' A' ' 57' ' ' GLU . 1.3 mpt? 65.27 -8.17 0.27 Allowed 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 -178.107 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.616 ' H ' ' C ' ' A' ' 57' ' ' GLU . 2.4 tmtm? -48.1 -43.27 30.77 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-O 121.804 0.811 . . . . 0.0 109.169 179.296 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -56.29 -27.08 54.23 Favored 'General case' 0 C--N 1.294 -1.834 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 -179.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -73.94 -53.14 10.78 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.5 mtt85 -61.79 -33.0 73.33 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.392 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . 0.519 ' O ' ' N ' ' A' ' 67' ' ' ILE . 0.7 OUTLIER -63.29 -35.88 81.84 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.226 -0.921 . . . . 0.0 108.704 179.594 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.34 -31.82 80.11 Favored Glycine 0 N--CA 1.485 1.915 0 N-CA-C 108.326 -1.91 . . . . 0.0 108.326 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -81.67 -38.01 26.56 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 178.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -72.14 -47.4 51.33 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.519 ' N ' ' O ' ' A' ' 63' ' ' HIS . 4.8 mm -56.2 -48.88 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 179.037 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 14.8 tp -57.41 -44.93 84.99 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.409 HG11 ' HE ' ' A' ' 34' ' ' ARG . 32.1 t -65.92 -19.93 26.49 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.366 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 178.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -77.75 -48.39 7.92 Favored Glycine 0 N--CA 1.488 2.145 0 C-N-CA 120.1 -1.047 . . . . 0.0 110.549 -178.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.546 ' C ' HE21 ' A' ' 71' ' ' GLN . 0.0 OUTLIER -71.37 -29.79 65.38 Favored 'General case' 0 C--N 1.305 -1.341 0 O-C-N 120.823 -1.398 . . . . 0.0 107.583 179.725 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 8.1 mt -75.16 -33.64 29.27 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.507 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 176.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -62.74 -58.69 6.59 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.256 -0.902 . . . . 0.0 109.332 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.72 -26.81 67.45 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.64 -31.13 63.35 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 107.821 -1.178 . . . . 0.0 107.821 178.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.07 -33.55 67.38 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 106.236 -1.764 . . . . 0.0 106.236 178.155 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.8 tptt -68.16 -48.17 66.06 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.517 179.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.5 mp -57.69 -34.95 69.97 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.21 -50.4 68.2 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 178.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.439 HD21 ' HG2' ' A' ' 27' ' ' LYS . 2.1 t-20 -73.44 -12.0 60.65 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.47 -0.769 . . . . 0.0 111.352 -179.11 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -95.12 -12.81 25.8 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.663 -1.273 . . . . 0.0 110.23 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 99.28 11.85 43.96 Favored Glycine 0 N--CA 1.495 2.607 0 C-N-CA 120.206 -0.997 . . . . 0.0 110.688 179.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.3 mmtp -93.65 78.68 4.28 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 120.887 -1.361 . . . . 0.0 108.135 179.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 26.3 t -75.91 -50.67 22.37 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.679 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.72 -179.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 6.9 mptt -53.0 -38.7 62.53 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 120.936 -1.102 . . . . 0.0 108.18 179.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.541 ' N ' ' CD ' ' A' ' 86' ' ' GLU . 4.7 mp0 -69.08 -42.95 75.52 Favored 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 178.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.5 -51.97 44.72 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 119.532 -0.867 . . . . 0.0 109.707 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.44 -49.45 77.51 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -55.0 -37.29 66.39 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.853 -1.155 . . . . 0.0 108.402 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.518 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -65.68 -31.91 73.18 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 178.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -49.87 -43.24 49.09 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 178.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -65.43 -27.51 68.57 Favored 'General case' 0 C--N 1.306 -1.285 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 178.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.629 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -73.42 -41.25 63.5 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 106.605 -1.628 . . . . 0.0 106.605 177.805 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.4 mp -67.56 -37.05 82.1 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 108.315 -0.995 . . . . 0.0 108.315 179.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 2.4 mtpt -53.89 -39.42 65.75 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 120.049 -1.657 . . . . 0.0 106.685 177.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.3 m -71.05 -26.01 62.89 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.431 ' O ' ' N ' ' A' ' 101' ' ' TYR . 1.2 m -60.84 -46.33 91.0 Favored 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 179.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 81.4 mt -51.33 -43.01 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 179.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -62.95 -56.76 14.33 Favored 'General case' 0 C--N 1.307 -1.269 0 C-N-CA 119.633 -0.827 . . . . 0.0 109.816 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.68 -21.68 66.51 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.858 -1.151 . . . . 0.0 108.828 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.629 ' CE2' ' NZ ' ' A' ' 104' ' ' LYS . 11.2 t80 -75.89 -27.46 57.72 Favored 'General case' 0 C--N 1.291 -1.938 0 O-C-N 120.351 -1.468 . . . . 0.0 107.328 178.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.538 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -67.06 -36.25 81.63 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 119.588 -0.845 . . . . 0.0 109.944 -179.762 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.601 HE21 ' N ' ' A' ' 104' ' ' LYS . 1.3 pp0? -65.32 -23.68 67.07 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 105.158 -2.164 . . . . 0.0 105.158 178.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.629 ' NZ ' ' CE2' ' A' ' 101' ' ' TYR . 0.0 OUTLIER -80.95 -30.86 35.13 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 176.601 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.549 ' CD1' ' C ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -94.84 7.74 44.96 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.186 -0.947 . . . . 0.0 108.782 179.994 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . 0.406 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.492 2.413 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.503 0.668 . . . . 0.0 109.296 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 60.9 mt -89.26 -48.27 7.48 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -63.64 -23.71 67.49 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 178.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -72.97 -47.37 45.97 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ASN . . . . . 0.539 HD21 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -53.99 -38.85 65.51 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 -179.814 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.539 ' N ' HD21 ' A' ' 6' ' ' ASN . 8.2 m95 -55.89 -55.58 30.87 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.146 -0.971 . . . . 0.0 109.621 -179.397 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -52.47 -29.8 26.62 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 120.586 -1.321 . . . . 0.0 109.689 -179.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 53.5 m -68.94 -65.38 0.71 Allowed 'General case' 0 N--CA 1.487 1.421 0 O-C-N 120.837 -1.165 . . . . 0.0 109.599 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.6 pp -57.99 -30.29 65.94 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 118.66 -1.216 . . . . 0.0 108.454 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.62 -59.94 2.49 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.862 -1.149 . . . . 0.0 109.209 178.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.5 t0 -57.38 -13.09 3.01 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.291 -0.881 . . . . 0.0 109.632 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -72.73 -52.37 15.41 Favored 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 107.166 -1.42 . . . . 0.0 107.166 179.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.6 mt -56.16 -25.9 48.33 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-O 121.058 0.456 . . . . 0.0 110.779 -179.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 25.3 ttmt -68.68 -56.16 9.08 Favored 'General case' 0 C--N 1.3 -1.55 0 C-N-CA 118.669 -1.212 . . . . 0.0 109.215 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.643 ' O ' ' N ' ' A' ' 20' ' ' ALA . 14.3 m -54.28 -20.42 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 C-N-CA 118.771 -1.172 . . . . 0.0 110.578 -178.701 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.47 ' O ' ' N ' ' A' ' 20' ' ' ALA . 9.3 mt -71.28 -72.08 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 O-C-N 120.339 -1.476 . . . . 0.0 109.093 179.212 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -48.47 -27.4 2.65 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.871 -1.143 . . . . 0.0 108.639 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -101.61 0.2 35.9 Favored 'General case' 0 N--CA 1.495 1.825 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.643 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -59.93 -43.56 94.87 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 179.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.513 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 21.6 m-20 59.46 -9.08 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.036 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.621 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -146.32 143.29 29.03 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 120.604 -1.31 . . . . 0.0 109.653 178.609 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.78 -29.71 54.89 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.679 -0.638 . . . . 0.0 111.423 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.67 -50.85 70.82 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.958 -1.089 . . . . 0.0 110.107 -178.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.499 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 6.3 mt-30 -68.7 -19.11 64.36 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.137 -0.977 . . . . 0.0 110.395 -179.582 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 43.0 t -71.95 -50.59 36.67 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 120.945 -1.097 . . . . 0.0 108.709 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.493 ' O ' ' OG1' ' A' ' 31' ' ' THR . 5.1 mtpt -54.79 -55.3 31.57 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 179.359 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -50.31 -38.36 41.19 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.85 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.56 -62.89 1.2 Allowed 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.243 -0.911 . . . . 0.0 110.05 -179.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 71.7 mt -61.46 -20.47 63.16 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.378 -0.826 . . . . 0.0 110.25 -179.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.493 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 56.7 m -61.21 -47.48 85.9 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 178.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.559 ' HZ2' ' CB ' ' A' ' 32' ' ' LYS . 0.4 OUTLIER -70.93 -25.81 62.91 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 121.807 -0.558 . . . . 0.0 109.793 -179.028 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' MET . . . . . 0.448 ' C ' ' N ' ' A' ' 35' ' ' ALA . 28.2 mtp -67.35 -66.94 0.5 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.784 -1.197 . . . . 0.0 108.905 178.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 22.0 ttt-85 -48.37 -21.58 0.55 Allowed 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.448 ' N ' ' C ' ' A' ' 33' ' ' MET . . . -75.06 -63.02 1.35 Allowed 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 178.201 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.25 -28.52 69.78 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.163 -0.961 . . . . 0.0 109.565 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.79 -41.83 87.6 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.071 -1.018 . . . . 0.0 108.648 179.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 22.7 mt -65.91 -28.62 69.08 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -85.94 -35.63 20.35 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.26 -0.9 . . . . 0.0 109.821 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.441 ' O ' ' CB ' ' A' ' 43' ' ' ALA . . . -55.64 -29.83 59.93 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.028 -1.045 . . . . 0.0 108.974 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.499 ' C ' ' H ' ' A' ' 43' ' ' ALA . 1.0 OUTLIER -48.06 -53.02 17.78 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-O 122.112 0.958 . . . . 0.0 108.546 178.824 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.6 mmmm -65.35 6.92 0.24 Allowed 'General case' 0 C--N 1.297 -1.688 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.762 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.499 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -81.66 145.56 30.5 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.827 -1.17 . . . . 0.0 110.127 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.6 p -152.05 67.91 7.19 Favored Pre-proline 0 N--CA 1.492 1.661 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.443 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 73.3 Cg_exo -42.87 -38.7 7.05 Favored 'Trans proline' 0 C--N 1.304 -1.795 0 C-N-CA 122.457 2.105 . . . . 0.0 113.376 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.443 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 94.3 Cg_endo -103.07 -98.04 0.0 OUTLIER 'Trans proline' 0 C--N 1.32 -0.935 0 C-N-CA 122.647 2.232 . . . . 0.0 111.983 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.2 102.78 0.08 Allowed 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 -179.348 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.2 tt -82.05 34.61 0.41 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.796 -1.19 . . . . 0.0 109.733 -179.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.437 ' O ' ' OD1' ' A' ' 50' ' ' ASP . 7.4 pt-20 -133.84 22.67 3.9 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 178.28 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.437 ' OD1' ' O ' ' A' ' 49' ' ' GLU . 0.4 OUTLIER -151.75 -44.76 0.11 Allowed 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -179.161 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.462 ' HG3' ' N ' ' A' ' 52' ' ' SER . 10.3 ptmm? -66.89 -152.78 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.55 -0.719 . . . . 0.0 109.543 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' SER . . . . . 0.462 ' N ' ' HG3' ' A' ' 51' ' ' LYS . 7.5 t -77.03 118.73 73.87 Favored Pre-proline 0 N--CA 1.485 1.315 0 O-C-N 120.787 -1.195 . . . . 0.0 109.173 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -83.54 -15.36 7.44 Favored 'Trans proline' 0 N--CA 1.493 1.477 0 C-N-CA 122.327 2.018 . . . . 0.0 111.761 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 47.9 t0 60.47 -132.84 0.79 Allowed 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 -179.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.725 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 11.7 t -165.6 -26.97 0.0 OUTLIER Pre-proline 0 N--CA 1.495 1.79 0 O-C-N 120.328 -1.483 . . . . 0.0 113.898 -179.273 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.725 ' CD ' ' H ' ' A' ' 55' ' ' SER . 62.7 Cg_exo -56.51 47.29 0.04 OUTLIER 'Trans proline' 0 N--CA 1.504 2.106 0 C-N-CA 122.204 1.936 . . . . 0.0 113.346 -179.605 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.61 ' N ' ' O ' ' A' ' 55' ' ' SER . 0.6 OUTLIER 48.64 27.5 1.52 Allowed 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 -179.005 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.498 ' SD ' ' OE2' ' A' ' 57' ' ' GLU . 1.6 mpp? 64.04 -4.75 0.35 Allowed 'General case' 0 C--N 1.308 -1.202 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -178.213 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.577 ' H ' ' C ' ' A' ' 57' ' ' GLU . 0.1 OUTLIER -48.2 -44.76 33.06 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.947 0.88 . . . . 0.0 108.668 179.009 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -56.41 -25.92 51.62 Favored 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.488 ' N ' ' O ' ' A' ' 58' ' ' MET . 15.6 t80 -76.18 -54.08 7.34 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 177.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.4 mtt85 -59.55 -30.35 68.56 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 179.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . 0.47 ' CE1' ' CD1' ' A' ' 67' ' ' ILE . 2.4 t60 -61.98 -40.97 97.44 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -62.16 -33.57 86.3 Favored Glycine 0 N--CA 1.484 1.863 0 N-CA-C 109.091 -1.604 . . . . 0.0 109.091 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -81.79 -37.9 26.42 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.012 -1.287 . . . . 0.0 108.264 178.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -71.99 -47.44 52.0 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 178.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.47 ' CD1' ' CE1' ' A' ' 63' ' ' HIS . 15.8 mm -54.55 -45.09 71.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 12.8 tp -57.81 -44.49 86.42 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 42.6 t -60.7 -15.15 10.75 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 O-C-N 121.076 -1.015 . . . . 0.0 109.265 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -79.64 -47.66 7.15 Favored Glycine 0 N--CA 1.49 2.265 0 C-N-CA 119.786 -1.197 . . . . 0.0 110.682 -179.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.526 ' O ' ' NE2' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -69.6 -29.84 67.46 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.699 -1.471 . . . . 0.0 107.532 179.894 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 4.7 mt -73.46 -34.34 42.46 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 176.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -63.28 -56.11 19.22 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.445 -0.784 . . . . 0.0 109.694 -179.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -62.2 -29.09 70.14 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.225 -0.922 . . . . 0.0 109.354 -179.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.31 -29.59 62.8 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 120.642 -1.286 . . . . 0.0 108.229 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.69 -33.84 66.84 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 106.211 -1.774 . . . . 0.0 106.211 178.161 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.1 tptt -68.4 -46.79 69.03 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.301 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.8 mp -57.4 -35.1 69.6 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.74 -50.1 70.41 Favored 'General case' 0 C--N 1.297 -1.705 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 178.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.443 HD21 ' HG2' ' A' ' 27' ' ' LYS . 1.9 t-20 -74.87 -13.07 60.51 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.494 -0.753 . . . . 0.0 111.616 -178.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -93.84 -9.23 38.04 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 120.606 -1.309 . . . . 0.0 110.205 -179.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 97.35 12.65 47.78 Favored Glycine 0 N--CA 1.499 2.854 0 O-C-N 121.032 -1.042 . . . . 0.0 110.592 178.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.4 mmtp -95.08 81.24 3.66 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.044 -1.268 . . . . 0.0 108.127 179.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 53.1 t -76.51 -61.83 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.414 -178.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.3 mtmm -49.81 -34.95 21.13 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.03 -1.044 . . . . 0.0 108.427 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.515 ' H ' ' CD ' ' A' ' 86' ' ' GLU . 29.8 mp0 -68.27 -45.8 72.17 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 178.216 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.13 -46.52 73.86 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 119.463 -0.895 . . . . 0.0 108.871 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.71 -51.88 67.9 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.24 -33.85 71.5 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 120.902 -1.124 . . . . 0.0 108.338 179.049 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -66.35 -26.95 67.52 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 178.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -56.64 -47.45 79.7 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 178.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -64.72 -22.79 67.06 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 178.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.662 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -72.93 -39.59 66.14 Favored 'General case' 0 N--CA 1.485 1.275 0 N-CA-C 106.18 -1.785 . . . . 0.0 106.18 177.908 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.433 ' CD1' ' OE1' ' A' ' 71' ' ' GLN . 3.9 mp -63.46 -50.63 68.96 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 178.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 4.5 mtpp -50.33 -42.53 52.97 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 178.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 5.3 m -70.88 -40.95 71.95 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.34 -0.85 . . . . 0.0 109.034 179.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -61.15 -40.43 93.84 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 72.9 mt -54.94 -33.15 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -59.32 -50.82 72.52 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 119.656 -0.818 . . . . 0.0 109.564 -179.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.66 -34.91 78.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.824 -1.172 . . . . 0.0 108.619 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.489 ' CD1' ' C ' ' A' ' 101' ' ' TYR . 1.1 t80 -68.09 -26.11 65.66 Favored 'General case' 0 C--N 1.293 -1.871 0 O-C-N 120.579 -1.326 . . . . 0.0 107.829 179.131 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.527 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -65.92 -34.91 79.21 Favored 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 119.162 -1.015 . . . . 0.0 110.057 -179.442 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.56 HE21 ' N ' ' A' ' 104' ' ' LYS . 1.1 pp0? -65.68 -21.83 66.58 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 104.759 -2.311 . . . . 0.0 104.759 178.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.56 ' N ' HE21 ' A' ' 103' ' ' GLN . 0.0 OUTLIER -79.5 -33.9 41.74 Favored 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 176.849 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.549 ' CD1' ' C ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -94.1 3.14 55.72 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.122 -0.986 . . . . 0.0 108.442 179.016 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . 0.52 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.491 2.36 0 CA-C-O 118.049 -1.417 . . . . 0.0 109.625 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -87.28 -15.69 37.33 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.483 -0.761 . . . . 0.0 109.088 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 44.4 mt -88.93 -50.08 6.41 Favored 'General case' 0 C--N 1.295 -1.771 0 CA-C-O 121.556 0.694 . . . . 0.0 109.172 -179.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.796 ' CD ' ' CB ' ' A' ' 4' ' ' GLU . . . -65.75 -26.34 67.68 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 178.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -76.87 -45.14 29.35 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.701 -179.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.566 HD21 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -52.33 -46.8 66.21 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 -179.19 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.566 ' N ' HD21 ' A' ' 6' ' ' ASN . 10.8 m95 -51.73 -57.76 8.33 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 179.588 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -58.5 -29.54 66.33 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 178.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.0 m -69.03 -55.41 10.91 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 119.328 -0.949 . . . . 0.0 108.986 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.8 mt -53.68 -40.82 66.27 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 106.845 -1.539 . . . . 0.0 106.845 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -68.21 -60.94 2.09 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 120.058 -0.657 . . . . 0.0 109.678 178.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -58.59 -13.6 6.14 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.394 -0.816 . . . . 0.0 110.153 -179.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -75.72 -54.69 6.55 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 179.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.4 mt -56.37 -28.58 59.59 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.296 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.2 ttpt -71.97 -42.71 66.22 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 120.802 -1.186 . . . . 0.0 108.942 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.573 ' O ' ' N ' ' A' ' 20' ' ' ALA . 72.5 t -59.33 -24.56 28.21 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.538 0 C-N-CA 119.323 -0.951 . . . . 0.0 109.256 -179.41 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.456 ' O ' ' N ' ' A' ' 20' ' ' ALA . 10.4 mt -70.94 -72.19 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.171 -0.956 . . . . 0.0 109.669 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -46.55 -28.3 1.38 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.249 -0.907 . . . . 0.0 109.139 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.69 1.98 32.55 Favored 'General case' 0 N--CA 1.504 2.234 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 179.082 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.573 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -57.08 -47.5 80.86 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.897 -1.127 . . . . 0.0 108.011 179.273 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.484 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 0.5 OUTLIER 67.13 -13.51 0.2 Allowed 'General case' 0 C--N 1.297 -1.711 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.728 179.659 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.649 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -146.17 146.41 30.82 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 120.842 -1.161 . . . . 0.0 110.029 179.043 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -58.62 -24.11 60.36 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.863 -0.523 . . . . 0.0 110.966 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.3 -51.29 64.21 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.0 -1.063 . . . . 0.0 110.017 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.519 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 7.0 mt-30 -69.33 -18.31 63.8 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.194 -0.941 . . . . 0.0 110.473 -179.502 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 61.6 t -71.17 -49.04 51.32 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 120.887 -1.133 . . . . 0.0 108.337 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.463 ' O ' ' N ' ' A' ' 31' ' ' THR . 8.4 mtpt -56.53 -55.26 35.99 Favored 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 106.754 -1.573 . . . . 0.0 106.754 179.024 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -51.13 -40.12 57.78 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 114.675 -1.148 . . . . 0.0 109.244 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.02 -63.33 1.08 Allowed 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.387 -0.821 . . . . 0.0 109.402 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 86.7 mt -62.95 -24.54 67.93 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.249 -0.907 . . . . 0.0 109.68 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.463 ' N ' ' O ' ' A' ' 27' ' ' LYS . 53.6 m -61.19 -39.68 91.09 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.942 -1.099 . . . . 0.0 108.344 179.284 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 39.3 mtpt -74.0 -30.68 62.59 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' MET . . . . . 0.402 ' C ' ' N ' ' A' ' 35' ' ' ALA . 34.5 mtp -66.23 -73.15 0.14 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.106 -0.996 . . . . 0.0 109.293 178.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.664 HH21 ' CB ' ' A' ' 73' ' ' ASP . 0.0 OUTLIER -46.04 -26.47 0.74 Allowed 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -179.168 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.402 ' N ' ' C ' ' A' ' 33' ' ' MET . . . -73.42 -63.36 1.21 Allowed 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 119.896 -0.722 . . . . 0.0 109.36 179.625 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.43 -28.0 69.5 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.073 -1.017 . . . . 0.0 109.426 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.35 -45.51 93.21 Favored 'General case' 0 N--CA 1.487 1.421 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 14.8 mt -65.77 -24.25 66.9 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 179.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -83.15 -47.86 11.16 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 179.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.431 ' O ' ' CB ' ' A' ' 43' ' ' ALA . . . -60.0 -9.78 3.48 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.389 -0.819 . . . . 0.0 109.465 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.496 ' C ' ' H ' ' A' ' 43' ' ' ALA . 1.3 tm0? -50.76 -57.1 9.17 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 120.683 -1.26 . . . . 0.0 108.017 179.233 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.32 32.2 0.09 Allowed 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.496 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -77.3 137.91 39.06 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.969 -1.082 . . . . 0.0 109.992 -179.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.63 ' N ' ' CD ' ' A' ' 45' ' ' PRO . 12.4 t -156.91 40.05 0.1 Allowed Pre-proline 0 N--CA 1.489 1.509 0 O-C-N 121.529 -0.732 . . . . 0.0 110.188 179.059 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.63 ' CD ' ' N ' ' A' ' 44' ' ' THR . 6.0 Cg_exo -45.28 -36.01 12.08 Favored 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 122.484 2.123 . . . . 0.0 113.923 178.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.48 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 46.7 Cg_endo -95.06 -12.93 0.79 Allowed 'Trans proline' 0 C--N 1.321 -0.872 0 C-N-CA 122.497 2.131 . . . . 0.0 111.333 -178.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.527 ' O ' ' NZ ' ' A' ' 51' ' ' LYS . 10.7 mtpt 82.89 105.93 0.06 Allowed 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.1 mt -79.59 4.38 16.09 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.361 -0.837 . . . . 0.0 108.971 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -98.55 18.79 15.86 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -147.0 42.59 1.13 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.801 -0.562 . . . . 0.0 110.067 -179.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.527 ' NZ ' ' O ' ' A' ' 47' ' ' LYS . 9.9 ptpp? -171.3 -143.07 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 108.636 -0.875 . . . . 0.0 108.636 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 28.5 t -76.74 116.28 55.38 Favored Pre-proline 0 N--CA 1.485 1.295 0 O-C-N 120.658 -1.276 . . . . 0.0 109.431 179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -85.76 -12.35 6.34 Favored 'Trans proline' 0 N--CA 1.492 1.402 0 C-N-CA 122.359 2.039 . . . . 0.0 111.471 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.427 ' OD1' ' N ' ' A' ' 54' ' ' ASP . 1.2 m-20 65.89 -126.73 0.29 Allowed 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 -178.508 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.614 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 0.7 OUTLIER -170.43 -37.44 0.0 OUTLIER Pre-proline 0 N--CA 1.488 1.442 0 O-C-N 120.614 -1.304 . . . . 0.0 111.972 -179.904 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.614 ' CD ' ' H ' ' A' ' 55' ' ' SER . 86.8 Cg_exo -54.02 48.56 0.03 OUTLIER 'Trans proline' 0 N--CA 1.504 2.118 0 C-N-CA 122.756 2.304 . . . . 0.0 113.606 -179.337 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.608 ' N ' ' O ' ' A' ' 55' ' ' SER . 1.2 mp0 45.58 29.71 0.67 Allowed 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 -179.15 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.447 ' O ' ' N ' ' A' ' 61' ' ' PHE . 7.6 mtm 63.73 -6.59 0.23 Allowed 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -178.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.593 ' H ' ' C ' ' A' ' 57' ' ' GLU . 0.0 OUTLIER -48.37 -39.23 21.57 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 122.065 0.936 . . . . 0.0 108.921 178.929 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.42 -21.32 64.01 Favored 'General case' 0 C--N 1.289 -2.05 0 O-C-N 121.365 -0.834 . . . . 0.0 108.868 -179.318 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.447 ' N ' ' O ' ' A' ' 58' ' ' MET . 3.0 t80 -74.94 -54.35 7.37 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.296 -0.877 . . . . 0.0 109.632 179.031 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.429 ' NH2' ' NE2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -65.4 -33.82 76.85 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.994 -1.066 . . . . 0.0 108.791 179.838 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . 0.427 ' O ' ' N ' ' A' ' 67' ' ' ILE . 1.9 t60 -58.15 -38.91 77.52 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.83 -31.84 82.26 Favored Glycine 0 N--CA 1.483 1.823 0 N-CA-C 108.309 -1.917 . . . . 0.0 108.309 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 -82.39 -39.27 22.94 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.316 -1.108 . . . . 0.0 108.145 178.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -70.45 -47.04 62.58 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 178.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.427 ' N ' ' O ' ' A' ' 63' ' ' HIS . 4.7 mm -55.38 -42.57 67.77 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.357 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 178.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 11.7 tp -57.39 -46.23 83.67 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 179.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.42 ' O ' ' CB ' ' A' ' 73' ' ' ASP . 37.7 t -59.99 -12.91 4.59 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.472 0 O-C-N 121.098 -1.001 . . . . 0.0 108.659 179.176 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -77.4 -44.03 14.26 Favored Glycine 0 N--CA 1.487 2.067 0 C-N-CA 119.812 -1.185 . . . . 0.0 110.597 -179.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.448 ' C ' ' CD ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -76.48 -37.81 56.26 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.889 -1.359 . . . . 0.0 107.555 179.528 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 51.9 mt -68.05 -29.48 44.83 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 N-CA-C 107.015 -1.476 . . . . 0.0 107.015 177.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.664 ' CB ' HH21 ' A' ' 34' ' ' ARG . 0.0 OUTLIER -63.17 -51.65 65.56 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.441 -0.787 . . . . 0.0 109.527 179.777 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -64.18 -32.01 73.43 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.106 -0.996 . . . . 0.0 109.787 -179.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.1 -37.76 64.05 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 120.741 -1.224 . . . . 0.0 108.814 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.95 -27.98 47.77 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 178.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.2 tptt -69.66 -47.23 64.05 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-O 121.667 0.746 . . . . 0.0 109.198 178.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.1 mp -58.69 -32.03 68.77 Favored 'General case' 0 C--N 1.306 -1.294 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.46 -52.83 50.24 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.462 HD21 ' HG2' ' A' ' 27' ' ' LYS . 2.0 t-20 . . . . . 0 N--CA 1.488 1.426 0 O-C-N 121.54 -0.725 . . . . 0.0 . -178.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.214 -0.78 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 98.27 15.22 36.18 Favored Glycine 0 N--CA 1.499 2.896 0 O-C-N 121.189 -0.944 . . . . 0.0 110.796 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 33.9 mmtt -98.57 84.21 3.13 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.071 -1.252 . . . . 0.0 108.675 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 53.6 t -75.33 -63.9 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 -179.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.425 ' HD3' ' H ' ' A' ' 85' ' ' LYS . 0.8 OUTLIER -47.88 -37.31 13.81 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.499 -0.75 . . . . 0.0 109.065 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -68.37 -44.18 75.75 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 178.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.52 -47.01 68.08 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.948 0.88 . . . . 0.0 109.046 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.26 -54.14 48.9 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -56.19 -41.58 75.75 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.069 -1.02 . . . . 0.0 108.906 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.576 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -61.25 -35.85 78.37 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 178.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -47.53 -43.69 25.1 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.059 -1.026 . . . . 0.0 108.717 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -63.1 -26.82 69.0 Favored 'General case' 0 N--CA 1.485 1.313 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 178.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.654 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -72.48 -38.99 68.05 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 106.492 -1.67 . . . . 0.0 106.492 177.615 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 11.1 mp -65.74 -40.48 92.16 Favored 'General case' 0 C--N 1.307 -1.264 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 3.9 mtpt -55.06 -38.24 67.77 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 178.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 6.8 m -69.3 -30.74 68.88 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.477 -0.765 . . . . 0.0 108.945 178.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -60.96 -41.92 97.29 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 18.8 mt -51.6 -38.97 22.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -51.2 61.69 Favored 'General case' 0 C--N 1.302 -1.489 0 C-N-CA 119.152 -1.019 . . . . 0.0 109.057 179.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.35 -21.71 66.71 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.034 -1.042 . . . . 0.0 109.067 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.539 ' OH ' ' CE1' ' A' ' 105' ' ' TYR . 10.5 t80 -72.92 -32.89 65.61 Favored 'General case' 0 C--N 1.298 -1.674 0 N-CA-C 107.327 -1.361 . . . . 0.0 107.327 179.168 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.533 ' ND2' ' O ' ' A' ' 102' ' ' ASN . 0.3 OUTLIER -64.1 -30.48 71.55 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 178.327 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.633 ' NE2' ' N ' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -65.43 -27.21 68.37 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 104.95 -2.241 . . . . 0.0 104.95 177.931 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.633 ' N ' ' NE2' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -79.34 -47.25 16.12 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 105.414 -2.069 . . . . 0.0 105.414 176.489 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.539 ' CE1' ' OH ' ' A' ' 101' ' ' TYR . 0.6 OUTLIER -86.2 30.86 0.66 Allowed 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 177.191 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.495 2.578 0 CA-C-O 117.964 -1.465 . . . . 0.0 109.517 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 121.576 0.703 . . . . 0.0 109.678 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -85.24 -18.89 32.63 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.349 -0.844 . . . . 0.0 109.673 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 25.5 mt -88.5 -49.53 6.85 Favored 'General case' 0 C--N 1.296 -1.724 0 O-C-N 121.489 -0.757 . . . . 0.0 109.085 -179.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -62.83 -23.48 67.3 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 106.56 -1.644 . . . . 0.0 106.56 178.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.73 -53.22 9.64 Favored 'General case' 0 C--N 1.299 -1.622 0 C-N-CA 119.778 -0.769 . . . . 0.0 109.295 -179.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.586 HD21 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -53.71 -44.15 69.6 Favored 'General case' 0 N--CA 1.485 1.324 0 O-C-N 121.243 -0.911 . . . . 0.0 108.673 -179.306 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.586 ' N ' HD21 ' A' ' 6' ' ' ASN . 7.6 m95 -50.06 -54.43 20.35 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.103 -0.998 . . . . 0.0 109.241 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -53.7 -25.57 18.95 Favored 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.237 -0.914 . . . . 0.0 109.308 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.2 m -68.37 -65.06 0.75 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.073 -1.017 . . . . 0.0 110.059 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.42 ' CD2' ' H ' ' A' ' 10' ' ' LEU . 0.1 OUTLIER -60.27 -31.25 70.05 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 118.436 -1.305 . . . . 0.0 107.546 179.763 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -69.29 -55.19 11.21 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.982 -1.074 . . . . 0.0 108.487 178.636 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.428 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 42.7 t0 -61.01 -14.81 25.68 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.457 -0.777 . . . . 0.0 110.092 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -72.85 -47.62 44.61 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 178.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.416 HD11 ' HZ3' ' A' ' 95' ' ' LYS . 3.8 mt -57.07 -33.19 67.01 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.738 -178.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 6.4 ttpp -68.32 -42.86 78.74 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 118.862 -1.135 . . . . 0.0 108.563 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.556 ' O ' ' N ' ' A' ' 20' ' ' ALA . 57.3 t -57.87 -24.47 23.27 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 O-C-N 121.304 -0.873 . . . . 0.0 109.379 -179.502 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.489 ' O ' ' N ' ' A' ' 20' ' ' ALA . 12.1 mt -71.31 -72.99 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 121.165 -0.96 . . . . 0.0 110.318 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -46.72 -27.63 1.25 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.941 -1.099 . . . . 0.0 108.985 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -102.52 0.97 34.4 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 179.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.569 ' C ' ' H ' ' A' ' 22' ' ' ASN . . . -58.23 -39.36 78.86 Favored 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 178.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.5 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 9.3 m-20 59.13 -11.0 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.059 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.62 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -147.86 143.28 27.32 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.549 -1.345 . . . . 0.0 110.11 178.949 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.51 -20.58 32.35 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.779 -0.576 . . . . 0.0 111.488 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.08 -50.55 61.32 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.718 -1.239 . . . . 0.0 109.72 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.426 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 4.2 mt-30 -70.22 -19.46 63.15 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.336 -0.853 . . . . 0.0 110.597 -179.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 48.7 t -70.26 -47.27 67.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 120.883 -1.136 . . . . 0.0 108.606 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.474 ' O ' ' OG1' ' A' ' 31' ' ' THR . 8.2 mtpt -55.5 -55.66 29.3 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 106.407 -1.701 . . . . 0.0 106.407 178.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -52.99 -34.08 54.51 Favored 'General case' 0 C--N 1.298 -1.664 0 CA-C-N 114.447 -1.251 . . . . 0.0 109.758 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.61 -65.83 0.65 Allowed 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.26 -0.9 . . . . 0.0 109.54 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 53.9 mt -61.9 -18.65 60.96 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.318 -0.864 . . . . 0.0 109.972 -179.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.474 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 42.8 m -62.65 -51.31 67.74 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.055 -1.028 . . . . 0.0 109.259 179.453 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -69.74 -24.73 63.58 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.663 -0.648 . . . . 0.0 109.307 -179.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 69.1 mtp -66.43 -61.82 1.79 Allowed 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 178.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -47.67 -27.94 2.16 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.86 -66.18 0.82 Allowed 'General case' 0 N--CA 1.488 1.452 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.93 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.71 -30.33 71.34 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.898 -1.126 . . . . 0.0 110.033 -179.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.45 -43.19 93.22 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.052 -1.03 . . . . 0.0 108.502 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 28.3 mt -66.33 -22.12 66.27 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.321 -0.862 . . . . 0.0 108.758 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -83.47 -45.09 14.02 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.216 -0.927 . . . . 0.0 109.739 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.405 ' O ' ' CB ' ' A' ' 43' ' ' ALA . . . -55.2 -22.54 18.02 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.154 -0.966 . . . . 0.0 108.987 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.428 ' C ' ' H ' ' A' ' 43' ' ' ALA . 1.7 tm0? -48.28 -51.34 26.24 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.312 -0.868 . . . . 0.0 109.937 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.418 ' HD3' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -68.89 4.0 1.71 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.166 -0.959 . . . . 0.0 109.628 -179.575 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.428 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -82.43 149.42 27.64 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.013 -1.054 . . . . 0.0 110.234 -179.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 p -151.34 69.61 8.16 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.358 -0.839 . . . . 0.0 108.778 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.444 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 50.1 Cg_exo -45.77 -38.99 18.25 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 C-N-CA 122.647 2.232 . . . . 0.0 114.272 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.444 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 88.6 Cg_endo -98.68 -94.33 0.0 OUTLIER 'Trans proline' 0 C--N 1.318 -1.047 0 C-N-CA 122.447 2.098 . . . . 0.0 112.732 -178.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.57 117.26 0.42 Allowed 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 -179.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.1 tt -81.77 0.91 37.0 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 120.953 -1.092 . . . . 0.0 108.721 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 66.5 mt-10 -99.07 30.59 3.36 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 177.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -147.65 -53.72 0.21 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.65 -0.656 . . . . 0.0 110.496 -178.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -65.23 -161.03 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.071 -1.018 . . . . 0.0 109.388 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 28.1 t -73.95 120.99 84.08 Favored Pre-proline 0 N--CA 1.488 1.457 0 O-C-N 120.804 -1.185 . . . . 0.0 109.352 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -83.32 -22.92 3.72 Favored 'Trans proline' 0 N--CA 1.494 1.507 0 C-N-CA 122.201 1.934 . . . . 0.0 111.899 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.8 t0 64.63 -137.72 0.26 Allowed 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.602 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 0.2 OUTLIER -161.83 -38.92 0.0 OUTLIER Pre-proline 0 N--CA 1.495 1.806 0 O-C-N 120.339 -1.476 . . . . 0.0 112.158 -179.383 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.602 ' CD ' ' H ' ' A' ' 55' ' ' SER . 67.0 Cg_exo -49.21 70.32 0.01 OUTLIER 'Trans proline' 0 N--CA 1.503 2.085 0 C-N-CA 122.7 2.267 . . . . 0.0 114.374 -178.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.59 ' C ' ' H ' ' A' ' 59' ' ' LYS . 91.4 mt-10 39.47 32.22 0.08 Allowed 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.678 -0.639 . . . . 0.0 109.308 179.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.47 ' SD ' ' C ' ' A' ' 57' ' ' GLU . 0.9 OUTLIER 64.73 -8.7 0.21 Allowed 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 -178.46 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.59 ' H ' ' C ' ' A' ' 57' ' ' GLU . 0.6 OUTLIER -48.26 -45.56 34.65 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-O 121.916 0.865 . . . . 0.0 108.93 178.962 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.12 -28.9 27.93 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -179.457 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -74.3 -54.37 7.8 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 177.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.38 -29.06 68.69 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.494 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . 0.466 ' N ' ' O ' ' A' ' 59' ' ' LYS . 2.1 t60 -62.68 -36.75 83.93 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 178.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -63.8 -28.23 72.34 Favored Glycine 0 N--CA 1.487 2.085 0 N-CA-C 107.794 -2.122 . . . . 0.0 107.794 178.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 26.8 m-85 -81.86 -41.03 21.58 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 177.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -73.14 -45.99 53.55 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.445 ' N ' ' O ' ' A' ' 63' ' ' HIS . 19.7 mm -56.69 -48.57 80.59 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.414 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.446 ' CD1' ' C ' ' A' ' 68' ' ' LEU . 2.3 tm? -58.01 -45.04 87.52 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 179.419 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 26.3 t -60.94 -11.4 4.15 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 179.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -76.16 -42.05 25.03 Favored Glycine 0 N--CA 1.487 2.065 0 N-CA-C 109.347 -1.501 . . . . 0.0 109.347 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.504 ' O ' ' NE2' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -67.61 -29.69 69.09 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 178.63 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 46.8 mt -75.91 -32.9 24.28 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.454 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 176.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -59.35 -54.39 47.3 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 121.593 0.711 . . . . 0.0 109.423 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -63.97 -28.81 70.07 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.292 -0.88 . . . . 0.0 109.29 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.65 -32.97 66.27 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 120.807 -1.183 . . . . 0.0 108.355 179.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.77 -32.95 63.9 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 178.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.9 tptt -66.39 -45.51 79.76 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 mp -58.3 -31.72 67.78 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.91 -51.33 62.48 Favored 'General case' 0 C--N 1.3 -1.545 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 177.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.437 HD21 ' HG2' ' A' ' 27' ' ' LYS . 1.9 t-20 -73.33 -11.95 60.67 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.475 -0.766 . . . . 0.0 111.16 -179.055 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -93.79 -11.04 32.18 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 120.719 -1.238 . . . . 0.0 109.556 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.93 11.3 53.55 Favored Glycine 0 N--CA 1.498 2.769 0 N-CA-C 110.654 -0.978 . . . . 0.0 110.654 179.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 39.7 mmtt -94.65 82.13 3.92 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.952 -1.322 . . . . 0.0 108.842 179.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 43.5 t -77.38 -51.22 18.84 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.676 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 -179.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.0 mtmp? -54.15 -39.61 66.67 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.065 -1.022 . . . . 0.0 108.542 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -69.75 -40.97 75.82 Favored 'General case' 0 N--CA 1.486 1.33 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 178.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.66 -51.32 57.48 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 119.528 -0.869 . . . . 0.0 109.114 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.446 ' O ' ' CB ' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -60.08 -46.37 89.81 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 179.383 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -55.11 -34.29 63.57 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 120.957 -1.089 . . . . 0.0 108.109 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.402 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -65.97 -28.71 69.1 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 107.216 -1.402 . . . . 0.0 107.216 178.118 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.446 ' CB ' ' O ' ' A' ' 88' ' ' GLN . . . -50.52 -48.67 57.0 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 178.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.492 ' OE1' ' N ' ' A' ' 92' ' ' GLU . 14.1 mp0 -67.15 -22.1 65.79 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.292 -0.88 . . . . 0.0 109.34 178.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.66 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -71.04 -35.27 71.91 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 105.508 -2.034 . . . . 0.0 105.508 177.164 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.467 ' O ' ' N ' ' A' ' 97' ' ' THR . 7.2 mp -70.94 -39.92 72.35 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 178.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . 0.434 ' C ' ' O ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -45.54 -40.45 8.67 Favored 'General case' 0 N--CA 1.498 1.973 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 178.766 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 53.4 m -72.72 -31.32 64.89 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.707 -0.621 . . . . 0.0 109.987 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.467 ' N ' ' O ' ' A' ' 94' ' ' LEU . 1.2 m -56.85 -43.63 81.36 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 49.8 mt -54.79 -46.36 74.68 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.498 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 51.7 ttt180 -62.28 -55.0 32.65 Favored 'General case' 0 C--N 1.308 -1.21 0 O-C-N 121.184 -0.947 . . . . 0.0 110.229 -179.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.54 -28.08 69.07 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.79 -1.194 . . . . 0.0 108.698 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.458 ' CD1' ' C ' ' A' ' 101' ' ' TYR . 3.4 t80 -70.86 -30.49 66.9 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 178.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.54 ' ND2' ' O ' ' A' ' 102' ' ' ASN . 0.1 OUTLIER -64.34 -32.0 73.43 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 119.013 -1.075 . . . . 0.0 108.536 179.416 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.511 ' NE2' ' N ' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -63.99 -26.0 68.38 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 105.105 -2.183 . . . . 0.0 105.105 177.854 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.511 ' N ' ' NE2' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -84.0 -32.46 24.94 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.123 -0.944 . . . . 0.0 108.663 178.012 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.54 ' CD1' ' C ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -95.11 0.82 54.66 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.108 -0.995 . . . . 0.0 109.173 -179.266 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.51 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.494 2.509 0 CA-C-O 117.927 -1.485 . . . . 0.0 109.742 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.594 0 CA-C-O 121.523 0.677 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -83.09 -12.67 56.86 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.348 -0.845 . . . . 0.0 109.177 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 70.2 mt -87.57 -52.5 5.31 Favored 'General case' 0 C--N 1.296 -1.743 0 O-C-N 121.656 -0.653 . . . . 0.0 109.392 -178.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -62.98 -23.72 67.57 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 179.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.52 -51.87 18.11 Favored 'General case' 0 C--N 1.297 -1.709 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.529 HD21 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -50.61 -40.9 54.08 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 -179.872 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.529 ' N ' HD21 ' A' ' 6' ' ' ASN . 7.0 m95 -51.94 -52.46 50.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.198 -0.939 . . . . 0.0 108.865 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -55.98 -28.58 57.73 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 120.719 -1.238 . . . . 0.0 108.919 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 10.4 m -69.52 -64.67 0.83 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.168 -0.958 . . . . 0.0 109.986 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.6 pp -57.02 -30.8 64.51 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.65 -1.282 . . . . 0.0 107.922 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.28 -55.32 8.28 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.912 -1.118 . . . . 0.0 108.349 178.144 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -58.57 -14.15 7.43 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.501 -0.749 . . . . 0.0 109.551 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -73.12 -50.11 24.62 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 179.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.3 mt -56.86 -30.01 63.43 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.829 -0.544 . . . . 0.0 111.087 -178.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -69.11 -51.39 39.05 Favored 'General case' 0 C--N 1.3 -1.581 0 C-N-CA 118.539 -1.264 . . . . 0.0 109.727 -179.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.624 ' O ' ' N ' ' A' ' 20' ' ' ALA . 15.4 m -55.74 -20.92 9.22 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 C-N-CA 118.458 -1.297 . . . . 0.0 110.105 -179.35 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.445 ' O ' ' N ' ' A' ' 20' ' ' ALA . 11.5 mt -70.16 -73.51 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 O-C-N 120.442 -1.412 . . . . 0.0 108.947 179.085 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -46.94 -28.66 1.69 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.311 -0.868 . . . . 0.0 109.007 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.37 1.46 35.5 Favored 'General case' 0 N--CA 1.496 1.867 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.624 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -56.9 -44.11 82.02 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 107.453 -1.314 . . . . 0.0 107.453 179.473 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.48 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 0.4 OUTLIER 67.76 -15.02 0.2 Allowed 'General case' 0 C--N 1.297 -1.678 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.949 179.437 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.647 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -148.21 142.79 26.51 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.653 -1.279 . . . . 0.0 110.051 178.576 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.86 -21.22 10.71 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.987 -0.446 . . . . 0.0 111.463 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.34 -52.13 55.94 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.857 -1.152 . . . . 0.0 109.601 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.501 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 5.4 mt-30 -69.76 -18.31 63.49 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.281 -0.887 . . . . 0.0 110.425 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.6 t -70.02 -48.95 59.87 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 O-C-N 120.925 -1.109 . . . . 0.0 108.388 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.473 ' O ' ' OG1' ' A' ' 31' ' ' THR . 7.0 mtpt -56.27 -55.12 37.27 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 178.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -50.78 -37.46 42.5 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-N 114.711 -1.132 . . . . 0.0 109.45 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.73 -68.71 0.39 Allowed 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.335 -0.853 . . . . 0.0 110.042 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 95.9 mt -60.28 -20.87 60.87 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.379 -0.826 . . . . 0.0 109.696 -179.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.473 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 7.8 m -62.42 -45.64 92.2 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.096 -1.002 . . . . 0.0 108.523 179.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 40.9 mtmt -72.81 -27.16 61.8 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.764 -0.585 . . . . 0.0 109.475 -179.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 29.5 mtp -63.98 -67.93 0.39 Allowed 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 178.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 15.8 ttt-85 -47.11 -26.4 1.09 Allowed 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.67 -57.9 3.61 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 120.009 -0.676 . . . . 0.0 109.344 178.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.25 -39.93 95.99 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.111 -0.993 . . . . 0.0 110.078 -179.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.92 -39.02 71.04 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.019 -1.051 . . . . 0.0 108.891 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 26.5 mt -66.01 -33.78 76.58 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.23 -0.919 . . . . 0.0 108.937 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -86.33 -41.94 14.12 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.096 -1.003 . . . . 0.0 109.549 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.424 ' O ' ' CB ' ' A' ' 43' ' ' ALA . . . -58.84 -14.53 9.16 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.318 -0.864 . . . . 0.0 109.761 -179.674 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.487 ' C ' ' H ' ' A' ' 43' ' ' ALA . 2.2 tm0? -48.49 -51.57 26.57 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 120.963 -1.086 . . . . 0.0 109.692 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 2.1 mppt? -71.0 14.24 0.16 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.345 -0.847 . . . . 0.0 109.706 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.487 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -78.04 151.27 33.58 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.887 -1.133 . . . . 0.0 108.719 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -152.31 69.18 7.38 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.171 -0.956 . . . . 0.0 109.564 -179.392 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.442 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 33.3 Cg_exo -49.31 -40.05 43.54 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.586 2.191 . . . . 0.0 113.878 178.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.442 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 69.7 Cg_endo -95.98 -14.58 0.51 Allowed 'Trans proline' 0 N--CA 1.483 0.862 0 C-N-CA 122.467 2.111 . . . . 0.0 112.635 -178.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 43.3 mttm 71.83 101.69 0.07 Allowed 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.8 mp -84.33 22.98 1.15 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.122 -0.986 . . . . 0.0 108.791 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -107.04 26.41 10.17 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 107.416 -1.327 . . . . 0.0 107.416 178.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -144.26 -59.5 0.38 Allowed 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 -179.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -65.99 -162.96 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.585 0 O-C-N 121.325 -0.859 . . . . 0.0 108.888 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.3 t -75.11 145.12 80.14 Favored Pre-proline 0 N--CA 1.485 1.313 0 O-C-N 120.722 -1.236 . . . . 0.0 109.029 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.448 ' O ' ' CB ' ' A' ' 54' ' ' ASP . 43.4 Cg_endo -80.78 -14.57 11.19 Favored 'Trans proline' 0 N--CA 1.499 1.835 0 C-N-CA 122.719 2.28 . . . . 0.0 112.309 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.448 ' CB ' ' O ' ' A' ' 53' ' ' PRO . 10.3 t0 76.27 -143.99 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.73 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 40.4 t -162.36 -26.62 0.0 OUTLIER Pre-proline 0 N--CA 1.495 1.817 0 O-C-N 120.379 -1.451 . . . . 0.0 113.801 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.73 ' CD ' ' H ' ' A' ' 55' ' ' SER . 73.2 Cg_exo -56.43 40.91 0.04 OUTLIER 'Trans proline' 0 N--CA 1.503 2.043 0 C-N-CA 121.981 1.788 . . . . 0.0 113.021 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.578 ' N ' ' O ' ' A' ' 55' ' ' SER . 7.1 tp10 49.87 25.56 1.64 Allowed 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 -178.655 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.51 ' O ' ' N ' ' A' ' 61' ' ' PHE . 2.1 mtp 63.95 -5.08 0.32 Allowed 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 -177.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.571 ' H ' ' C ' ' A' ' 57' ' ' GLU . 0.5 OUTLIER -46.59 -50.37 17.52 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.346 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -54.03 -24.91 18.77 Favored 'General case' 0 C--N 1.297 -1.693 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.51 ' N ' ' O ' ' A' ' 58' ' ' MET . 3.8 t80 -77.25 -54.18 6.8 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 107.134 -1.432 . . . . 0.0 107.134 177.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.8 mtt-85 -62.54 -31.02 71.74 Favored 'General case' 0 N--CA 1.489 1.512 0 CA-C-O 121.328 0.585 . . . . 0.0 109.474 178.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . 0.448 ' O ' ' N ' ' A' ' 67' ' ' ILE . 1.6 t60 -59.6 -40.89 88.99 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.67 -31.32 80.51 Favored Glycine 0 C--N 1.296 -1.649 0 N-CA-C 108.702 -1.759 . . . . 0.0 108.702 179.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -81.07 -41.46 22.55 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.055 -1.262 . . . . 0.0 108.062 178.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -71.26 -46.19 61.51 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.448 ' N ' ' O ' ' A' ' 63' ' ' HIS . 5.3 mm -55.78 -44.72 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 179.28 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 5.4 tp -58.04 -52.94 63.44 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.598 -0.689 . . . . 0.0 109.756 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 46.0 t -61.08 -15.76 12.9 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 O-C-N 121.281 -0.887 . . . . 0.0 110.692 -178.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -78.19 -43.79 12.72 Favored Glycine 0 N--CA 1.49 2.236 0 C-N-CA 119.25 -1.453 . . . . 0.0 110.382 -178.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.535 ' O ' ' NE2' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -70.77 -30.8 67.38 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 120.681 -1.482 . . . . 0.0 107.429 179.47 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 27.9 mt -75.42 -30.11 21.94 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.558 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -59.87 -53.18 60.95 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 119.47 -0.892 . . . . 0.0 109.03 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.445 ' OD1' ' O ' ' A' ' 71' ' ' GLN . 0.4 OUTLIER -66.31 -32.53 73.99 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.071 -1.018 . . . . 0.0 109.297 179.909 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.44 -27.12 64.0 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 120.709 -1.245 . . . . 0.0 107.916 179.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.95 -34.15 67.75 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 105.797 -1.927 . . . . 0.0 105.797 177.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 9.2 tptt -69.73 -49.04 57.0 Favored 'General case' 0 C--N 1.305 -1.333 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.596 179.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 8.5 mp -55.1 -37.18 66.52 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.55 -50.29 71.9 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.313 -0.867 . . . . 0.0 108.902 178.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.441 HD21 ' HG2' ' A' ' 27' ' ' LYS . 1.9 t-20 -73.23 -12.37 60.84 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.504 -0.747 . . . . 0.0 111.389 -178.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -94.16 -9.57 35.96 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 120.672 -1.268 . . . . 0.0 109.58 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.67 11.29 54.0 Favored Glycine 0 N--CA 1.497 2.751 0 O-C-N 121.131 -0.981 . . . . 0.0 110.662 178.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 5.7 mmtp -94.21 83.26 4.22 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.921 -1.341 . . . . 0.0 108.464 179.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 57.9 t -77.55 -54.0 13.46 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.773 0 O-C-N 121.786 -0.571 . . . . 0.0 109.653 -179.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -53.42 -39.7 64.56 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 120.954 -1.092 . . . . 0.0 108.604 179.329 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -67.25 -42.33 84.13 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 178.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.05 -51.87 49.23 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 119.564 -0.854 . . . . 0.0 109.1 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -59.95 -48.29 82.32 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 179.585 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -55.87 -33.42 64.56 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -67.04 -27.58 67.51 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 178.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.41 ' N ' ' O ' ' A' ' 88' ' ' GLN . . . -53.06 -50.78 63.64 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 179.059 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -63.42 -24.65 67.93 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 178.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.639 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -75.23 -36.16 61.35 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 177.859 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.431 ' CD1' ' OE1' ' A' ' 71' ' ' GLN . 4.1 mp -64.78 -49.15 71.86 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 178.646 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -50.32 -42.92 53.49 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 24.4 m -71.32 -35.27 71.17 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.165 -0.96 . . . . 0.0 109.125 179.005 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.2 m -60.79 -44.89 96.24 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 179.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 86.2 mt -51.26 -37.89 18.77 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.374 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.2 tpm_? -56.27 -54.49 44.69 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-O 121.907 0.86 . . . . 0.0 109.571 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.491 ' O ' ' N ' ' A' ' 103' ' ' GLN . . . -63.37 -53.89 45.43 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 120.434 -1.416 . . . . 0.0 108.184 179.222 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.491 ' O ' ' CG ' ' A' ' 104' ' ' LYS . 0.6 OUTLIER -53.33 -21.75 6.16 Favored 'General case' 0 C--N 1.297 -1.688 0 O-C-N 120.697 -1.252 . . . . 0.0 107.724 179.366 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.543 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -65.85 -28.25 68.83 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 176.917 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.491 ' N ' ' O ' ' A' ' 100' ' ' ALA . 1.4 pp0? -61.83 -18.93 61.84 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 105.358 -2.09 . . . . 0.0 105.358 178.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.491 ' CG ' ' O ' ' A' ' 101' ' ' TYR . 0.0 OUTLIER -79.63 -28.12 40.93 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 177.476 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.485 ' O ' ' CG ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -101.96 3.5 39.04 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 107.756 -1.201 . . . . 0.0 107.756 178.544 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.488 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.491 2.351 0 N-CA-C 109.312 -1.515 . . . . 0.0 109.312 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -85.28 -20.5 29.94 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.403 -0.811 . . . . 0.0 108.964 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 48.9 mt -89.57 -49.12 6.85 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -62.64 -22.29 66.33 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 178.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -72.99 -49.54 28.4 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.618 HD21 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -50.13 -44.17 52.2 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.207 -0.933 . . . . 0.0 108.683 -179.73 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.618 ' N ' HD21 ' A' ' 6' ' ' ASN . 16.2 m95 -54.7 -49.21 71.27 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.187 -0.946 . . . . 0.0 109.367 -179.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -55.41 -29.49 58.65 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 120.875 -1.14 . . . . 0.0 109.083 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 35.4 m -69.39 -65.46 0.71 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 119.289 -0.965 . . . . 0.0 109.789 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.1 pp -58.55 -28.86 65.88 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.776 -1.202 . . . . 0.0 108.566 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -71.74 -59.7 2.61 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.932 -1.105 . . . . 0.0 109.268 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -57.25 -13.77 3.58 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.45 -0.781 . . . . 0.0 109.378 -179.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -74.25 -54.27 8.04 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 13.4 mt -55.53 -27.55 49.48 Favored 'General case' 0 N--CA 1.49 1.548 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.574 -178.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 9.0 ttpp -70.16 -46.64 64.24 Favored 'General case' 0 C--N 1.298 -1.672 0 C-N-CA 118.919 -1.112 . . . . 0.0 108.569 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.523 ' O ' ' N ' ' A' ' 20' ' ' ALA . 71.9 t -55.84 -26.69 21.06 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.579 0 O-C-N 121.415 -0.803 . . . . 0.0 109.944 -179.301 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.526 ' O ' ' N ' ' A' ' 20' ' ' ALA . 7.1 mt -71.23 -71.25 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 O-C-N 121.053 -1.03 . . . . 0.0 110.468 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -46.75 -28.78 1.63 Allowed 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.931 -1.106 . . . . 0.0 108.789 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.43 ' O ' ' OD2' ' A' ' 21' ' ' ASP . 1.0 OUTLIER -99.96 -1.47 37.07 Favored 'General case' 0 N--CA 1.498 1.928 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 179.522 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.57 ' O ' ' NE2' ' A' ' 25' ' ' GLN . . . -58.26 -59.93 4.55 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.893 -1.129 . . . . 0.0 108.299 178.713 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.43 ' OD2' ' O ' ' A' ' 19' ' ' LYS . 1.4 m-20 69.55 -7.62 0.85 Allowed 'General case' 0 C--N 1.295 -1.765 0 O-C-N 121.75 -0.594 . . . . 0.0 110.566 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.57 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -142.96 143.05 31.8 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 120.724 -1.235 . . . . 0.0 109.569 178.048 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.94 -27.78 46.08 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.714 -0.616 . . . . 0.0 111.101 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.2 -51.61 62.9 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.029 -1.044 . . . . 0.0 110.887 -178.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.57 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 9.4 mt-30 -68.37 -24.07 64.75 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 120.955 -1.091 . . . . 0.0 110.884 -178.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 49.1 t -70.78 -47.74 61.58 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.036 0 O-C-N 120.693 -1.254 . . . . 0.0 108.99 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.47 ' O ' ' OG1' ' A' ' 31' ' ' THR . 12.7 mtpt -54.91 -55.11 34.11 Favored 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 106.376 -1.712 . . . . 0.0 106.376 179.048 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.474 ' N ' ' OD1' ' A' ' 28' ' ' ASP . 2.6 m-20 -52.14 -37.99 56.13 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-N 114.33 -1.305 . . . . 0.0 109.574 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.81 -64.09 0.95 Allowed 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.357 -0.839 . . . . 0.0 110.333 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 90.0 mt -60.15 -23.37 63.87 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.165 -0.959 . . . . 0.0 109.955 -179.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.47 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 48.1 m -61.86 -46.11 90.87 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.036 -1.04 . . . . 0.0 108.93 179.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 50.5 mttm -72.26 -28.71 63.3 Favored 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.809 -0.557 . . . . 0.0 109.623 -179.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' MET . . . . . 0.416 ' C ' ' N ' ' A' ' 35' ' ' ALA . 48.6 mtp -65.36 -63.46 1.09 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.808 -1.183 . . . . 0.0 108.557 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.8 ttt-85 -50.06 -22.92 1.8 Allowed 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.416 ' N ' ' C ' ' A' ' 33' ' ' MET . . . -75.11 -58.7 3.12 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.643 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.414 ' O ' ' N ' ' A' ' 40' ' ' ALA . . . -62.89 -31.0 71.96 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.169 -0.957 . . . . 0.0 109.64 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.83 -44.12 90.85 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.165 -0.959 . . . . 0.0 108.82 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 17.2 mt -64.79 -32.24 73.83 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.366 -0.834 . . . . 0.0 109.227 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -84.69 -23.87 29.21 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.125 -0.984 . . . . 0.0 109.138 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.507 ' O ' ' N ' ' A' ' 43' ' ' ALA . . . -61.8 -34.01 75.14 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.428 -0.795 . . . . 0.0 110.348 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.533 ' C ' ' H ' ' A' ' 43' ' ' ALA . 0.8 OUTLIER -40.33 -63.06 0.67 Allowed 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.33 -0.856 . . . . 0.0 110.077 -179.885 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 67.7 mmtt -57.62 1.05 0.04 OUTLIER 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.523 -0.736 . . . . 0.0 110.459 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.533 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -84.12 145.57 28.35 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.817 -1.177 . . . . 0.0 110.842 -179.151 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 m -159.37 90.22 1.96 Allowed Pre-proline 0 N--CA 1.49 1.544 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.417 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 23.3 Cg_exo -53.57 -43.68 55.63 Favored 'Trans proline' 0 N--CA 1.49 1.297 0 C-N-CA 121.601 1.534 . . . . 0.0 112.367 -179.105 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.417 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 96.6 Cg_endo -84.96 -90.6 0.0 OUTLIER 'Trans proline' 0 C--N 1.317 -1.087 0 C-N-CA 121.372 1.382 . . . . 0.0 110.574 178.424 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.404 ' H ' ' HG2' ' A' ' 46' ' ' PRO . 2.7 pttt -176.6 122.23 0.15 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.076 -1.015 . . . . 0.0 109.829 179.276 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.452 ' C ' ' N ' ' A' ' 50' ' ' ASP . 0.7 OUTLIER -80.34 -174.71 4.73 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 178.575 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 50.74 18.83 0.53 Allowed 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.007 -1.058 . . . . 0.0 108.165 -179.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.452 ' N ' ' C ' ' A' ' 48' ' ' LEU . 33.4 m-20 -148.61 -55.0 0.19 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.733 -0.604 . . . . 0.0 110.054 -179.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.7 ptpp? -65.69 -162.59 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.537 0 O-C-N 120.974 -1.079 . . . . 0.0 109.289 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 3.7 m -79.36 115.82 55.93 Favored Pre-proline 0 N--CA 1.487 1.415 0 O-C-N 121.095 -1.003 . . . . 0.0 109.0 179.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.441 ' O ' ' CB ' ' A' ' 54' ' ' ASP . 31.1 Cg_endo -86.72 -17.22 3.38 Favored 'Trans proline' 0 N--CA 1.493 1.496 0 C-N-CA 122.356 2.038 . . . . 0.0 111.441 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.441 ' CB ' ' O ' ' A' ' 53' ' ' PRO . 6.2 t0 75.4 164.22 0.26 Allowed 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.264 -1.014 . . . . 0.0 108.264 -178.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.675 ' O ' ' N ' ' A' ' 57' ' ' GLU . 0.1 OUTLIER -80.28 -47.4 1.33 Allowed Pre-proline 0 N--CA 1.497 1.898 0 O-C-N 120.638 -1.289 . . . . 0.0 112.18 -178.405 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.6 ' O ' ' N ' ' A' ' 59' ' ' LYS . 30.2 Cg_exo -39.98 62.58 0.0 OUTLIER 'Trans proline' 0 N--CA 1.505 2.154 0 C-N-CA 123.523 2.816 . . . . 0.0 115.363 -178.356 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.675 ' N ' ' O ' ' A' ' 55' ' ' SER . 30.3 mt-10 36.63 29.08 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.038 0 CA-C-O 121.437 0.637 . . . . 0.0 109.477 179.273 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.534 ' N ' ' O ' ' A' ' 56' ' ' PRO . 0.1 OUTLIER 65.16 -8.07 0.26 Allowed 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -177.902 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.609 ' H ' ' C ' ' A' ' 57' ' ' GLU . 4.2 tmtm? -50.2 -40.79 48.26 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-O 121.704 0.764 . . . . 0.0 109.015 179.021 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -56.65 -27.31 58.27 Favored 'General case' 0 C--N 1.296 -1.724 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -179.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -73.17 -53.61 10.54 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 177.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -62.85 -32.47 73.71 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.661 179.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -61.7 -38.08 86.54 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.154 -0.966 . . . . 0.0 108.542 179.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.1 -30.67 78.42 Favored Glycine 0 N--CA 1.481 1.675 0 N-CA-C 108.381 -1.888 . . . . 0.0 108.381 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.515 ' CE2' ' NZ ' ' A' ' 104' ' ' LYS . 56.2 m-85 -84.01 -39.51 19.57 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.35 -1.088 . . . . 0.0 108.26 178.292 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -69.34 -46.4 67.14 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 178.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 5.6 mm -56.69 -38.87 59.99 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 179.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.72 -48.17 82.08 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.404 -0.81 . . . . 0.0 109.545 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 53.7 t -60.94 -17.33 15.55 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 O-C-N 121.65 -0.656 . . . . 0.0 109.632 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -78.55 -43.61 12.01 Favored Glycine 0 N--CA 1.487 2.087 0 C-N-CA 119.609 -1.281 . . . . 0.0 110.792 -178.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.462 ' NE2' ' C ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -71.7 -30.74 65.99 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.557 -1.555 . . . . 0.0 107.501 179.713 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 12.0 mt -74.01 -31.35 29.98 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 177.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -62.83 -57.52 10.57 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.252 -0.905 . . . . 0.0 110.099 -179.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -62.69 -29.2 70.47 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.132 -0.98 . . . . 0.0 109.746 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.32 -29.29 61.54 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 120.645 -1.284 . . . . 0.0 108.355 179.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.49 -33.18 65.72 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 106.171 -1.789 . . . . 0.0 106.171 178.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.4 tptt -69.03 -42.37 76.45 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.422 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 8.1 mp -59.51 -37.62 78.79 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.37 -0.831 . . . . 0.0 108.85 -178.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.4 -51.33 66.24 Favored 'General case' 0 C--N 1.298 -1.642 0 O-C-N 121.272 -0.893 . . . . 0.0 109.23 178.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.431 HD21 ' HG2' ' A' ' 27' ' ' LYS . 1.8 t-20 -72.6 -11.07 60.5 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.418 -0.802 . . . . 0.0 111.012 -178.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -95.04 -10.86 29.56 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 120.904 -1.122 . . . . 0.0 109.513 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.83 12.92 48.62 Favored Glycine 0 N--CA 1.496 2.651 0 N-CA-C 110.693 -0.963 . . . . 0.0 110.693 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp -95.22 77.43 3.46 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.971 -1.311 . . . . 0.0 108.43 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 71.2 t -75.63 -52.01 19.3 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.747 0 O-C-N 121.864 -0.523 . . . . 0.0 109.646 -179.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.7 mptt -53.74 -37.15 63.08 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.091 -1.078 . . . . 0.0 108.091 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -70.24 -42.61 72.0 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 178.334 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.65 -53.74 37.24 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 119.627 -0.829 . . . . 0.0 109.18 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.69 -46.03 90.31 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -58.62 -39.22 79.83 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.117 -0.99 . . . . 0.0 108.403 179.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.528 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -64.73 -29.58 70.56 Favored 'General case' 0 N--CA 1.485 1.31 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 178.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -49.17 -47.43 45.85 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.983 -1.073 . . . . 0.0 108.16 178.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -62.37 -27.06 68.81 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 178.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.628 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -72.64 -36.39 67.99 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 177.939 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.0 mp -65.57 -48.24 73.06 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.459 -1.312 . . . . 0.0 107.459 178.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 3.6 mtpt -52.81 -48.37 66.99 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.371 -0.83 . . . . 0.0 109.189 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 45.4 m -69.28 -34.27 74.49 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.163 -0.961 . . . . 0.0 109.674 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.449 ' HG1' ' NE2' ' A' ' 93' ' ' GLN . 3.4 m -58.52 -48.04 82.16 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 4.2 mm -50.32 -33.7 10.67 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.312 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.22 -42.05 76.62 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 179.217 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.41 -28.18 69.07 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.609 -0.682 . . . . 0.0 109.48 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -67.83 -35.66 78.99 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 179.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.544 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -61.6 -32.77 72.9 Favored 'General case' 0 C--N 1.303 -1.451 0 C-N-CA 119.052 -1.059 . . . . 0.0 108.358 179.584 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.552 ' NE2' ' N ' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -64.04 -23.45 67.34 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 105.178 -2.156 . . . . 0.0 105.178 177.846 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.552 ' N ' ' NE2' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -83.86 -33.8 24.76 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 177.577 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.538 ' CD1' ' C ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -89.98 4.77 49.13 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 120.947 -1.096 . . . . 0.0 108.55 179.39 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.395 0 CA-C-O 117.94 -1.478 . . . . 0.0 109.519 179.714 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.463 0 CA-C-O 121.252 0.548 . . . . 0.0 109.552 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -85.93 -16.45 38.41 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.427 -0.796 . . . . 0.0 109.419 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 69.2 mt -88.36 -51.94 5.47 Favored 'General case' 0 C--N 1.295 -1.762 0 O-C-N 121.608 -0.682 . . . . 0.0 109.326 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -64.47 -25.11 67.86 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -73.41 -43.4 60.55 Favored 'General case' 0 C--N 1.296 -1.741 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.565 HD21 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -57.82 -40.61 80.44 Favored 'General case' 0 C--N 1.307 -1.264 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -179.886 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.565 ' N ' HD21 ' A' ' 6' ' ' ASN . 8.2 m95 -52.67 -53.01 53.33 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.165 -0.959 . . . . 0.0 108.702 -179.347 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 51.1 tt0 -59.38 -30.84 68.71 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 120.918 -1.114 . . . . 0.0 108.434 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.3 m -67.98 -54.28 19.77 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 119.451 -0.899 . . . . 0.0 108.79 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.4 mt -58.27 -37.27 74.64 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 178.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -69.34 -60.86 2.06 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.385 -0.822 . . . . 0.0 109.809 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -55.67 -14.72 2.37 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.347 -0.846 . . . . 0.0 109.349 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -74.6 -54.62 7.11 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 107.637 -1.245 . . . . 0.0 107.637 179.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.5 mt -55.92 -22.38 25.62 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.537 -0.727 . . . . 0.0 110.312 -178.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.466 ' NZ ' ' HZ3' ' A' ' 19' ' ' LYS . 11.7 tttp -70.21 -57.61 4.72 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.068 -1.02 . . . . 0.0 109.102 179.531 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.617 ' O ' ' N ' ' A' ' 20' ' ' ALA . 14.9 m -52.68 -22.76 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 C-N-CA 118.864 -1.135 . . . . 0.0 110.316 -178.449 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 9.4 mt -70.2 -74.87 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 120.441 -1.412 . . . . 0.0 109.926 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -47.67 -28.57 2.46 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.143 -0.973 . . . . 0.0 108.724 -179.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.466 ' HZ3' ' NZ ' ' A' ' 15' ' ' LYS . 0.0 OUTLIER -103.13 4.33 36.87 Favored 'General case' 0 N--CA 1.495 1.809 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.836 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.617 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -57.65 -38.45 75.09 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 179.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.529 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 0.6 OUTLIER 63.57 -17.6 0.06 Allowed 'General case' 0 N--CA 1.494 1.753 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.225 179.744 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.63 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -146.6 144.23 29.4 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.749 -1.219 . . . . 0.0 109.787 179.773 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -56.06 -15.75 4.04 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.721 -0.612 . . . . 0.0 110.106 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.51 -55.54 13.13 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.215 -0.928 . . . . 0.0 109.568 -179.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -68.34 -19.04 64.63 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.557 -0.714 . . . . 0.0 110.609 -179.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 47.5 t -70.8 -46.71 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 O-C-N 120.936 -1.102 . . . . 0.0 108.589 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.467 ' O ' ' OG1' ' A' ' 31' ' ' THR . 14.0 mtpt -55.58 -56.74 16.78 Favored 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 178.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -51.8 -34.14 38.64 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-N 114.403 -1.271 . . . . 0.0 109.64 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.84 -69.66 0.33 Allowed 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.289 -0.882 . . . . 0.0 110.32 -179.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 93.0 mt -57.1 -19.99 22.79 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.52 -0.738 . . . . 0.0 109.414 -178.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.467 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 39.4 m -64.17 -40.76 96.81 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 178.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 58.2 mttt -73.94 -32.07 63.33 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 36.8 mtp -66.67 -69.09 0.33 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 120.988 -1.07 . . . . 0.0 108.74 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.3 ttt-85 -45.9 -29.18 1.31 Allowed 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.32 -64.76 0.95 Allowed 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 120.049 -0.66 . . . . 0.0 109.843 179.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.66 -33.17 73.5 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.043 -1.036 . . . . 0.0 109.224 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.25 -38.07 82.36 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 179.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.5 mt -65.68 -26.32 67.73 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 179.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 61.0 t0 -84.66 -37.42 21.05 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.12 -0.987 . . . . 0.0 110.041 -179.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.563 ' O ' ' N ' ' A' ' 42' ' ' LYS . . . -58.46 -69.34 0.19 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.07 -1.019 . . . . 0.0 109.607 -179.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.639 ' C ' ' H ' ' A' ' 43' ' ' ALA . 0.0 OUTLIER 11.78 -78.42 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.606 0 CA-C-O 121.702 0.763 . . . . 0.0 111.354 -179.581 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.563 ' N ' ' O ' ' A' ' 40' ' ' ALA . 44.7 mmtt -56.26 13.0 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.926 -0.483 . . . . 0.0 110.682 179.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.639 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -75.42 148.38 39.18 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.432 -1.418 . . . . 0.0 110.236 -178.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -153.58 76.51 6.11 Favored Pre-proline 0 N--CA 1.492 1.648 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.421 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 46.9 Cg_exo -49.67 -39.79 46.89 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.537 2.158 . . . . 0.0 113.89 179.781 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.421 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 88.6 Cg_endo -93.1 -93.72 0.0 OUTLIER 'Trans proline' 0 C--N 1.32 -0.967 0 C-N-CA 121.848 1.699 . . . . 0.0 111.589 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.444 ' NZ ' ' CB ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -177.78 103.06 0.05 OUTLIER 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.157 -0.965 . . . . 0.0 110.227 179.899 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.414 ' C ' ' N ' ' A' ' 50' ' ' ASP . 0.5 OUTLIER -82.85 -175.05 5.61 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 107.019 -1.474 . . . . 0.0 107.019 178.17 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 51.35 20.38 0.95 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.796 -1.19 . . . . 0.0 108.36 -179.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.414 ' N ' ' C ' ' A' ' 48' ' ' LEU . 7.7 m-20 -143.16 -61.33 0.42 Allowed 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 7.9 ptpp? -66.64 -146.98 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 178.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 25.9 t -77.96 131.92 68.83 Favored Pre-proline 0 C--N 1.307 -1.273 0 O-C-N 120.65 -1.281 . . . . 0.0 108.279 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -80.99 -11.61 12.27 Favored 'Trans proline' 0 N--CA 1.496 1.656 0 C-N-CA 122.354 2.036 . . . . 0.0 111.468 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 69.02 -128.2 0.1 Allowed 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 -178.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.711 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 24.2 t -168.27 -28.45 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.714 0 C-N-CA 118.645 -1.222 . . . . 0.0 113.523 -179.42 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.711 ' CD ' ' H ' ' A' ' 55' ' ' SER . 73.4 Cg_exo -54.75 45.65 0.03 OUTLIER 'Trans proline' 0 N--CA 1.503 2.081 0 C-N-CA 122.277 1.985 . . . . 0.0 113.205 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.63 ' N ' ' O ' ' A' ' 55' ' ' SER . 38.6 mt-10 46.98 27.94 0.8 Allowed 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 -179.383 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 8.9 mtm 65.4 -8.25 0.28 Allowed 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 -177.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.626 ' H ' ' C ' ' A' ' 57' ' ' GLU . 1.0 OUTLIER -50.21 -46.65 54.69 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-O 121.716 0.769 . . . . 0.0 109.875 179.191 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -52.31 -17.81 1.32 Allowed 'General case' 0 C--N 1.293 -1.875 0 O-C-N 121.089 -1.007 . . . . 0.0 109.331 -178.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -74.74 -68.07 0.58 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.166 -0.959 . . . . 0.0 109.265 178.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.576 ' NH2' HE22 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -58.46 -27.11 64.09 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 -179.644 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . 0.466 ' O ' ' N ' ' A' ' 67' ' ' ILE . 3.5 t60 -60.99 -45.61 94.11 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.874 -0.788 . . . . 0.0 108.874 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -60.54 -32.09 76.9 Favored Glycine 0 N--CA 1.484 1.889 0 C-N-CA 118.89 -1.624 . . . . 0.0 109.214 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -82.0 -41.98 19.98 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.106 -1.232 . . . . 0.0 108.258 178.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 51.9 t0 -69.5 -46.41 66.64 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 179.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.466 ' N ' ' O ' ' A' ' 63' ' ' HIS . 17.7 mm -54.59 -47.08 72.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 178.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.9 tp -60.53 -47.28 86.88 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.459 -0.776 . . . . 0.0 108.964 179.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 55.3 t -62.45 -21.77 27.94 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 O-C-N 121.181 -0.949 . . . . 0.0 110.072 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -77.19 -49.4 7.5 Favored Glycine 0 N--CA 1.49 2.286 0 C-N-CA 119.686 -1.245 . . . . 0.0 110.471 -178.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.522 ' O ' ' NE2' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -67.32 -28.01 67.64 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 120.67 -1.488 . . . . 0.0 107.519 179.743 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 4.5 mt -74.58 -33.06 31.19 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.474 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 176.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -60.27 -53.79 53.49 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.527 -0.733 . . . . 0.0 109.708 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -64.14 -31.53 72.76 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.439 -0.788 . . . . 0.0 109.764 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.25 -31.56 67.69 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 120.434 -1.416 . . . . 0.0 107.801 179.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.59 -33.38 66.16 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 178.087 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 5.8 tptt -67.13 -43.52 82.2 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-O 121.724 0.773 . . . . 0.0 109.526 178.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.9 mp -59.78 -32.04 70.23 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.11 -55.22 23.56 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.587 -0.696 . . . . 0.0 109.372 178.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.404 HD21 ' HG2' ' A' ' 27' ' ' LYS . 2.7 t-20 -73.37 -10.63 59.94 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.431 -0.793 . . . . 0.0 111.494 -178.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -92.41 -10.91 36.35 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 120.791 -1.193 . . . . 0.0 109.575 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.22 12.39 51.96 Favored Glycine 0 N--CA 1.496 2.681 0 N-CA-C 110.299 -1.12 . . . . 0.0 110.299 178.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 17.3 mmtp -93.86 82.56 4.28 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.064 -1.257 . . . . 0.0 108.001 179.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 19.4 t -76.69 -60.45 2.31 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.809 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.956 -178.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.6 mptt -49.43 -38.0 27.67 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.03 -1.044 . . . . 0.0 109.084 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.516 ' OE1' ' N ' ' A' ' 86' ' ' GLU . 35.3 mp0 -68.02 -46.3 71.57 Favored 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 179.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.2 -45.51 80.55 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 119.194 -1.003 . . . . 0.0 108.971 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.94 -58.82 6.43 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 179.488 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -53.4 -37.68 62.72 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.056 -1.027 . . . . 0.0 108.805 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.581 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -63.32 -35.08 79.19 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 178.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -48.24 -41.97 29.09 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -65.43 -26.41 67.95 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 178.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.647 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -73.45 -39.91 64.6 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 177.741 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.495 ' CD1' ' OE1' ' A' ' 71' ' ' GLN . 11.3 mp -62.81 -42.89 99.91 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 107.456 -1.312 . . . . 0.0 107.456 178.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 3.6 mtpt -54.89 -47.96 73.63 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 87.0 m -69.38 -32.25 71.15 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.244 -0.91 . . . . 0.0 109.515 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.9 m -60.83 -48.12 83.25 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.094 -1.004 . . . . 0.0 108.457 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 95.9 mt -51.23 -36.71 17.07 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -53.29 -43.55 67.6 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.32 -37.03 86.06 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.351 -0.843 . . . . 0.0 109.048 179.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.458 ' CD1' ' C ' ' A' ' 101' ' ' TYR . 0.5 OUTLIER -65.95 -28.21 68.74 Favored 'General case' 0 C--N 1.297 -1.682 0 O-C-N 120.26 -1.525 . . . . 0.0 107.832 179.41 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.53 ' ND2' ' O ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -66.6 -32.1 73.22 Favored 'General case' 0 C--N 1.298 -1.636 0 C-N-CA 119.152 -1.019 . . . . 0.0 110.084 -179.541 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.498 ' NE2' ' C ' ' A' ' 103' ' ' GLN . 0.9 OUTLIER -66.84 -20.94 66.03 Favored 'General case' 0 N--CA 1.485 1.325 0 N-CA-C 104.71 -2.329 . . . . 0.0 104.71 177.999 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.487 ' CA ' HE21 ' A' ' 103' ' ' GLN . 0.0 OUTLIER -80.77 -36.37 31.96 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 177.289 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.551 ' CD1' ' C ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -94.49 6.84 47.56 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.064 -1.023 . . . . 0.0 108.475 179.335 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.503 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.49 2.3 0 CA-C-O 117.943 -1.476 . . . . 0.0 109.612 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -86.15 -17.96 33.54 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.314 -0.866 . . . . 0.0 109.186 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 43.7 mt -89.08 -49.83 6.52 Favored 'General case' 0 C--N 1.295 -1.766 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -65.32 -23.78 67.1 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 179.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -74.39 -51.86 13.78 Favored 'General case' 0 C--N 1.298 -1.658 0 C-N-CA 119.796 -0.762 . . . . 0.0 108.969 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.532 ' C ' ' ND2' ' A' ' 6' ' ' ASN . 0.0 OUTLIER -53.39 -37.6 62.62 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 -179.77 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.529 ' N ' HD21 ' A' ' 6' ' ' ASN . 11.9 m0 -53.41 -52.85 58.02 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.227 -0.921 . . . . 0.0 108.556 -179.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -56.46 -29.44 61.71 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.289 -0.882 . . . . 0.0 109.2 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 59.4 m -69.46 -63.76 1.01 Allowed 'General case' 0 N--CA 1.486 1.354 0 O-C-N 121.076 -1.015 . . . . 0.0 110.164 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.3 pp -59.05 -30.54 68.12 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 118.382 -1.327 . . . . 0.0 108.026 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -70.91 -58.16 3.87 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.94 -1.1 . . . . 0.0 108.931 178.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -58.96 -11.41 3.35 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.502 -0.749 . . . . 0.0 109.886 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -74.44 -53.24 9.93 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 107.594 -1.261 . . . . 0.0 107.594 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.16 -37.17 69.16 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.711 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.72 -40.92 84.2 Favored 'General case' 0 C--N 1.296 -1.718 0 C-N-CA 118.51 -1.276 . . . . 0.0 108.74 -179.286 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.553 ' O ' ' N ' ' A' ' 20' ' ' ALA . 69.3 t -60.25 -23.93 29.14 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 O-C-N 120.98 -1.075 . . . . 0.0 109.52 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.466 ' O ' ' N ' ' A' ' 20' ' ' ALA . 12.6 mt -70.41 -70.77 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.875 0 O-C-N 121.021 -1.049 . . . . 0.0 109.93 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -48.25 -25.18 1.42 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.12 -0.987 . . . . 0.0 108.893 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.38 -1.14 29.1 Favored 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 179.228 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.564 ' C ' ' H ' ' A' ' 22' ' ' ASN . . . -57.78 -38.13 74.92 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 107.686 -1.227 . . . . 0.0 107.686 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.505 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 8.9 m-20 58.13 -8.73 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.264 179.431 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.603 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -147.11 144.2 28.86 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 120.574 -1.329 . . . . 0.0 109.745 178.636 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.07 -22.23 37.65 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.861 -0.524 . . . . 0.0 111.016 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.8 -54.96 19.96 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.138 -0.976 . . . . 0.0 110.351 -179.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -67.35 -16.57 64.33 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.147 -0.971 . . . . 0.0 110.614 -179.035 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 48.9 t -71.11 -48.38 55.56 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.019 0 O-C-N 120.916 -1.115 . . . . 0.0 108.39 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.462 ' O ' ' OG1' ' A' ' 31' ' ' THR . 5.8 mppt? -55.59 -50.94 68.76 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 179.068 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.437 ' N ' ' OD1' ' A' ' 28' ' ' ASP . 6.2 m-20 -54.67 -39.58 68.22 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-N 114.782 -1.099 . . . . 0.0 109.654 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.77 -62.08 1.54 Allowed 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.31 -0.868 . . . . 0.0 110.284 -179.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 85.3 mt -62.95 -24.88 68.09 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.11 -0.994 . . . . 0.0 110.514 -179.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.462 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 31.6 m -60.86 -45.72 93.42 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.895 -1.128 . . . . 0.0 108.714 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 16.3 mmtm -71.44 -28.99 64.36 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-O 121.305 0.574 . . . . 0.0 109.517 -179.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' MET . . . . . 0.403 ' C ' ' N ' ' A' ' 35' ' ' ALA . 62.9 mtp -64.62 -67.66 0.42 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.153 -0.967 . . . . 0.0 108.812 178.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.473 ' O ' ' CD2' ' A' ' 38' ' ' LEU . 12.3 ttt-85 -48.72 -23.38 1.03 Allowed 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -179.323 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.403 ' N ' ' C ' ' A' ' 33' ' ' MET . . . -77.76 -58.27 3.36 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.95 -28.56 67.57 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.83 -1.169 . . . . 0.0 110.223 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -57.87 -58.77 6.92 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.98 -1.075 . . . . 0.0 108.609 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.473 ' CD2' ' O ' ' A' ' 34' ' ' ARG . 0.6 OUTLIER -62.34 -18.33 61.17 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.432 -0.793 . . . . 0.0 109.253 179.48 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -84.14 -39.15 19.8 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.773 -1.204 . . . . 0.0 108.248 178.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.47 -19.72 62.34 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.463 -0.773 . . . . 0.0 109.705 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.513 ' O ' ' N ' ' A' ' 43' ' ' ALA . 1.6 tm0? -46.43 -56.82 5.34 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.22 74.6 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.753 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.538 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.513 ' N ' ' O ' ' A' ' 41' ' ' GLN . . . -160.61 149.81 17.12 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.485 -1.384 . . . . 0.0 110.292 -179.223 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -154.91 74.35 5.66 Favored Pre-proline 0 N--CA 1.494 1.729 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.436 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 50.3 Cg_exo -46.8 -38.59 23.14 Favored 'Trans proline' 0 C--N 1.306 -1.688 0 C-N-CA 122.552 2.168 . . . . 0.0 114.315 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.436 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 73.0 Cg_endo -96.9 -92.01 0.0 OUTLIER 'Trans proline' 0 C--N 1.317 -1.111 0 C-N-CA 122.442 2.095 . . . . 0.0 112.149 -179.25 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 10.1 pttp -175.64 102.4 0.07 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.218 -0.927 . . . . 0.0 109.731 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.43 -177.34 6.46 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 178.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 52.07 22.37 1.85 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.751 -1.218 . . . . 0.0 108.291 -178.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -145.6 -56.8 0.31 Allowed 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -68.0 -163.79 0.04 OUTLIER 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.22 -0.925 . . . . 0.0 108.782 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.3 t -76.55 117.32 63.76 Favored Pre-proline 0 N--CA 1.486 1.363 0 O-C-N 120.998 -1.064 . . . . 0.0 108.948 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.615 ' C ' ' H ' ' A' ' 55' ' ' SER . 41.6 Cg_endo -83.25 -9.89 10.28 Favored 'Trans proline' 0 N--CA 1.496 1.645 0 C-N-CA 122.325 2.016 . . . . 0.0 111.494 -179.68 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.554 ' O ' ' CB ' ' A' ' 55' ' ' SER . 6.7 t0 63.14 -24.37 0.06 Allowed 'General case' 0 N--CA 1.491 1.577 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.595 -178.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.769 ' O ' ' N ' ' A' ' 57' ' ' GLU . 4.5 t 102.47 -26.44 0.0 OUTLIER Pre-proline 0 N--CA 1.52 3.029 0 N-CA-C 115.557 1.688 . . . . 0.0 115.557 177.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.55 ' O ' ' N ' ' A' ' 59' ' ' LYS . 85.7 Cg_exo -45.98 36.86 0.01 OUTLIER 'Trans proline' 0 N--CA 1.511 2.529 0 C-N-CA 122.677 2.251 . . . . 0.0 114.943 179.262 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.769 ' N ' ' O ' ' A' ' 55' ' ' SER . 25.3 tt0 50.41 23.4 1.25 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 120.426 -1.421 . . . . 0.0 107.189 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.503 ' SD ' ' O ' ' A' ' 57' ' ' GLU . 0.8 OUTLIER 66.41 -3.9 0.78 Allowed 'General case' 0 C--N 1.307 -1.282 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 -178.281 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.576 ' H ' ' C ' ' A' ' 57' ' ' GLU . 0.1 OUTLIER -52.93 -42.45 65.42 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 121.953 0.883 . . . . 0.0 109.396 179.514 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -55.39 -17.95 5.86 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 108.498 -0.926 . . . . 0.0 108.498 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.443 ' CD1' ' NZ ' ' A' ' 104' ' ' LYS . 30.8 t80 -75.11 -63.93 1.16 Allowed 'General case' 0 N--CA 1.492 1.627 0 CA-C-O 122.061 0.934 . . . . 0.0 109.44 178.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.583 ' O ' ' N ' ' A' ' 66' ' ' ASP . 0.0 OUTLIER -63.02 -31.88 73.11 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 -179.655 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . 0.476 ' O ' ' N ' ' A' ' 67' ' ' ILE . 4.8 t60 -54.84 -38.9 68.01 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -65.63 -34.7 89.72 Favored Glycine 0 C--N 1.293 -1.848 0 N-CA-C 108.137 -1.985 . . . . 0.0 108.137 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -82.98 -32.97 26.75 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.304 -1.115 . . . . 0.0 108.517 178.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.583 ' N ' ' O ' ' A' ' 62' ' ' ARG . 14.6 t0 -72.25 -44.89 62.19 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 177.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.476 ' N ' ' O ' ' A' ' 63' ' ' HIS . 5.5 mm -63.13 -35.86 73.52 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.524 0 O-C-N 121.287 -0.883 . . . . 0.0 109.094 178.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.8 tp -54.18 -61.34 2.37 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 122.153 0.978 . . . . 0.0 108.96 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.416 ' O ' ' NE ' ' A' ' 34' ' ' ARG . 31.0 m -57.87 -13.32 2.45 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.835 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.548 -178.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -78.19 -54.82 4.26 Favored Glycine 0 N--CA 1.494 2.506 0 C-N-CA 119.806 -1.188 . . . . 0.0 111.172 -179.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.446 ' O ' ' NE2' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -67.08 -29.12 68.79 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.316 -1.697 . . . . 0.0 107.9 -179.837 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 14.4 mt -71.05 -31.43 44.92 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 177.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -58.14 -52.22 66.45 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 119.205 -0.998 . . . . 0.0 109.347 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -64.4 -31.98 73.42 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.361 -0.837 . . . . 0.0 109.471 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.12 -30.22 63.47 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 120.698 -1.251 . . . . 0.0 108.389 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.81 -33.81 64.78 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 178.292 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.4 tptt -68.65 -46.54 68.89 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.33 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 8.1 mp -58.0 -33.41 68.9 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 -178.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.08 -50.07 69.82 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.35 -0.844 . . . . 0.0 108.862 178.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.426 HD21 ' HG2' ' A' ' 27' ' ' LYS . 2.1 t-20 -74.2 -13.58 60.82 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.591 -0.693 . . . . 0.0 111.447 -178.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 82.5 mt-10 -93.09 -10.43 36.05 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.602 -1.311 . . . . 0.0 110.128 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 95.57 15.62 42.79 Favored Glycine 0 N--CA 1.496 2.641 0 N-CA-C 110.264 -1.134 . . . . 0.0 110.264 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.1 mmtt -96.44 75.66 2.89 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.205 -1.173 . . . . 0.0 108.312 179.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 22.0 t -73.29 -59.32 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.778 -0.576 . . . . 0.0 109.638 -179.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.434 ' H ' ' HD2' ' A' ' 85' ' ' LYS . 0.0 OUTLIER -48.41 -35.99 13.85 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.216 -0.927 . . . . 0.0 108.517 179.378 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.526 ' OE1' ' N ' ' A' ' 86' ' ' GLU . 27.2 mp0 -71.65 -47.84 51.68 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 178.432 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.34 -42.74 98.95 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.482 ' O ' ' N ' ' A' ' 91' ' ' ALA . 0.1 OUTLIER -60.75 -61.42 2.6 Favored 'General case' 0 C--N 1.296 -1.726 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 178.654 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -49.0 -37.59 20.81 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.154 -0.966 . . . . 0.0 109.07 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.547 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -63.08 -36.56 84.0 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 178.246 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.482 ' N ' ' O ' ' A' ' 88' ' ' GLN . . . -45.96 -46.97 16.58 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.456 ' OE1' ' O ' ' A' ' 88' ' ' GLN . 2.3 mp0 -62.76 -27.18 69.11 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.14 -0.975 . . . . 0.0 108.444 178.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.686 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -72.69 -41.22 65.54 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 177.915 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.5 mp -63.44 -43.09 98.42 Favored 'General case' 0 C--N 1.305 -1.354 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 179.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 3.9 mtpt -56.27 -40.9 74.98 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.29 -0.881 . . . . 0.0 108.813 178.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 13.5 m -67.47 -31.75 72.12 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.15 -0.969 . . . . 0.0 108.868 179.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.24 -42.61 98.92 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 178.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.2 mt -53.81 -32.92 22.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.9 tpt180 -58.64 -45.4 89.38 Favored 'General case' 0 C--N 1.302 -1.496 0 C-N-CA 119.023 -1.071 . . . . 0.0 108.414 179.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.64 -24.96 67.75 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.461 -0.774 . . . . 0.0 109.18 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.408 ' O ' ' N ' ' A' ' 105' ' ' TYR . 6.2 t80 -74.72 -32.11 62.04 Favored 'General case' 0 C--N 1.297 -1.711 0 O-C-N 120.557 -1.34 . . . . 0.0 108.028 179.287 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.546 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.2 OUTLIER -65.5 -40.94 93.62 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 120.991 -1.068 . . . . 0.0 110.72 -179.096 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.629 HE21 ' N ' ' A' ' 104' ' ' LYS . 1.3 pp0? -64.87 -22.26 66.96 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 105.514 -2.032 . . . . 0.0 105.514 179.136 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.629 ' N ' HE21 ' A' ' 103' ' ' GLN . 0.0 OUTLIER -81.82 -33.31 30.82 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 176.631 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.568 ' CD1' ' C ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -90.61 3.77 53.18 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.117 -0.989 . . . . 0.0 108.59 179.7 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.491 2.342 0 CA-C-O 117.955 -1.469 . . . . 0.0 109.537 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.586 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -86.03 -19.43 30.32 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.313 -0.867 . . . . 0.0 109.278 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 15.1 mt -87.38 -51.2 6.08 Favored 'General case' 0 C--N 1.296 -1.73 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 -179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -64.36 -22.72 67.05 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -72.73 -44.78 61.24 Favored 'General case' 0 C--N 1.298 -1.657 0 C-N-CA 119.568 -0.853 . . . . 0.0 108.742 -179.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.639 HD21 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -54.83 -44.11 73.61 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 -179.856 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.639 ' N ' HD21 ' A' ' 6' ' ' ASN . 11.6 m95 -53.13 -48.08 68.18 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.556 -0.715 . . . . 0.0 109.524 -179.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -56.32 -33.0 65.17 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 120.805 -1.185 . . . . 0.0 108.163 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.3 m -68.19 -52.12 37.95 Favored 'General case' 0 C--N 1.306 -1.301 0 C-N-CA 119.185 -1.006 . . . . 0.0 108.371 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 25.9 mt -58.96 -38.84 80.0 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 178.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -68.33 -52.78 29.64 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.576 -0.849 . . . . 0.0 108.902 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -61.53 -15.39 37.88 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.599 -0.688 . . . . 0.0 109.628 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -74.94 -51.82 12.77 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 179.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.2 mt -57.61 -33.01 67.77 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-O 120.995 0.426 . . . . 0.0 111.425 -178.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -67.8 -47.62 68.58 Favored 'General case' 0 C--N 1.296 -1.754 0 O-C-N 121.066 -1.022 . . . . 0.0 108.654 -179.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.523 ' O ' ' N ' ' A' ' 20' ' ' ALA . 55.6 t -55.88 -25.49 19.01 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 C-N-CA 119.304 -0.958 . . . . 0.0 109.755 -179.1 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.487 ' O ' ' N ' ' A' ' 20' ' ' ALA . 7.2 mt -71.28 -72.48 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.181 0 O-C-N 120.936 -1.103 . . . . 0.0 110.213 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -46.8 -27.4 1.2 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.893 -1.129 . . . . 0.0 109.201 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -101.02 -4.07 28.16 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.474 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.548 ' O ' ' ND2' ' A' ' 22' ' ' ASN . . . -57.49 -54.56 45.43 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 178.525 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.465 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 39.8 m-20 66.11 -0.92 1.27 Allowed 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.007 179.084 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.593 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -144.63 142.48 30.16 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.587 -1.321 . . . . 0.0 109.19 177.55 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -56.0 -19.38 12.37 Favored 'General case' 0 C--N 1.295 -1.792 0 O-C-N 121.599 -0.688 . . . . 0.0 110.794 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -71.41 -58.89 3.1 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.176 -0.953 . . . . 0.0 111.055 -179.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.515 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 5.0 mt-30 -64.3 -17.58 63.78 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.319 -0.863 . . . . 0.0 111.281 -177.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 55.4 t -70.7 -48.06 60.27 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 120.895 -1.128 . . . . 0.0 108.479 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.485 ' O ' ' OG1' ' A' ' 31' ' ' THR . 4.1 mtpt -56.27 -51.44 68.15 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 179.267 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.473 ' N ' ' OD1' ' A' ' 28' ' ' ASP . 2.8 m-20 -52.56 -38.03 59.03 Favored 'General case' 0 C--N 1.296 -1.741 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.754 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.52 -64.36 0.88 Allowed 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 119.663 -0.815 . . . . 0.0 110.009 -179.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 18.1 mt -61.13 -24.45 66.27 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.295 -0.878 . . . . 0.0 110.126 -178.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.485 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 53.3 m -59.7 -41.11 90.01 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 178.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.0 mtpm? -72.87 -32.08 65.16 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.359 -179.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' MET . . . . . 0.409 ' C ' ' N ' ' A' ' 35' ' ' ALA . 46.8 mtp -67.16 -68.09 0.4 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.01 -1.056 . . . . 0.0 108.956 178.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 12.9 ttt-85 -45.73 -26.44 0.64 Allowed 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -179.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.409 ' N ' ' C ' ' A' ' 33' ' ' MET . . . -74.79 -66.18 0.78 Allowed 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 178.389 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.91 -27.55 68.93 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.145 -0.972 . . . . 0.0 109.819 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.03 -42.15 84.73 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.01 -1.056 . . . . 0.0 108.401 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 25.6 mt -65.57 -30.18 70.88 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -82.53 -35.72 27.01 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.175 -0.953 . . . . 0.0 109.04 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -53.73 -26.16 21.98 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.42 ' C ' ' NE2' ' A' ' 41' ' ' GLN . 0.8 OUTLIER -52.14 -46.1 65.26 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.669 -0.644 . . . . 0.0 109.764 179.383 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 4.6 mptt -68.17 3.99 1.43 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.164 -0.96 . . . . 0.0 110.09 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.402 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -80.99 144.41 31.83 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.839 -1.163 . . . . 0.0 109.337 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.7 m -154.19 67.9 5.82 Favored Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.147 -0.971 . . . . 0.0 109.932 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.419 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 22.9 Cg_exo -56.64 -42.71 62.25 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 C-N-CA 122.305 2.003 . . . . 0.0 113.527 179.043 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.419 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 65.4 Cg_endo -83.43 -14.18 8.21 Favored 'Trans proline' 0 N--CA 1.494 1.534 0 C-N-CA 121.985 1.79 . . . . 0.0 112.23 -179.231 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 24.0 mtpt 74.2 109.84 0.07 Allowed 'General case' 0 N--CA 1.498 1.955 0 CA-C-O 121.581 0.705 . . . . 0.0 109.539 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.55 ' C ' ' H ' ' A' ' 50' ' ' ASP . 1.5 tt -87.05 -48.06 8.4 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.589 -0.694 . . . . 0.0 109.791 -179.144 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -68.34 40.53 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.082 -1.011 . . . . 0.0 109.381 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.55 ' H ' ' C ' ' A' ' 48' ' ' LEU . 5.6 t0 -146.55 -70.09 0.25 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.251 -0.906 . . . . 0.0 109.598 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.403 ' O ' ' O ' ' A' ' 50' ' ' ASP . 21.9 pttp -64.28 -141.16 0.0 OUTLIER 'General case' 0 C--N 1.298 -1.664 0 O-C-N 121.351 -0.843 . . . . 0.0 108.958 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 38.5 t -74.22 133.51 78.02 Favored Pre-proline 0 N--CA 1.485 1.314 0 O-C-N 120.594 -1.317 . . . . 0.0 109.378 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.41 ' O ' ' CB ' ' A' ' 54' ' ' ASP . 31.4 Cg_endo -83.47 -16.82 6.69 Favored 'Trans proline' 0 N--CA 1.499 1.836 0 C-N-CA 122.489 2.126 . . . . 0.0 112.627 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.41 ' CB ' ' O ' ' A' ' 53' ' ' PRO . 1.0 OUTLIER 77.47 -133.85 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.611 -0.681 . . . . 0.0 109.768 -179.053 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.696 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 12.6 p -167.97 -30.02 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.581 0 O-C-N 120.745 -1.222 . . . . 0.0 113.454 -179.269 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.696 ' CD ' ' H ' ' A' ' 55' ' ' SER . 73.2 Cg_exo -55.63 41.74 0.03 OUTLIER 'Trans proline' 0 N--CA 1.503 2.065 0 C-N-CA 122.243 1.962 . . . . 0.0 113.435 -179.421 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.626 ' N ' ' O ' ' A' ' 55' ' ' SER . 13.2 tt0 50.32 23.63 1.28 Allowed 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 -179.212 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.418 ' N ' ' C ' ' A' ' 56' ' ' PRO . 1.1 mpt? 67.94 -5.78 0.8 Allowed 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 -178.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.542 ' H ' ' C ' ' A' ' 57' ' ' GLU . 0.2 OUTLIER -47.75 -51.95 20.4 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-O 121.735 0.779 . . . . 0.0 108.963 178.902 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -52.41 -25.48 10.07 Favored 'General case' 0 C--N 1.3 -1.579 0 C-N-CA 120.497 -0.481 . . . . 0.0 109.842 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -75.81 -57.1 4.08 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 178.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -61.98 -33.83 75.03 Favored 'General case' 0 C--N 1.302 -1.479 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.683 179.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . 0.444 ' O ' ' N ' ' A' ' 67' ' ' ILE . 1.3 t60 -61.34 -38.97 88.85 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.242 -0.911 . . . . 0.0 108.925 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.58 -32.04 82.89 Favored Glycine 0 N--CA 1.484 1.891 0 N-CA-C 108.874 -1.69 . . . . 0.0 108.874 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -81.34 -41.64 21.74 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.185 -1.185 . . . . 0.0 107.995 178.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -69.96 -45.38 67.54 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 179.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.444 ' N ' ' O ' ' A' ' 63' ' ' HIS . 4.6 mm -55.1 -49.86 68.38 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 178.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 14.0 tp -59.03 -41.95 89.03 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 41.7 t -60.89 -18.96 18.55 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 178.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -79.6 -46.49 7.9 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 110.567 -1.013 . . . . 0.0 110.567 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.533 ' O ' ' NE2' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -67.73 -31.26 71.07 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 120.426 -1.632 . . . . 0.0 106.943 179.506 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 14.3 mt -72.84 -32.47 40.36 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.493 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 176.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -63.18 -52.04 63.93 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.454 -0.778 . . . . 0.0 110.013 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.52 -28.53 69.71 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.166 -0.959 . . . . 0.0 109.756 -179.048 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.57 -35.28 67.91 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 120.529 -1.357 . . . . 0.0 108.038 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.1 -33.04 64.72 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 178.349 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 6.8 tptt -67.48 -46.14 73.82 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 178.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 mp -58.48 -33.6 69.97 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.92 -50.59 68.08 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.416 HD21 ' HG2' ' A' ' 27' ' ' LYS . 1.9 t-20 -74.43 -12.61 60.55 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.639 -0.663 . . . . 0.0 111.395 -178.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -93.76 -10.63 33.57 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 120.622 -1.299 . . . . 0.0 110.536 -178.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 99.31 11.14 46.11 Favored Glycine 0 N--CA 1.498 2.772 0 C-N-CA 119.92 -1.133 . . . . 0.0 110.368 179.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.4 mmtp -95.91 85.06 3.98 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.094 -1.239 . . . . 0.0 108.282 179.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 30.9 t -77.22 -59.4 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.225 -178.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.8 mptt -54.49 -37.08 64.86 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 120.771 -1.206 . . . . 0.0 109.221 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -66.93 -42.71 84.85 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 178.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.11 -49.09 68.72 Favored 'General case' 0 C--N 1.306 -1.316 0 C-N-CA 119.404 -0.918 . . . . 0.0 108.805 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.43 ' O ' ' OE1' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -61.55 -48.49 80.75 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 179.442 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -54.52 -33.11 59.38 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 120.978 -1.076 . . . . 0.0 108.419 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.514 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -66.39 -32.92 74.6 Favored 'General case' 0 C--N 1.306 -1.286 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 178.55 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -48.19 -50.32 29.54 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.485 ' OE1' ' N ' ' A' ' 92' ' ' GLU . 19.7 mp0 -60.57 -27.96 68.1 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 178.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.702 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -74.22 -40.24 62.57 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 106.896 -1.52 . . . . 0.0 106.896 178.404 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.457 ' CD1' ' OE1' ' A' ' 71' ' ' GLN . 8.7 mp -64.07 -42.19 97.06 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 179.264 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 6.2 mtpt -57.94 -44.48 86.96 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.885 -1.135 . . . . 0.0 108.256 178.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 23.9 m -66.96 -27.79 67.75 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.154 -0.967 . . . . 0.0 109.214 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.21 -40.55 96.48 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 178.435 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 69.4 mt -49.83 -39.73 15.33 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.45 -43.95 80.02 Favored 'General case' 0 C--N 1.302 -1.466 0 C-N-CA 118.31 -1.356 . . . . 0.0 108.046 179.213 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.482 ' O ' ' OE1' ' A' ' 103' ' ' GLN . . . -65.83 -27.44 68.25 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.841 0.829 . . . . 0.0 109.305 179.316 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.44 ' O ' ' N ' ' A' ' 105' ' ' TYR . 12.4 t80 -71.71 -27.89 63.32 Favored 'General case' 0 C--N 1.294 -1.821 0 O-C-N 120.384 -1.448 . . . . 0.0 107.794 179.515 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.548 ' C ' HD21 ' A' ' 102' ' ' ASN . 0.4 OUTLIER -67.39 -41.84 84.33 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.109 -0.994 . . . . 0.0 110.229 -179.65 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.553 ' C ' HE21 ' A' ' 103' ' ' GLN . 0.0 OUTLIER -62.09 -21.74 65.23 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 105.403 -2.073 . . . . 0.0 105.403 178.663 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.408 ' N ' ' NE2' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -84.48 -34.95 23.27 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 177.247 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.558 ' CD1' ' C ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -88.54 8.24 29.15 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.921 -1.112 . . . . 0.0 109.018 -179.617 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.317 0 CA-C-O 117.958 -1.468 . . . . 0.0 109.485 179.868 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 -86.16 -16.08 39.0 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.304 -0.872 . . . . 0.0 109.37 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 17.3 mt -89.07 -49.2 6.9 Favored 'General case' 0 C--N 1.295 -1.777 0 CA-C-O 121.631 0.729 . . . . 0.0 109.083 -178.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -66.86 -23.83 66.07 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 179.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -76.2 -49.91 15.92 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.851 -179.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.619 HD21 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -52.03 -42.81 63.36 Favored 'General case' 0 C--N 1.307 -1.245 0 O-C-N 121.252 -0.905 . . . . 0.0 108.695 -179.091 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.619 ' N ' HD21 ' A' ' 6' ' ' ASN . 11.0 m95 -57.61 -51.13 70.74 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.1 -1.0 . . . . 0.0 109.245 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -58.61 -30.16 67.03 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.131 -0.981 . . . . 0.0 108.726 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 46.5 m -67.96 -54.51 18.07 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 119.257 -0.977 . . . . 0.0 108.601 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.8 mt -59.05 -37.76 77.8 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 106.966 -1.494 . . . . 0.0 106.966 178.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -68.3 -55.07 13.38 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 119.725 -0.79 . . . . 0.0 109.104 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -59.05 -16.4 18.57 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.562 -0.711 . . . . 0.0 109.626 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -74.53 -53.55 9.23 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 179.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.9 mt -58.07 -30.69 66.41 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 122.011 -0.431 . . . . 0.0 111.278 -178.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.9 ttpp -69.15 -43.11 74.96 Favored 'General case' 0 C--N 1.295 -1.794 0 C-N-CA 118.622 -1.231 . . . . 0.0 108.963 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.532 ' O ' ' N ' ' A' ' 20' ' ' ALA . 53.7 t -57.93 -26.35 28.25 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.61 0 O-C-N 121.11 -0.994 . . . . 0.0 109.52 -179.498 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.489 ' O ' ' N ' ' A' ' 20' ' ' ALA . 9.6 mt -71.66 -72.25 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.084 -1.01 . . . . 0.0 110.499 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -47.12 -27.46 1.41 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.017 -1.052 . . . . 0.0 109.139 -179.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.74 2.47 30.33 Favored 'General case' 0 N--CA 1.5 2.061 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 178.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.629 ' C ' ' H ' ' A' ' 22' ' ' ASN . . . -56.66 -40.44 75.5 Favored 'General case' 0 N--CA 1.491 1.579 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 178.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.496 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 0.9 OUTLIER 57.25 -13.28 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.988 -0.445 . . . . 0.0 110.84 179.889 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.643 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -146.83 145.57 29.92 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 120.656 -1.278 . . . . 0.0 108.814 178.834 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -53.98 -35.44 61.83 Favored 'General case' 0 C--N 1.296 -1.747 0 O-C-N 121.901 -0.5 . . . . 0.0 111.761 -179.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.77 -49.36 76.84 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 120.987 -1.07 . . . . 0.0 110.671 -178.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.547 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 18.9 mt-30 -67.3 -17.68 64.87 Favored 'General case' 0 C--N 1.3 -1.551 0 O-C-N 121.038 -1.039 . . . . 0.0 110.271 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 47.2 t -73.05 -51.05 28.05 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.078 -1.014 . . . . 0.0 108.587 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.468 ' O ' ' OG1' ' A' ' 31' ' ' THR . 3.2 mppt? -54.21 -44.65 71.84 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -53.89 -38.79 65.16 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.046 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.77 -65.03 0.79 Allowed 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.483 -0.761 . . . . 0.0 110.452 -179.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 26.3 mt -61.7 -27.86 69.0 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.144 -0.972 . . . . 0.0 110.392 -178.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.468 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 33.7 m -62.25 -40.38 95.99 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 178.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 12.2 mmmt -72.39 -30.36 64.59 Favored 'General case' 0 C--N 1.296 -1.719 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.386 -179.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' MET . . . . . 0.409 ' O ' ' C ' ' A' ' 34' ' ' ARG . 48.7 mtt -63.71 -67.55 0.42 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.024 -1.048 . . . . 0.0 108.797 178.731 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.691 HH21 ' CB ' ' A' ' 73' ' ' ASP . 0.3 OUTLIER -44.01 -29.89 0.65 Allowed 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 -179.243 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.24 -59.1 2.89 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 178.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.77 -34.81 78.73 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.119 -0.988 . . . . 0.0 109.451 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.55 -38.46 71.93 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.194 -0.941 . . . . 0.0 108.697 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 11.9 mt -67.8 -29.0 68.07 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -85.11 -38.78 18.69 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.077 -1.015 . . . . 0.0 109.336 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.413 ' O ' ' CB ' ' A' ' 43' ' ' ALA . . . -56.5 -23.13 37.4 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.159 -0.963 . . . . 0.0 108.719 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.534 HE21 ' C ' ' A' ' 41' ' ' GLN . 0.6 OUTLIER -52.19 -51.55 57.42 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.264 -0.898 . . . . 0.0 108.94 179.315 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -67.04 10.11 0.16 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.406 -0.809 . . . . 0.0 109.444 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.515 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -79.37 128.71 33.67 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.878 -1.139 . . . . 0.0 108.772 179.682 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.43 ' O ' ' CG2' ' A' ' 44' ' ' THR . 12.2 t -154.56 61.93 3.4 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.335 -0.853 . . . . 0.0 109.637 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.453 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 86.4 Cg_exo -43.06 -37.31 6.36 Favored 'Trans proline' 0 C--N 1.304 -1.788 0 C-N-CA 122.716 2.277 . . . . 0.0 114.284 179.049 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.453 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 23.1 Cg_endo -93.75 -16.28 0.72 Allowed 'Trans proline' 0 N--CA 1.483 0.86 0 C-N-CA 122.566 2.177 . . . . 0.0 111.847 -179.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 21.3 mttm 80.06 98.29 0.06 Allowed 'General case' 0 N--CA 1.5 2.027 0 CA-C-O 121.25 0.547 . . . . 0.0 109.659 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -84.28 9.19 13.61 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.371 -0.831 . . . . 0.0 109.323 -179.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -99.61 27.82 5.08 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -148.87 -50.33 0.15 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.385 -0.822 . . . . 0.0 110.324 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -65.56 -160.55 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.181 -0.95 . . . . 0.0 109.377 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 20.8 t -73.13 129.99 85.4 Favored Pre-proline 0 N--CA 1.485 1.312 0 O-C-N 120.908 -1.12 . . . . 0.0 109.184 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -82.67 -9.11 11.19 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 122.64 2.227 . . . . 0.0 111.437 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 72.59 -114.48 0.05 Allowed 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 -178.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.651 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 1.4 t -167.87 -32.45 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.719 0 O-C-N 120.2 -1.563 . . . . 0.0 113.288 -179.498 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.651 ' CD ' ' H ' ' A' ' 55' ' ' SER . 68.1 Cg_exo -56.44 40.98 0.04 OUTLIER 'Trans proline' 0 N--CA 1.502 2.024 0 C-N-CA 122.068 1.845 . . . . 0.0 112.774 -179.739 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.645 ' N ' ' O ' ' A' ' 55' ' ' SER . 41.1 tt0 50.79 23.18 1.32 Allowed 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 106.999 -1.482 . . . . 0.0 106.999 -178.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.476 ' SD ' ' O ' ' A' ' 57' ' ' GLU . 0.3 OUTLIER 66.38 -3.51 0.83 Allowed 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 -178.272 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.588 ' H ' ' C ' ' A' ' 57' ' ' GLU . 0.9 OUTLIER -48.43 -48.38 37.41 Favored 'General case' 0 N--CA 1.487 1.404 0 CA-C-O 121.851 0.834 . . . . 0.0 109.424 178.984 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -51.13 -26.6 6.88 Favored 'General case' 0 C--N 1.295 -1.792 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 -179.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -77.93 -57.1 3.98 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 120.842 -1.161 . . . . 0.0 107.924 177.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.6 mtt-85 -58.44 -30.6 67.04 Favored 'General case' 0 N--CA 1.488 1.435 0 CA-C-O 121.366 0.603 . . . . 0.0 109.483 179.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . 0.465 ' O ' ' N ' ' A' ' 67' ' ' ILE . 1.8 t60 -63.65 -39.74 95.1 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.276 -0.89 . . . . 0.0 109.041 179.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -61.51 -31.92 79.32 Favored Glycine 0 N--CA 1.486 2.009 0 C-N-CA 118.737 -1.697 . . . . 0.0 109.132 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -81.8 -40.08 23.08 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.054 -1.262 . . . . 0.0 108.291 178.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -70.73 -48.62 53.55 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 178.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.465 ' N ' ' O ' ' A' ' 63' ' ' HIS . 20.5 mm -56.49 -39.06 59.42 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 15.8 tp -56.99 -44.3 82.58 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 20.3 t -63.01 -17.22 18.99 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.45 0 O-C-N 120.918 -1.114 . . . . 0.0 109.095 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -76.24 -40.91 27.75 Favored Glycine 0 N--CA 1.487 2.079 0 C-N-CA 119.859 -1.162 . . . . 0.0 111.011 -178.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.556 ' C ' HE21 ' A' ' 71' ' ' GLN . 0.0 OUTLIER -78.38 -32.67 49.02 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.998 -1.295 . . . . 0.0 107.841 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 7.0 mt -74.19 -30.45 26.98 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.679 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 177.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.691 ' CB ' HH21 ' A' ' 34' ' ' ARG . 0.0 OUTLIER -61.1 -52.57 64.36 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 119.679 -0.808 . . . . 0.0 109.528 -179.658 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -62.27 -32.11 72.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.032 -1.042 . . . . 0.0 108.978 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.46 -34.55 65.44 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 120.87 -1.144 . . . . 0.0 108.252 179.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.71 -30.34 55.64 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 106.943 -1.503 . . . . 0.0 106.943 178.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.6 tptt -70.85 -48.94 51.23 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-O 121.657 0.742 . . . . 0.0 109.66 178.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 8.1 mp -56.93 -34.66 68.19 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.62 -49.7 70.02 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.447 HD21 ' HG2' ' A' ' 27' ' ' LYS . 2.2 t-20 -73.08 -14.31 61.37 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.634 -0.666 . . . . 0.0 111.314 -179.055 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -94.55 -10.1 33.18 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.801 -1.187 . . . . 0.0 110.312 -178.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 97.38 12.6 47.84 Favored Glycine 0 N--CA 1.499 2.877 0 C-N-CA 120.237 -0.982 . . . . 0.0 110.77 178.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 14.3 mmtp -94.94 83.84 4.04 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.009 -1.289 . . . . 0.0 108.687 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 26.1 t -77.34 -56.45 7.87 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 O-C-N 121.79 -0.569 . . . . 0.0 110.009 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.418 ' H ' ' HD2' ' A' ' 85' ' ' LYS . 8.6 mptt -49.64 -39.42 35.94 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.221 -0.924 . . . . 0.0 108.648 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.547 ' OE1' ' N ' ' A' ' 86' ' ' GLU . 47.7 mp0 -70.18 -44.55 68.52 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 121.402 -0.811 . . . . 0.0 109.007 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.13 -38.91 86.38 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 119.359 -0.936 . . . . 0.0 109.338 -179.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.425 ' O ' ' N ' ' A' ' 91' ' ' ALA . 0.1 OUTLIER -61.39 -62.77 1.59 Allowed 'General case' 0 C--N 1.294 -1.825 0 CA-C-O 121.632 0.729 . . . . 0.0 109.607 179.796 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -49.76 -34.95 20.68 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.097 -1.002 . . . . 0.0 109.583 -179.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.531 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -62.03 -35.13 77.67 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 178.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.425 ' N ' ' O ' ' A' ' 88' ' ' GLN . . . -50.22 -43.43 52.78 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.027 -1.046 . . . . 0.0 108.204 178.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -62.8 -23.91 67.48 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 178.4 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.628 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -73.8 -37.92 64.77 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 106.441 -1.688 . . . . 0.0 106.441 177.87 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.29 -45.46 72.98 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -50.26 -38.99 43.63 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 107.85 -1.166 . . . . 0.0 107.85 179.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 34.7 m -72.79 -32.07 65.31 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.425 -0.797 . . . . 0.0 109.238 177.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.9 m -58.65 -46.97 85.99 Favored 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 4.3 mm -49.15 -40.91 13.76 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 179.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 10.1 ttt180 -64.5 -55.36 21.22 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 119.22 -0.992 . . . . 0.0 109.294 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.554 ' O ' ' NE2' ' A' ' 103' ' ' GLN . . . -63.4 -19.25 64.52 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.181 -0.949 . . . . 0.0 109.021 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.422 ' CD1' ' C ' ' A' ' 101' ' ' TYR . 9.1 t80 -74.56 -31.11 61.98 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 178.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.551 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -66.67 -42.36 86.7 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.998 -1.064 . . . . 0.0 110.096 -179.908 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.656 ' NE2' ' N ' ' A' ' 104' ' ' LYS . 2.0 pp0? -63.2 -15.76 57.99 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 116.808 -1.957 . . . . 0.0 105.778 179.443 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.656 ' N ' ' NE2' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -82.27 -34.19 28.84 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 106.759 -1.571 . . . . 0.0 106.759 175.572 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.527 ' CG ' ' O ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -91.76 6.36 46.28 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 179.338 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.32 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 179.63 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.551 0 CA-C-O 121.276 0.56 . . . . 0.0 109.495 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -86.57 -26.01 24.71 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.224 -0.922 . . . . 0.0 109.185 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.7 pp -88.53 -32.14 18.33 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 107.175 -1.417 . . . . 0.0 107.175 179.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -67.94 -25.1 65.29 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 105.579 -2.008 . . . . 0.0 105.579 177.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -72.95 -36.52 67.18 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.577 HD21 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -56.95 -41.28 78.0 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 179.452 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.577 ' N ' HD21 ' A' ' 6' ' ' ASN . 16.9 m95 -57.88 -46.91 84.16 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.079 -1.013 . . . . 0.0 108.841 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -63.2 -28.89 70.35 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 120.884 -1.135 . . . . 0.0 108.548 179.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 89.0 m -68.55 -62.86 1.2 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.464 -0.773 . . . . 0.0 109.733 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.2 pp -57.25 -31.3 65.41 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 118.451 -1.3 . . . . 0.0 108.181 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -70.03 -62.59 1.33 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.072 -1.018 . . . . 0.0 109.651 178.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -58.11 -11.89 2.97 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.368 -0.832 . . . . 0.0 109.79 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -72.65 -53.23 12.36 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 179.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.2 mt -56.75 -24.85 52.92 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.667 -178.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -68.67 -54.99 12.92 Favored 'General case' 0 C--N 1.301 -1.52 0 C-N-CA 118.414 -1.314 . . . . 0.0 109.166 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.636 ' O ' ' N ' ' A' ' 20' ' ' ALA . 12.5 m -55.01 -20.96 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 120.731 -1.23 . . . . 0.0 110.448 -179.048 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.498 ' O ' ' N ' ' A' ' 20' ' ' ALA . 10.6 mt -71.53 -72.88 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 O-C-N 120.373 -1.454 . . . . 0.0 109.622 179.416 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -47.71 -27.37 1.93 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.837 -1.164 . . . . 0.0 108.749 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.4 -0.19 32.94 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.636 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -57.99 -49.0 78.34 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 179.405 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.476 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 0.5 OUTLIER 67.88 -12.33 0.31 Allowed 'General case' 0 C--N 1.296 -1.742 0 O-C-N 121.772 -0.58 . . . . 0.0 109.926 179.336 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.642 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -144.84 143.8 30.8 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.946 -1.096 . . . . 0.0 109.554 178.925 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.21 -24.91 57.7 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 121.882 -0.511 . . . . 0.0 111.193 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.46 -51.61 64.92 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.073 -1.017 . . . . 0.0 109.965 -179.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.509 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 9.4 mt-30 -68.46 -17.55 64.22 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.285 -0.885 . . . . 0.0 110.548 -179.475 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 48.9 t -71.74 -50.23 40.2 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 O-C-N 120.962 -1.087 . . . . 0.0 108.661 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.439 ' HG2' HD21 ' A' ' 80' ' ' ASN . 5.1 mppt? -54.5 -53.22 57.27 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 106.954 -1.498 . . . . 0.0 106.954 179.164 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -52.36 -38.87 59.86 Favored 'General case' 0 C--N 1.296 -1.738 0 CA-C-N 114.717 -1.129 . . . . 0.0 109.453 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.58 -67.75 0.46 Allowed 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.468 -0.77 . . . . 0.0 110.433 -179.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 33.9 mt -59.16 -25.77 64.2 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.345 -0.847 . . . . 0.0 109.913 -178.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 20.8 m -61.39 -38.98 89.01 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 179.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 33.1 mttm -74.17 -31.06 62.54 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 41.2 mtp -66.65 -65.38 0.69 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.993 -1.067 . . . . 0.0 108.173 178.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 34' ' ' ARG . 18.2 ttt-85 -47.68 -25.56 1.24 Allowed 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.0 -60.12 2.41 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 119.843 -0.743 . . . . 0.0 109.025 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.78 -33.21 75.15 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.018 -1.051 . . . . 0.0 109.826 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.48 -39.73 73.72 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.087 -1.008 . . . . 0.0 108.795 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.5 mt -65.96 -32.11 73.41 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.405 -0.809 . . . . 0.0 108.878 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -86.22 -36.61 19.33 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.224 -0.922 . . . . 0.0 109.986 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.02 -22.24 62.36 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.151 -0.968 . . . . 0.0 110.461 -179.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.619 ' C ' ' H ' ' A' ' 43' ' ' ALA . 1.1 tm0? -48.84 -66.54 0.38 Allowed 'General case' 0 C--N 1.3 -1.556 0 O-C-N 120.879 -1.138 . . . . 0.0 109.335 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.557 ' NZ ' ' NE2' ' A' ' 41' ' ' GLN . 2.8 mptp? -53.96 5.04 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.625 -0.672 . . . . 0.0 110.71 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.619 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -78.48 134.47 37.32 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.607 -1.308 . . . . 0.0 109.515 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -152.18 72.1 7.74 Favored Pre-proline 0 N--CA 1.492 1.656 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.44 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 52.0 Cg_exo -46.81 -39.12 23.91 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.521 2.147 . . . . 0.0 113.905 -179.305 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.44 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 89.5 Cg_endo -97.63 -95.75 0.0 OUTLIER 'Trans proline' 0 C--N 1.319 -1.02 0 C-N-CA 122.426 2.084 . . . . 0.0 111.852 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 4.0 pttt -175.6 116.57 0.15 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.283 -0.886 . . . . 0.0 110.005 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.547 ' CD2' ' H ' ' A' ' 49' ' ' GLU . 0.4 OUTLIER -83.86 -172.66 4.28 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 178.116 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.547 ' H ' ' CD2' ' A' ' 48' ' ' LEU . 59.8 mt-10 49.27 23.3 0.79 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.76 -1.212 . . . . 0.0 108.814 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.403 ' N ' ' C ' ' A' ' 48' ' ' LEU . 4.3 m-20 -140.49 -70.5 0.38 Allowed 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.426 ' HG3' ' N ' ' A' ' 52' ' ' SER . 17.5 pttp -66.96 -121.69 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 178.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.426 ' N ' ' HG3' ' A' ' 51' ' ' LYS . 9.1 t -81.89 114.1 47.91 Favored Pre-proline 0 N--CA 1.488 1.446 0 O-C-N 120.539 -1.351 . . . . 0.0 109.581 179.134 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -90.19 -16.24 1.8 Allowed 'Trans proline' 0 N--CA 1.491 1.372 0 C-N-CA 122.452 2.101 . . . . 0.0 112.023 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 65.05 -131.6 0.27 Allowed 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 -178.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.658 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 7.5 t -170.06 -33.84 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 120.859 -1.151 . . . . 0.0 112.363 179.632 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.658 ' CD ' ' H ' ' A' ' 55' ' ' SER . 95.0 Cg_exo -51.52 59.35 0.02 OUTLIER 'Trans proline' 0 N--CA 1.505 2.178 0 C-N-CA 122.608 2.205 . . . . 0.0 114.116 -178.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.634 ' N ' ' O ' ' A' ' 55' ' ' SER . 93.5 mt-10 42.42 29.51 0.16 Allowed 'General case' 0 N--CA 1.493 1.725 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.473 ' SD ' ' C ' ' A' ' 57' ' ' GLU . 1.3 mpt? 65.27 -8.17 0.27 Allowed 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 -178.107 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.616 ' H ' ' C ' ' A' ' 57' ' ' GLU . 2.4 tmtm? -48.1 -43.27 30.77 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-O 121.804 0.811 . . . . 0.0 109.169 179.296 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -56.29 -27.08 54.23 Favored 'General case' 0 C--N 1.294 -1.834 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 -179.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -73.94 -53.14 10.78 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.5 mtt85 -61.79 -33.0 73.33 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.392 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . 0.519 ' O ' ' N ' ' A' ' 67' ' ' ILE . 0.7 OUTLIER -63.29 -35.88 81.84 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.226 -0.921 . . . . 0.0 108.704 179.594 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.34 -31.82 80.11 Favored Glycine 0 N--CA 1.485 1.915 0 N-CA-C 108.326 -1.91 . . . . 0.0 108.326 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -81.67 -38.01 26.56 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 178.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -72.14 -47.4 51.33 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.519 ' N ' ' O ' ' A' ' 63' ' ' HIS . 4.8 mm -56.2 -48.88 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 179.037 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 14.8 tp -57.41 -44.93 84.99 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.409 HG11 ' HE ' ' A' ' 34' ' ' ARG . 32.1 t -65.92 -19.93 26.49 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.366 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 178.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -77.75 -48.39 7.92 Favored Glycine 0 N--CA 1.488 2.145 0 C-N-CA 120.1 -1.047 . . . . 0.0 110.549 -178.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.546 ' C ' HE21 ' A' ' 71' ' ' GLN . 0.0 OUTLIER -71.37 -29.79 65.38 Favored 'General case' 0 C--N 1.305 -1.341 0 O-C-N 120.823 -1.398 . . . . 0.0 107.583 179.725 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 8.1 mt -75.16 -33.64 29.27 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.507 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 176.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -62.74 -58.69 6.59 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.256 -0.902 . . . . 0.0 109.332 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.72 -26.81 67.45 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.64 -31.13 63.35 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 107.821 -1.178 . . . . 0.0 107.821 178.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.07 -33.55 67.38 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 106.236 -1.764 . . . . 0.0 106.236 178.155 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.8 tptt -68.16 -48.17 66.06 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.517 179.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.5 mp -57.69 -34.95 69.97 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.21 -50.4 68.2 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 178.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.439 HD21 ' HG2' ' A' ' 27' ' ' LYS . 2.1 t-20 -73.44 -12.0 60.65 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.47 -0.769 . . . . 0.0 111.352 -179.11 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -95.12 -12.81 25.8 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.663 -1.273 . . . . 0.0 110.23 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 99.28 11.85 43.96 Favored Glycine 0 N--CA 1.495 2.607 0 C-N-CA 120.206 -0.997 . . . . 0.0 110.688 179.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.3 mmtp -93.65 78.68 4.28 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 120.887 -1.361 . . . . 0.0 108.135 179.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 26.3 t -75.91 -50.67 22.37 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.679 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.72 -179.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 6.9 mptt -53.0 -38.7 62.53 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 120.936 -1.102 . . . . 0.0 108.18 179.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.541 ' N ' ' CD ' ' A' ' 86' ' ' GLU . 4.7 mp0 -69.08 -42.95 75.52 Favored 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 178.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.5 -51.97 44.72 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 119.532 -0.867 . . . . 0.0 109.707 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.44 -49.45 77.51 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -55.0 -37.29 66.39 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.853 -1.155 . . . . 0.0 108.402 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.518 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -65.68 -31.91 73.18 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 178.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -49.87 -43.24 49.09 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 178.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -65.43 -27.51 68.57 Favored 'General case' 0 C--N 1.306 -1.285 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 178.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.629 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -73.42 -41.25 63.5 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 106.605 -1.628 . . . . 0.0 106.605 177.805 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.4 mp -67.56 -37.05 82.1 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 108.315 -0.995 . . . . 0.0 108.315 179.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 2.4 mtpt -53.89 -39.42 65.75 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 120.049 -1.657 . . . . 0.0 106.685 177.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.3 m -71.05 -26.01 62.89 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.431 ' O ' ' N ' ' A' ' 101' ' ' TYR . 1.2 m -60.84 -46.33 91.0 Favored 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 179.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 81.4 mt -51.33 -43.01 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 179.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -62.95 -56.76 14.33 Favored 'General case' 0 C--N 1.307 -1.269 0 C-N-CA 119.633 -0.827 . . . . 0.0 109.816 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.68 -21.68 66.51 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.858 -1.151 . . . . 0.0 108.828 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.629 ' CE2' ' NZ ' ' A' ' 104' ' ' LYS . 11.2 t80 -75.89 -27.46 57.72 Favored 'General case' 0 C--N 1.291 -1.938 0 O-C-N 120.351 -1.468 . . . . 0.0 107.328 178.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.538 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -67.06 -36.25 81.63 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 119.588 -0.845 . . . . 0.0 109.944 -179.762 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.601 HE21 ' N ' ' A' ' 104' ' ' LYS . 1.3 pp0? -65.32 -23.68 67.07 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 105.158 -2.164 . . . . 0.0 105.158 178.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.629 ' NZ ' ' CE2' ' A' ' 101' ' ' TYR . 0.0 OUTLIER -80.95 -30.86 35.13 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 176.601 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.549 ' CD1' ' C ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -94.84 7.74 44.96 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.186 -0.947 . . . . 0.0 108.782 179.994 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.406 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.492 2.413 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.575 0 CA-C-O 121.354 0.597 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -86.22 -20.92 27.8 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.275 -0.891 . . . . 0.0 109.296 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 60.9 mt -89.26 -48.27 7.48 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -63.64 -23.71 67.49 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 178.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -72.97 -47.37 45.97 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.539 HD21 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -53.99 -38.85 65.51 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 -179.814 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.539 ' N ' HD21 ' A' ' 6' ' ' ASN . 8.2 m95 -55.89 -55.58 30.87 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.146 -0.971 . . . . 0.0 109.621 -179.397 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -52.47 -29.8 26.62 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 120.586 -1.321 . . . . 0.0 109.689 -179.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 53.5 m -68.94 -65.38 0.71 Allowed 'General case' 0 N--CA 1.487 1.421 0 O-C-N 120.837 -1.165 . . . . 0.0 109.599 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.6 pp -57.99 -30.29 65.94 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 118.66 -1.216 . . . . 0.0 108.454 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.62 -59.94 2.49 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.862 -1.149 . . . . 0.0 109.209 178.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.5 t0 -57.38 -13.09 3.01 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.291 -0.881 . . . . 0.0 109.632 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -72.73 -52.37 15.41 Favored 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 107.166 -1.42 . . . . 0.0 107.166 179.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.6 mt -56.16 -25.9 48.33 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-O 121.058 0.456 . . . . 0.0 110.779 -179.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 25.3 ttmt -68.68 -56.16 9.08 Favored 'General case' 0 C--N 1.3 -1.55 0 C-N-CA 118.669 -1.212 . . . . 0.0 109.215 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.643 ' O ' ' N ' ' A' ' 20' ' ' ALA . 14.3 m -54.28 -20.42 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 C-N-CA 118.771 -1.172 . . . . 0.0 110.578 -178.701 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.47 ' O ' ' N ' ' A' ' 20' ' ' ALA . 9.3 mt -71.28 -72.08 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 O-C-N 120.339 -1.476 . . . . 0.0 109.093 179.212 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -48.47 -27.4 2.65 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.871 -1.143 . . . . 0.0 108.639 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -101.61 0.2 35.9 Favored 'General case' 0 N--CA 1.495 1.825 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.643 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -59.93 -43.56 94.87 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 179.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.513 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 21.6 m-20 59.46 -9.08 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.036 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.621 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -146.32 143.29 29.03 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 120.604 -1.31 . . . . 0.0 109.653 178.609 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.78 -29.71 54.89 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.679 -0.638 . . . . 0.0 111.423 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.67 -50.85 70.82 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.958 -1.089 . . . . 0.0 110.107 -178.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.499 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 6.3 mt-30 -68.7 -19.11 64.36 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.137 -0.977 . . . . 0.0 110.395 -179.582 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 43.0 t -71.95 -50.59 36.67 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 120.945 -1.097 . . . . 0.0 108.709 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.493 ' O ' ' OG1' ' A' ' 31' ' ' THR . 5.1 mtpt -54.79 -55.3 31.57 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 179.359 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -50.31 -38.36 41.19 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.85 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.56 -62.89 1.2 Allowed 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.243 -0.911 . . . . 0.0 110.05 -179.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 71.7 mt -61.46 -20.47 63.16 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.378 -0.826 . . . . 0.0 110.25 -179.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.493 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 56.7 m -61.21 -47.48 85.9 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 178.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.559 ' HZ2' ' CB ' ' A' ' 32' ' ' LYS . 0.4 OUTLIER -70.93 -25.81 62.91 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 121.807 -0.558 . . . . 0.0 109.793 -179.028 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' MET . . . . . 0.448 ' C ' ' N ' ' A' ' 35' ' ' ALA . 28.2 mtp -67.35 -66.94 0.5 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.784 -1.197 . . . . 0.0 108.905 178.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 22.0 ttt-85 -48.37 -21.58 0.55 Allowed 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.448 ' N ' ' C ' ' A' ' 33' ' ' MET . . . -75.06 -63.02 1.35 Allowed 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 178.201 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.25 -28.52 69.78 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.163 -0.961 . . . . 0.0 109.565 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.79 -41.83 87.6 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.071 -1.018 . . . . 0.0 108.648 179.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 22.7 mt -65.91 -28.62 69.08 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -85.94 -35.63 20.35 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.26 -0.9 . . . . 0.0 109.821 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.441 ' O ' ' CB ' ' A' ' 43' ' ' ALA . . . -55.64 -29.83 59.93 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.028 -1.045 . . . . 0.0 108.974 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.499 ' C ' ' H ' ' A' ' 43' ' ' ALA . 1.0 OUTLIER -48.06 -53.02 17.78 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-O 122.112 0.958 . . . . 0.0 108.546 178.824 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.6 mmmm -65.35 6.92 0.24 Allowed 'General case' 0 C--N 1.297 -1.688 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.762 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.499 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -81.66 145.56 30.5 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.827 -1.17 . . . . 0.0 110.127 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.6 p -152.05 67.91 7.19 Favored Pre-proline 0 N--CA 1.492 1.661 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.443 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 73.3 Cg_exo -42.87 -38.7 7.05 Favored 'Trans proline' 0 C--N 1.304 -1.795 0 C-N-CA 122.457 2.105 . . . . 0.0 113.376 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.443 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 94.3 Cg_endo -103.07 -98.04 0.0 OUTLIER 'Trans proline' 0 C--N 1.32 -0.935 0 C-N-CA 122.647 2.232 . . . . 0.0 111.983 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.2 102.78 0.08 Allowed 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 -179.348 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.2 tt -82.05 34.61 0.41 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.796 -1.19 . . . . 0.0 109.733 -179.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.437 ' O ' ' OD1' ' A' ' 50' ' ' ASP . 7.4 pt-20 -133.84 22.67 3.9 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 178.28 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.437 ' OD1' ' O ' ' A' ' 49' ' ' GLU . 0.4 OUTLIER -151.75 -44.76 0.11 Allowed 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -179.161 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.462 ' HG3' ' N ' ' A' ' 52' ' ' SER . 10.3 ptmm? -66.89 -152.78 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.55 -0.719 . . . . 0.0 109.543 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.462 ' N ' ' HG3' ' A' ' 51' ' ' LYS . 7.5 t -77.03 118.73 73.87 Favored Pre-proline 0 N--CA 1.485 1.315 0 O-C-N 120.787 -1.195 . . . . 0.0 109.173 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -83.54 -15.36 7.44 Favored 'Trans proline' 0 N--CA 1.493 1.477 0 C-N-CA 122.327 2.018 . . . . 0.0 111.761 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 47.9 t0 60.47 -132.84 0.79 Allowed 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 -179.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.725 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 11.7 t -165.6 -26.97 0.0 OUTLIER Pre-proline 0 N--CA 1.495 1.79 0 O-C-N 120.328 -1.483 . . . . 0.0 113.898 -179.273 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.725 ' CD ' ' H ' ' A' ' 55' ' ' SER . 62.7 Cg_exo -56.51 47.29 0.04 OUTLIER 'Trans proline' 0 N--CA 1.504 2.106 0 C-N-CA 122.204 1.936 . . . . 0.0 113.346 -179.605 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.61 ' N ' ' O ' ' A' ' 55' ' ' SER . 0.6 OUTLIER 48.64 27.5 1.52 Allowed 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 -179.005 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.498 ' SD ' ' OE2' ' A' ' 57' ' ' GLU . 1.6 mpp? 64.04 -4.75 0.35 Allowed 'General case' 0 C--N 1.308 -1.202 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -178.213 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.577 ' H ' ' C ' ' A' ' 57' ' ' GLU . 0.1 OUTLIER -48.2 -44.76 33.06 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.947 0.88 . . . . 0.0 108.668 179.009 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -56.41 -25.92 51.62 Favored 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.488 ' N ' ' O ' ' A' ' 58' ' ' MET . 15.6 t80 -76.18 -54.08 7.34 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 177.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.4 mtt85 -59.55 -30.35 68.56 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 179.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . 0.47 ' CE1' ' CD1' ' A' ' 67' ' ' ILE . 2.4 t60 -61.98 -40.97 97.44 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -62.16 -33.57 86.3 Favored Glycine 0 N--CA 1.484 1.863 0 N-CA-C 109.091 -1.604 . . . . 0.0 109.091 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -81.79 -37.9 26.42 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.012 -1.287 . . . . 0.0 108.264 178.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -71.99 -47.44 52.0 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 178.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.47 ' CD1' ' CE1' ' A' ' 63' ' ' HIS . 15.8 mm -54.55 -45.09 71.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 12.8 tp -57.81 -44.49 86.42 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 42.6 t -60.7 -15.15 10.75 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 O-C-N 121.076 -1.015 . . . . 0.0 109.265 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -79.64 -47.66 7.15 Favored Glycine 0 N--CA 1.49 2.265 0 C-N-CA 119.786 -1.197 . . . . 0.0 110.682 -179.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.526 ' O ' ' NE2' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -69.6 -29.84 67.46 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.699 -1.471 . . . . 0.0 107.532 179.894 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 4.7 mt -73.46 -34.34 42.46 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 176.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -63.28 -56.11 19.22 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.445 -0.784 . . . . 0.0 109.694 -179.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -62.2 -29.09 70.14 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.225 -0.922 . . . . 0.0 109.354 -179.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.31 -29.59 62.8 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 120.642 -1.286 . . . . 0.0 108.229 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.69 -33.84 66.84 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 106.211 -1.774 . . . . 0.0 106.211 178.161 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.1 tptt -68.4 -46.79 69.03 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.301 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.8 mp -57.4 -35.1 69.6 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.74 -50.1 70.41 Favored 'General case' 0 C--N 1.297 -1.705 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 178.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.443 HD21 ' HG2' ' A' ' 27' ' ' LYS . 1.9 t-20 -74.87 -13.07 60.51 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.494 -0.753 . . . . 0.0 111.616 -178.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -93.84 -9.23 38.04 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 120.606 -1.309 . . . . 0.0 110.205 -179.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 97.35 12.65 47.78 Favored Glycine 0 N--CA 1.499 2.854 0 O-C-N 121.032 -1.042 . . . . 0.0 110.592 178.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.4 mmtp -95.08 81.24 3.66 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.044 -1.268 . . . . 0.0 108.127 179.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 53.1 t -76.51 -61.83 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.414 -178.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.3 mtmm -49.81 -34.95 21.13 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.03 -1.044 . . . . 0.0 108.427 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.515 ' H ' ' CD ' ' A' ' 86' ' ' GLU . 29.8 mp0 -68.27 -45.8 72.17 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 178.216 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.13 -46.52 73.86 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 119.463 -0.895 . . . . 0.0 108.871 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.71 -51.88 67.9 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.24 -33.85 71.5 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 120.902 -1.124 . . . . 0.0 108.338 179.049 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -66.35 -26.95 67.52 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 178.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -56.64 -47.45 79.7 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 178.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -64.72 -22.79 67.06 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 178.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.662 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -72.93 -39.59 66.14 Favored 'General case' 0 N--CA 1.485 1.275 0 N-CA-C 106.18 -1.785 . . . . 0.0 106.18 177.908 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.433 ' CD1' ' OE1' ' A' ' 71' ' ' GLN . 3.9 mp -63.46 -50.63 68.96 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 178.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 4.5 mtpp -50.33 -42.53 52.97 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 178.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 5.3 m -70.88 -40.95 71.95 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.34 -0.85 . . . . 0.0 109.034 179.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -61.15 -40.43 93.84 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 72.9 mt -54.94 -33.15 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -59.32 -50.82 72.52 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 119.656 -0.818 . . . . 0.0 109.564 -179.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.66 -34.91 78.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.824 -1.172 . . . . 0.0 108.619 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.489 ' CD1' ' C ' ' A' ' 101' ' ' TYR . 1.1 t80 -68.09 -26.11 65.66 Favored 'General case' 0 C--N 1.293 -1.871 0 O-C-N 120.579 -1.326 . . . . 0.0 107.829 179.131 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.527 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -65.92 -34.91 79.21 Favored 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 119.162 -1.015 . . . . 0.0 110.057 -179.442 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.56 HE21 ' N ' ' A' ' 104' ' ' LYS . 1.1 pp0? -65.68 -21.83 66.58 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 104.759 -2.311 . . . . 0.0 104.759 178.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.56 ' N ' HE21 ' A' ' 103' ' ' GLN . 0.0 OUTLIER -79.5 -33.9 41.74 Favored 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 176.849 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.549 ' CD1' ' C ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -94.1 3.14 55.72 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.122 -0.986 . . . . 0.0 108.442 179.016 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.52 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.491 2.36 0 CA-C-O 118.049 -1.417 . . . . 0.0 109.625 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 . . . . . 0 N--CA 1.493 1.722 0 CA-C-O 121.649 0.737 . . . . 0.0 109.088 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 44.4 mt -88.93 -50.08 6.41 Favored 'General case' 0 C--N 1.295 -1.771 0 CA-C-O 121.556 0.694 . . . . 0.0 109.172 -179.218 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.796 ' CB ' ' CD ' ' A' ' 4' ' ' GLU . . . -65.75 -26.34 67.68 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 178.91 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -76.87 -45.14 29.35 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.701 -179.591 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.553 ' ND2' ' HB2' ' A' ' 40' ' ' ALA . 0.1 OUTLIER -52.33 -46.8 66.21 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 -179.19 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 10.8 m95 -51.73 -57.76 8.33 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 179.588 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -58.5 -29.54 66.33 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 178.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.0 m -69.03 -55.41 10.91 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 119.328 -0.949 . . . . 0.0 108.986 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.8 mt -53.68 -40.82 66.27 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 106.845 -1.539 . . . . 0.0 106.845 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -68.21 -60.94 2.09 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 120.058 -0.657 . . . . 0.0 109.678 178.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -58.59 -13.6 6.14 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.394 -0.816 . . . . 0.0 110.153 -179.156 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.411 ' ND2' ' HG2' ' A' ' 33' ' ' MET . 4.8 m-20 -75.72 -54.69 6.55 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 179.331 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.4 mt -56.37 -28.58 59.59 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.296 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.2 ttpt -71.97 -42.71 66.22 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 120.802 -1.186 . . . . 0.0 108.942 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.573 ' O ' ' N ' ' A' ' 20' ' ' ALA . 72.5 t -59.33 -24.56 28.21 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.538 0 C-N-CA 119.323 -0.951 . . . . 0.0 109.256 -179.41 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.456 ' O ' ' N ' ' A' ' 20' ' ' ALA . 10.4 mt -70.94 -72.19 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.171 -0.956 . . . . 0.0 109.669 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -46.55 -28.3 1.38 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.249 -0.907 . . . . 0.0 109.139 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.69 1.98 32.55 Favored 'General case' 0 N--CA 1.504 2.234 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 179.082 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.573 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -57.08 -47.5 80.86 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.897 -1.127 . . . . 0.0 108.011 179.273 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 67.13 -13.51 0.2 Allowed 'General case' 0 C--N 1.297 -1.711 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.728 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.49 ' H ' ' C ' ' A' ' 20' ' ' ALA . 0.4 OUTLIER -146.17 146.41 30.82 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 120.842 -1.161 . . . . 0.0 110.029 179.043 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -58.62 -24.11 60.36 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.863 -0.523 . . . . 0.0 110.966 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.3 -51.29 64.21 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.0 -1.063 . . . . 0.0 110.017 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.519 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 7.0 mt-30 -69.33 -18.31 63.8 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.194 -0.941 . . . . 0.0 110.473 -179.502 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.552 HG12 ' HB2' ' A' ' 79' ' ' ALA . 61.6 t -71.17 -49.04 51.32 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 120.887 -1.133 . . . . 0.0 108.337 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.474 ' O ' ' OG1' ' A' ' 31' ' ' THR . 8.4 mtpt -56.53 -55.26 35.99 Favored 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 106.754 -1.573 . . . . 0.0 106.754 179.024 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -51.13 -40.12 57.78 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 114.675 -1.148 . . . . 0.0 109.244 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.02 -63.33 1.08 Allowed 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.387 -0.821 . . . . 0.0 109.402 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.484 HD23 ' SD ' ' A' ' 33' ' ' MET . 86.7 mt -62.95 -24.54 67.93 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.249 -0.907 . . . . 0.0 109.68 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.474 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 53.6 m -61.19 -39.68 91.09 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.942 -1.099 . . . . 0.0 108.344 179.284 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 39.3 mtpt -74.0 -30.68 62.59 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' MET . . . . . 0.484 ' SD ' HD23 ' A' ' 30' ' ' LEU . 34.5 mtp -66.23 -73.15 0.14 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.106 -0.996 . . . . 0.0 109.293 178.868 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.693 HH21 ' CB ' ' A' ' 73' ' ' ASP . 0.0 OUTLIER -46.04 -26.47 0.74 Allowed 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -179.168 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.402 ' N ' ' C ' ' A' ' 33' ' ' MET . . . -73.42 -63.36 1.21 Allowed 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 119.896 -0.722 . . . . 0.0 109.36 179.625 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.414 ' HB1' HD21 ' A' ' 6' ' ' ASN . . . -62.43 -28.0 69.5 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.073 -1.017 . . . . 0.0 109.426 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.35 -45.51 93.21 Favored 'General case' 0 N--CA 1.487 1.421 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 14.8 mt -65.77 -24.25 66.9 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 179.288 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -83.15 -47.86 11.16 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 179.442 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.553 ' HB2' ' ND2' ' A' ' 6' ' ' ASN . . . -60.0 -9.78 3.48 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.389 -0.819 . . . . 0.0 109.465 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.478 ' NE2' ' C ' ' A' ' 41' ' ' GLN . 1.3 tm0? -50.76 -57.1 9.17 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 120.683 -1.26 . . . . 0.0 108.017 179.233 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.423 ' HD3' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -74.32 32.2 0.09 Allowed 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.785 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.458 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -77.3 137.91 39.06 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.969 -1.082 . . . . 0.0 109.992 -179.103 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.63 ' N ' ' CD ' ' A' ' 45' ' ' PRO . 12.4 t -156.91 40.05 0.1 Allowed Pre-proline 0 N--CA 1.489 1.509 0 O-C-N 121.529 -0.732 . . . . 0.0 110.188 179.059 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.63 ' CD ' ' N ' ' A' ' 44' ' ' THR . 6.0 Cg_exo -45.28 -36.01 12.08 Favored 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 122.484 2.123 . . . . 0.0 113.923 178.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.48 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 46.7 Cg_endo -95.06 -12.93 0.79 Allowed 'Trans proline' 0 C--N 1.321 -0.872 0 C-N-CA 122.497 2.131 . . . . 0.0 111.333 -178.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.497 ' O ' ' NZ ' ' A' ' 51' ' ' LYS . 10.7 mtpt 82.89 105.93 0.06 Allowed 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.494 HD21 ' CZ ' ' A' ' 61' ' ' PHE . 1.1 mt -79.59 4.38 16.09 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.361 -0.837 . . . . 0.0 108.971 -179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -98.55 18.79 15.86 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -147.0 42.59 1.13 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.801 -0.562 . . . . 0.0 110.067 -179.225 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.497 ' NZ ' ' O ' ' A' ' 47' ' ' LYS . 9.9 ptpp? -171.3 -143.07 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 108.636 -0.875 . . . . 0.0 108.636 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 28.5 t -76.74 116.28 55.38 Favored Pre-proline 0 N--CA 1.485 1.295 0 O-C-N 120.658 -1.276 . . . . 0.0 109.431 179.571 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -85.76 -12.35 6.34 Favored 'Trans proline' 0 N--CA 1.492 1.402 0 C-N-CA 122.359 2.039 . . . . 0.0 111.471 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.427 ' OD1' ' N ' ' A' ' 54' ' ' ASP . 1.2 m-20 65.89 -126.73 0.29 Allowed 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 -178.508 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.704 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 0.7 OUTLIER -170.43 -37.44 0.0 OUTLIER Pre-proline 0 N--CA 1.488 1.442 0 O-C-N 120.614 -1.304 . . . . 0.0 111.972 -179.904 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.704 ' CD ' ' H ' ' A' ' 55' ' ' SER . 86.8 Cg_exo -54.02 48.56 0.03 OUTLIER 'Trans proline' 0 N--CA 1.504 2.118 0 C-N-CA 122.756 2.304 . . . . 0.0 113.606 -179.337 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.652 ' N ' ' O ' ' A' ' 55' ' ' SER . 1.2 mp0 45.58 29.71 0.67 Allowed 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 -179.15 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.447 ' O ' ' N ' ' A' ' 61' ' ' PHE . 7.6 mtm 63.73 -6.59 0.23 Allowed 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -178.492 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.567 ' H ' ' C ' ' A' ' 57' ' ' GLU . 0.0 OUTLIER -48.37 -39.23 21.57 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 122.065 0.936 . . . . 0.0 108.921 178.929 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.42 -21.32 64.01 Favored 'General case' 0 C--N 1.289 -2.05 0 O-C-N 121.365 -0.834 . . . . 0.0 108.868 -179.318 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.494 ' CZ ' HD21 ' A' ' 48' ' ' LEU . 3.0 t80 -74.94 -54.35 7.37 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.296 -0.877 . . . . 0.0 109.632 179.031 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.452 ' CD ' ' H ' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -65.4 -33.82 76.85 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.994 -1.066 . . . . 0.0 108.791 179.838 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.427 ' O ' ' N ' ' A' ' 67' ' ' ILE . 1.9 t60 -58.15 -38.91 77.52 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.83 -31.84 82.26 Favored Glycine 0 N--CA 1.483 1.823 0 N-CA-C 108.309 -1.917 . . . . 0.0 108.309 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 -82.39 -39.27 22.94 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.316 -1.108 . . . . 0.0 108.145 178.341 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -70.45 -47.04 62.58 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 178.658 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.427 ' N ' ' O ' ' A' ' 63' ' ' HIS . 4.7 mm -55.38 -42.57 67.77 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.357 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 178.775 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 11.7 tp -57.39 -46.23 83.67 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 179.148 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.449 HG13 ' CG ' ' A' ' 34' ' ' ARG . 37.7 t -59.99 -12.91 4.59 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.472 0 O-C-N 121.098 -1.001 . . . . 0.0 108.659 179.176 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -77.4 -44.03 14.26 Favored Glycine 0 N--CA 1.487 2.067 0 C-N-CA 119.812 -1.185 . . . . 0.0 110.597 -179.071 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.448 ' CD ' ' C ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -76.48 -37.81 56.26 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.889 -1.359 . . . . 0.0 107.555 179.528 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 51.9 mt -68.05 -29.48 44.83 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 N-CA-C 107.015 -1.476 . . . . 0.0 107.015 177.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.693 ' CB ' HH21 ' A' ' 34' ' ' ARG . 0.0 OUTLIER -63.17 -51.65 65.56 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.441 -0.787 . . . . 0.0 109.527 179.777 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -64.18 -32.01 73.43 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.106 -0.996 . . . . 0.0 109.787 -179.376 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.1 -37.76 64.05 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 120.741 -1.224 . . . . 0.0 108.814 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.95 -27.98 47.77 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 178.768 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.2 tptt -69.66 -47.23 64.05 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-O 121.667 0.746 . . . . 0.0 109.198 178.148 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.1 mp -58.69 -32.03 68.77 Favored 'General case' 0 C--N 1.306 -1.294 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.552 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -65.46 -52.83 50.24 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.237 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 5.7 t30 . . . . . 0 N--CA 1.488 1.426 0 O-C-N 121.54 -0.725 . . . . 0.0 . -178.934 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.214 -0.78 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 98.27 15.22 36.18 Favored Glycine 0 N--CA 1.499 2.896 0 O-C-N 121.189 -0.944 . . . . 0.0 110.796 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 33.9 mmtt -98.57 84.21 3.13 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.071 -1.252 . . . . 0.0 108.675 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 53.6 t -75.33 -63.9 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 -179.372 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.527 ' HD3' ' H ' ' A' ' 85' ' ' LYS . 0.8 OUTLIER -47.88 -37.31 13.81 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.499 -0.75 . . . . 0.0 109.065 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -68.37 -44.18 75.75 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 178.153 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.52 -47.01 68.08 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.948 0.88 . . . . 0.0 109.046 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.528 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.8 OUTLIER -56.26 -54.14 48.9 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 179.734 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -56.19 -41.58 75.75 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.069 -1.02 . . . . 0.0 108.906 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.576 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -61.25 -35.85 78.37 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 178.597 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -47.53 -43.69 25.1 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.059 -1.026 . . . . 0.0 108.717 179.123 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -63.1 -26.82 69.0 Favored 'General case' 0 N--CA 1.485 1.313 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 178.235 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.576 ' N ' ' O ' ' A' ' 90' ' ' ALA . 1.7 tm0? -72.48 -38.99 68.05 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 106.492 -1.67 . . . . 0.0 106.492 177.615 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.464 ' N ' HD12 ' A' ' 94' ' ' LEU . 11.1 mp -65.74 -40.48 92.16 Favored 'General case' 0 C--N 1.307 -1.264 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 3.9 mtpt -55.06 -38.24 67.77 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 178.429 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 6.8 m -69.3 -30.74 68.88 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.477 -0.765 . . . . 0.0 108.945 178.755 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -60.96 -41.92 97.29 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 18.8 mt -51.6 -38.97 22.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -51.2 61.69 Favored 'General case' 0 C--N 1.302 -1.489 0 C-N-CA 119.152 -1.019 . . . . 0.0 109.057 179.346 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.35 -21.71 66.71 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.034 -1.042 . . . . 0.0 109.067 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.535 ' OH ' ' CE1' ' A' ' 105' ' ' TYR . 10.5 t80 -72.92 -32.89 65.61 Favored 'General case' 0 C--N 1.298 -1.674 0 N-CA-C 107.327 -1.361 . . . . 0.0 107.327 179.168 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.515 ' O ' ' N ' ' A' ' 106' ' ' GLY . 1.2 t30 -64.1 -30.48 71.55 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 178.327 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.491 ' OE1' ' N ' ' A' ' 104' ' ' LYS . 0.3 OUTLIER -65.43 -27.21 68.37 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 104.95 -2.241 . . . . 0.0 104.95 177.931 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.491 ' N ' ' OE1' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -79.34 -47.25 16.12 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 105.414 -2.069 . . . . 0.0 105.414 176.489 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.535 ' CE1' ' OH ' ' A' ' 101' ' ' TYR . 0.6 OUTLIER -86.2 30.86 0.66 Allowed 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 177.191 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.495 2.578 0 CA-C-O 117.964 -1.465 . . . . 0.0 109.517 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.489 0.662 . . . . 0.0 109.673 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 25.5 mt -88.5 -49.53 6.85 Favored 'General case' 0 C--N 1.296 -1.724 0 O-C-N 121.489 -0.757 . . . . 0.0 109.085 -179.028 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -62.83 -23.48 67.3 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 106.56 -1.644 . . . . 0.0 106.56 178.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.73 -53.22 9.64 Favored 'General case' 0 C--N 1.299 -1.622 0 C-N-CA 119.778 -0.769 . . . . 0.0 109.295 -179.642 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.575 HD22 ' HB2' ' A' ' 40' ' ' ALA . 0.1 OUTLIER -53.71 -44.15 69.6 Favored 'General case' 0 N--CA 1.485 1.324 0 O-C-N 121.243 -0.911 . . . . 0.0 108.673 -179.306 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 7.6 m95 -50.06 -54.43 20.35 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.103 -0.998 . . . . 0.0 109.241 -179.597 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -53.7 -25.57 18.95 Favored 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.237 -0.914 . . . . 0.0 109.308 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.2 m -68.37 -65.06 0.75 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.073 -1.017 . . . . 0.0 110.059 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.652 ' H ' HD23 ' A' ' 10' ' ' LEU . 0.1 OUTLIER -60.27 -31.25 70.05 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 118.436 -1.305 . . . . 0.0 107.546 179.763 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -69.29 -55.19 11.21 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.982 -1.074 . . . . 0.0 108.487 178.636 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.428 ' O ' ' OD1' ' A' ' 12' ' ' ASP . 42.7 t0 -61.01 -14.81 25.68 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.457 -0.777 . . . . 0.0 110.092 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.411 ' ND2' ' HG2' ' A' ' 33' ' ' MET . 3.9 m-20 -72.85 -47.62 44.61 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 178.93 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.677 HD13 ' HZ3' ' A' ' 95' ' ' LYS . 3.8 mt -57.07 -33.19 67.01 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.738 -178.87 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 6.4 ttpp -68.32 -42.86 78.74 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 118.862 -1.135 . . . . 0.0 108.563 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.556 ' O ' ' N ' ' A' ' 20' ' ' ALA . 57.3 t -57.87 -24.47 23.27 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 O-C-N 121.304 -0.873 . . . . 0.0 109.379 -179.502 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.489 ' O ' ' N ' ' A' ' 20' ' ' ALA . 12.1 mt -71.31 -72.99 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 121.165 -0.96 . . . . 0.0 110.318 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -46.72 -27.63 1.25 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.941 -1.099 . . . . 0.0 108.985 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -102.52 0.97 34.4 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 179.238 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.556 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -58.23 -39.36 78.86 Favored 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 178.755 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 59.13 -11.0 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.059 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.525 ' H ' ' C ' ' A' ' 20' ' ' ALA . 0.5 OUTLIER -147.86 143.28 27.32 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.549 -1.345 . . . . 0.0 110.11 178.949 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.51 -20.58 32.35 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.779 -0.576 . . . . 0.0 111.488 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.08 -50.55 61.32 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.718 -1.239 . . . . 0.0 109.72 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.426 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 4.2 mt-30 -70.22 -19.46 63.15 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.336 -0.853 . . . . 0.0 110.597 -179.499 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.5 HG12 ' HB2' ' A' ' 79' ' ' ALA . 48.7 t -70.26 -47.27 67.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 120.883 -1.136 . . . . 0.0 108.606 -179.778 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.4 ' O ' ' OG1' ' A' ' 31' ' ' THR . 8.2 mtpt -55.5 -55.66 29.3 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 106.407 -1.701 . . . . 0.0 106.407 178.742 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -52.99 -34.08 54.51 Favored 'General case' 0 C--N 1.298 -1.664 0 CA-C-N 114.447 -1.251 . . . . 0.0 109.758 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.61 -65.83 0.65 Allowed 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.26 -0.9 . . . . 0.0 109.54 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.736 HD23 ' SD ' ' A' ' 33' ' ' MET . 53.9 mt -61.9 -18.65 60.96 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.318 -0.864 . . . . 0.0 109.972 -179.467 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.4 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 42.8 m -62.65 -51.31 67.74 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.055 -1.028 . . . . 0.0 109.259 179.453 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -69.74 -24.73 63.58 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.663 -0.648 . . . . 0.0 109.307 -179.234 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' MET . . . . . 0.736 ' SD ' HD23 ' A' ' 30' ' ' LEU . 69.1 mtp -66.43 -61.82 1.79 Allowed 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 178.389 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.54 ' HE ' HG12 ' A' ' 69' ' ' VAL . 0.1 OUTLIER -47.67 -27.94 2.16 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 179.622 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.86 -66.18 0.82 Allowed 'General case' 0 N--CA 1.488 1.452 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.93 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.71 -30.33 71.34 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.898 -1.126 . . . . 0.0 110.033 -179.274 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.45 -43.19 93.22 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.052 -1.03 . . . . 0.0 108.502 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 28.3 mt -66.33 -22.12 66.27 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.321 -0.862 . . . . 0.0 108.758 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -83.47 -45.09 14.02 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.216 -0.927 . . . . 0.0 109.739 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.575 ' HB2' HD22 ' A' ' 6' ' ' ASN . . . -55.2 -22.54 18.02 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.154 -0.966 . . . . 0.0 108.987 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -48.28 -51.34 26.24 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.312 -0.868 . . . . 0.0 109.937 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.502 ' HD3' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -68.89 4.0 1.71 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.166 -0.959 . . . . 0.0 109.628 -179.575 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.502 ' HB3' ' O ' ' A' ' 40' ' ' ALA . . . -82.43 149.42 27.64 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.013 -1.054 . . . . 0.0 110.234 -179.572 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 p -151.34 69.61 8.16 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.358 -0.839 . . . . 0.0 108.778 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.444 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 50.1 Cg_exo -45.77 -38.99 18.25 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 C-N-CA 122.647 2.232 . . . . 0.0 114.272 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.444 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 88.6 Cg_endo -98.68 -94.33 0.0 OUTLIER 'Trans proline' 0 C--N 1.318 -1.047 0 C-N-CA 122.447 2.098 . . . . 0.0 112.732 -178.527 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.57 117.26 0.42 Allowed 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 -179.231 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.547 HD23 ' O ' ' A' ' 48' ' ' LEU . 1.1 tt -81.77 0.91 37.0 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 120.953 -1.092 . . . . 0.0 108.721 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 66.5 mt-10 -99.07 30.59 3.36 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 177.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -147.65 -53.72 0.21 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.65 -0.656 . . . . 0.0 110.496 -178.311 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -65.23 -161.03 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.071 -1.018 . . . . 0.0 109.388 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 28.1 t -73.95 120.99 84.08 Favored Pre-proline 0 N--CA 1.488 1.457 0 O-C-N 120.804 -1.185 . . . . 0.0 109.352 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -83.32 -22.92 3.72 Favored 'Trans proline' 0 N--CA 1.494 1.507 0 C-N-CA 122.201 1.934 . . . . 0.0 111.899 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.8 t0 64.63 -137.72 0.26 Allowed 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.691 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 0.2 OUTLIER -161.83 -38.92 0.0 OUTLIER Pre-proline 0 N--CA 1.495 1.806 0 O-C-N 120.339 -1.476 . . . . 0.0 112.158 -179.383 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.691 ' CD ' ' H ' ' A' ' 55' ' ' SER . 67.0 Cg_exo -49.21 70.32 0.01 OUTLIER 'Trans proline' 0 N--CA 1.503 2.085 0 C-N-CA 122.7 2.267 . . . . 0.0 114.374 -178.866 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.571 ' N ' ' O ' ' A' ' 55' ' ' SER . 91.4 mt-10 39.47 32.22 0.08 Allowed 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.678 -0.639 . . . . 0.0 109.308 179.528 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.47 ' SD ' ' C ' ' A' ' 57' ' ' GLU . 0.9 OUTLIER 64.73 -8.7 0.21 Allowed 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 -178.46 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.572 ' N ' ' O ' ' A' ' 56' ' ' PRO . 0.6 OUTLIER -48.26 -45.56 34.65 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-O 121.916 0.865 . . . . 0.0 108.93 178.962 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.12 -28.9 27.93 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -179.457 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -74.3 -54.37 7.8 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 177.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.38 -29.06 68.69 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.494 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.624 ' NE2' HD11 ' A' ' 67' ' ' ILE . 2.1 t60 -62.68 -36.75 83.93 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 178.417 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -63.8 -28.23 72.34 Favored Glycine 0 N--CA 1.487 2.085 0 N-CA-C 107.794 -2.122 . . . . 0.0 107.794 178.71 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.428 ' O ' HG23 ' A' ' 69' ' ' VAL . 26.8 m-85 -81.86 -41.03 21.58 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 177.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -73.14 -45.99 53.55 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.624 HD11 ' NE2' ' A' ' 63' ' ' HIS . 19.7 mm -56.69 -48.57 80.59 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.414 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.704 ' C ' HD13 ' A' ' 68' ' ' LEU . 2.3 tm? -58.01 -45.04 87.52 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 179.419 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.54 HG12 ' HE ' ' A' ' 34' ' ' ARG . 26.3 t -60.94 -11.4 4.15 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 179.031 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -76.16 -42.05 25.03 Favored Glycine 0 N--CA 1.487 2.065 0 N-CA-C 109.347 -1.501 . . . . 0.0 109.347 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.504 ' NE2' ' O ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -67.61 -29.69 69.09 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 178.63 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.57 HG23 HD22 ' A' ' 30' ' ' LEU . 46.8 mt -75.91 -32.9 24.28 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.454 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 176.579 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -59.35 -54.39 47.3 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 121.593 0.711 . . . . 0.0 109.423 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -63.97 -28.81 70.07 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.292 -0.88 . . . . 0.0 109.29 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.65 -32.97 66.27 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 120.807 -1.183 . . . . 0.0 108.355 179.297 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.77 -32.95 63.9 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 178.371 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.9 tptt -66.39 -45.51 79.76 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 mp -58.3 -31.72 67.78 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.5 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -64.91 -51.33 62.48 Favored 'General case' 0 C--N 1.3 -1.545 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 177.907 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -73.33 -11.95 60.67 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.475 -0.766 . . . . 0.0 111.16 -179.055 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -93.79 -11.04 32.18 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 120.719 -1.238 . . . . 0.0 109.556 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.93 11.3 53.55 Favored Glycine 0 N--CA 1.498 2.769 0 N-CA-C 110.654 -0.978 . . . . 0.0 110.654 179.075 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 39.7 mmtt -94.65 82.13 3.92 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.952 -1.322 . . . . 0.0 108.842 179.562 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 43.5 t -77.38 -51.22 18.84 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.676 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 -179.579 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.0 mtmp? -54.15 -39.61 66.67 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.065 -1.022 . . . . 0.0 108.542 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -69.75 -40.97 75.82 Favored 'General case' 0 N--CA 1.486 1.33 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 178.581 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.66 -51.32 57.48 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 119.528 -0.869 . . . . 0.0 109.114 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.547 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -60.08 -46.37 89.81 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 179.383 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -55.11 -34.29 63.57 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 120.957 -1.089 . . . . 0.0 108.109 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.402 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -65.97 -28.71 69.1 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 107.216 -1.402 . . . . 0.0 107.216 178.118 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.547 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -50.52 -48.67 57.0 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 178.895 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.492 ' OE1' ' N ' ' A' ' 92' ' ' GLU . 14.1 mp0 -67.15 -22.1 65.79 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.292 -0.88 . . . . 0.0 109.34 178.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.402 ' N ' ' O ' ' A' ' 90' ' ' ALA . 1.6 tm0? -71.04 -35.27 71.91 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 105.508 -2.034 . . . . 0.0 105.508 177.164 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.509 HD22 HD21 ' A' ' 14' ' ' LEU . 7.2 mp -70.94 -39.92 72.35 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 178.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' LYS . . . . . 0.677 ' HZ3' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -45.54 -40.45 8.67 Favored 'General case' 0 N--CA 1.498 1.973 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 178.766 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 53.4 m -72.72 -31.32 64.89 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.707 -0.621 . . . . 0.0 109.987 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.467 ' N ' ' O ' ' A' ' 94' ' ' LEU . 1.2 m -56.85 -43.63 81.36 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 49.8 mt -54.79 -46.36 74.68 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.498 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 51.7 ttt180 -62.28 -55.0 32.65 Favored 'General case' 0 C--N 1.308 -1.21 0 O-C-N 121.184 -0.947 . . . . 0.0 110.229 -179.627 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.54 -28.08 69.07 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.79 -1.194 . . . . 0.0 108.698 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.458 ' CD1' ' C ' ' A' ' 101' ' ' TYR . 3.4 t80 -70.86 -30.49 66.9 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 178.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.51 ' O ' ' N ' ' A' ' 106' ' ' GLY . 0.4 OUTLIER -64.34 -32.0 73.43 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 119.013 -1.075 . . . . 0.0 108.536 179.416 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -63.99 -26.0 68.38 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 105.105 -2.183 . . . . 0.0 105.105 177.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.0 -32.46 24.94 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.123 -0.944 . . . . 0.0 108.663 178.012 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.54 ' C ' ' CD1' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -95.11 0.82 54.66 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.108 -0.995 . . . . 0.0 109.173 -179.266 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.51 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.494 2.509 0 CA-C-O 117.927 -1.485 . . . . 0.0 109.742 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 . . . . . 0 N--CA 1.489 1.52 0 CA-C-O 121.743 0.782 . . . . 0.0 109.177 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 70.2 mt -87.57 -52.5 5.31 Favored 'General case' 0 C--N 1.296 -1.743 0 O-C-N 121.656 -0.653 . . . . 0.0 109.392 -178.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -62.98 -23.72 67.57 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 179.193 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.52 -51.87 18.11 Favored 'General case' 0 C--N 1.297 -1.709 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.768 ' ND2' ' HB2' ' A' ' 40' ' ' ALA . 0.1 OUTLIER -50.61 -40.9 54.08 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 -179.872 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 7.0 m95 -51.94 -52.46 50.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.198 -0.939 . . . . 0.0 108.865 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -55.98 -28.58 57.73 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 120.719 -1.238 . . . . 0.0 108.919 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 10.4 m -69.52 -64.67 0.83 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.168 -0.958 . . . . 0.0 109.986 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.6 pp -57.02 -30.8 64.51 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.65 -1.282 . . . . 0.0 107.922 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -71.28 -55.32 8.28 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.912 -1.118 . . . . 0.0 108.349 178.144 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -58.57 -14.15 7.43 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.501 -0.749 . . . . 0.0 109.551 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.496 ' O ' HG22 ' A' ' 16' ' ' VAL . 1.6 m-20 -73.12 -50.11 24.62 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 179.34 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.3 mt -56.86 -30.01 63.43 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.829 -0.544 . . . . 0.0 111.087 -178.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -69.11 -51.39 39.05 Favored 'General case' 0 C--N 1.3 -1.581 0 C-N-CA 118.539 -1.264 . . . . 0.0 109.727 -179.281 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.624 ' O ' ' N ' ' A' ' 20' ' ' ALA . 15.4 m -55.74 -20.92 9.22 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 C-N-CA 118.458 -1.297 . . . . 0.0 110.105 -179.35 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.445 ' O ' ' N ' ' A' ' 20' ' ' ALA . 11.5 mt -70.16 -73.51 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 O-C-N 120.442 -1.412 . . . . 0.0 108.947 179.085 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -46.94 -28.66 1.69 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.311 -0.868 . . . . 0.0 109.007 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.37 1.46 35.5 Favored 'General case' 0 N--CA 1.496 1.867 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.624 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -56.9 -44.11 82.02 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 107.453 -1.314 . . . . 0.0 107.453 179.473 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 67.76 -15.02 0.2 Allowed 'General case' 0 C--N 1.297 -1.678 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.949 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.488 ' N ' ' OD1' ' A' ' 22' ' ' ASN . 0.3 OUTLIER -148.21 142.79 26.51 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.653 -1.279 . . . . 0.0 110.051 178.576 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.86 -21.22 10.71 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.987 -0.446 . . . . 0.0 111.463 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.34 -52.13 55.94 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.857 -1.152 . . . . 0.0 109.601 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.501 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 5.4 mt-30 -69.76 -18.31 63.49 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.281 -0.887 . . . . 0.0 110.425 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.524 HG12 ' HB2' ' A' ' 79' ' ' ALA . 57.6 t -70.02 -48.95 59.87 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 O-C-N 120.925 -1.109 . . . . 0.0 108.388 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.463 ' O ' ' OG1' ' A' ' 31' ' ' THR . 7.0 mtpt -56.27 -55.12 37.27 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 178.812 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -50.78 -37.46 42.5 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-N 114.711 -1.132 . . . . 0.0 109.45 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.73 -68.71 0.39 Allowed 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.335 -0.853 . . . . 0.0 110.042 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 95.9 mt -60.28 -20.87 60.87 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.379 -0.826 . . . . 0.0 109.696 -179.263 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.463 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 7.8 m -62.42 -45.64 92.2 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.096 -1.002 . . . . 0.0 108.523 179.208 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 40.9 mtmt -72.81 -27.16 61.8 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.764 -0.585 . . . . 0.0 109.475 -179.149 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 29.5 mtp -63.98 -67.93 0.39 Allowed 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 178.268 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 15.8 ttt-85 -47.11 -26.4 1.09 Allowed 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.67 -57.9 3.61 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 120.009 -0.676 . . . . 0.0 109.344 178.854 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.25 -39.93 95.99 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.111 -0.993 . . . . 0.0 110.078 -179.619 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.92 -39.02 71.04 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.019 -1.051 . . . . 0.0 108.891 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 26.5 mt -66.01 -33.78 76.58 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.23 -0.919 . . . . 0.0 108.937 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -86.33 -41.94 14.12 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.096 -1.003 . . . . 0.0 109.549 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.768 ' HB2' ' ND2' ' A' ' 6' ' ' ASN . . . -58.84 -14.53 9.16 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.318 -0.864 . . . . 0.0 109.761 -179.674 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.45 ' C ' ' H ' ' A' ' 43' ' ' ALA . 2.2 tm0? -48.49 -51.57 26.57 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 120.963 -1.086 . . . . 0.0 109.692 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.465 ' HD3' ' H ' ' A' ' 42' ' ' LYS . 2.1 mppt? -71.0 14.24 0.16 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.345 -0.847 . . . . 0.0 109.706 -179.81 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.45 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -78.04 151.27 33.58 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.887 -1.133 . . . . 0.0 108.719 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -152.31 69.18 7.38 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.171 -0.956 . . . . 0.0 109.564 -179.392 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.442 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 33.3 Cg_exo -49.31 -40.05 43.54 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.586 2.191 . . . . 0.0 113.878 178.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.442 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 69.7 Cg_endo -95.98 -14.58 0.51 Allowed 'Trans proline' 0 N--CA 1.483 0.862 0 C-N-CA 122.467 2.111 . . . . 0.0 112.635 -178.922 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 43.3 mttm 71.83 101.69 0.07 Allowed 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.8 mp -84.33 22.98 1.15 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.122 -0.986 . . . . 0.0 108.791 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -107.04 26.41 10.17 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 107.416 -1.327 . . . . 0.0 107.416 178.144 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -144.26 -59.5 0.38 Allowed 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 -179.231 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -65.99 -162.96 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.585 0 O-C-N 121.325 -0.859 . . . . 0.0 108.888 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.3 t -75.11 145.12 80.14 Favored Pre-proline 0 N--CA 1.485 1.313 0 O-C-N 120.722 -1.236 . . . . 0.0 109.029 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.448 ' O ' ' CB ' ' A' ' 54' ' ' ASP . 43.4 Cg_endo -80.78 -14.57 11.19 Favored 'Trans proline' 0 N--CA 1.499 1.835 0 C-N-CA 122.719 2.28 . . . . 0.0 112.309 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.448 ' CB ' ' O ' ' A' ' 53' ' ' PRO . 10.3 t0 76.27 -143.99 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.825 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 40.4 t -162.36 -26.62 0.0 OUTLIER Pre-proline 0 N--CA 1.495 1.817 0 O-C-N 120.379 -1.451 . . . . 0.0 113.801 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.825 ' CD ' ' H ' ' A' ' 55' ' ' SER . 73.2 Cg_exo -56.43 40.91 0.04 OUTLIER 'Trans proline' 0 N--CA 1.503 2.043 0 C-N-CA 121.981 1.788 . . . . 0.0 113.021 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.648 ' N ' ' O ' ' A' ' 55' ' ' SER . 7.1 tp10 49.87 25.56 1.64 Allowed 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 -178.655 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.51 ' O ' ' N ' ' A' ' 61' ' ' PHE . 2.1 mtp 63.95 -5.08 0.32 Allowed 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 -177.732 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.566 ' H ' ' C ' ' A' ' 57' ' ' GLU . 0.5 OUTLIER -46.59 -50.37 17.52 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.346 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -54.03 -24.91 18.77 Favored 'General case' 0 C--N 1.297 -1.693 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.51 ' N ' ' O ' ' A' ' 58' ' ' MET . 3.8 t80 -77.25 -54.18 6.8 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 107.134 -1.432 . . . . 0.0 107.134 177.763 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.8 mtt-85 -62.54 -31.02 71.74 Favored 'General case' 0 N--CA 1.489 1.512 0 CA-C-O 121.328 0.585 . . . . 0.0 109.474 178.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.425 ' N ' ' O ' ' A' ' 59' ' ' LYS . 1.6 t60 -59.6 -40.89 88.99 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.67 -31.32 80.51 Favored Glycine 0 C--N 1.296 -1.649 0 N-CA-C 108.702 -1.759 . . . . 0.0 108.702 179.473 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -81.07 -41.46 22.55 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.055 -1.262 . . . . 0.0 108.062 178.421 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -71.26 -46.19 61.51 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 5.3 mm -55.78 -44.72 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 179.28 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 5.4 tp -58.04 -52.94 63.44 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.598 -0.689 . . . . 0.0 109.756 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 46.0 t -61.08 -15.76 12.9 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 O-C-N 121.281 -0.887 . . . . 0.0 110.692 -178.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -78.19 -43.79 12.72 Favored Glycine 0 N--CA 1.49 2.236 0 C-N-CA 119.25 -1.453 . . . . 0.0 110.382 -178.752 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.551 HE21 ' C ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -70.77 -30.8 67.38 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 120.681 -1.482 . . . . 0.0 107.429 179.47 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 27.9 mt -75.42 -30.11 21.94 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.558 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -59.87 -53.18 60.95 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 119.47 -0.892 . . . . 0.0 109.03 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.445 ' OD1' ' O ' ' A' ' 71' ' ' GLN . 0.4 OUTLIER -66.31 -32.53 73.99 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.071 -1.018 . . . . 0.0 109.297 179.909 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.44 -27.12 64.0 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 120.709 -1.245 . . . . 0.0 107.916 179.499 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.95 -34.15 67.75 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 105.797 -1.927 . . . . 0.0 105.797 177.628 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 9.2 tptt -69.73 -49.04 57.0 Favored 'General case' 0 C--N 1.305 -1.333 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.596 179.348 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 8.5 mp -55.1 -37.18 66.52 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.524 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -62.55 -50.29 71.9 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.313 -0.867 . . . . 0.0 108.902 178.46 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -73.23 -12.37 60.84 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.504 -0.747 . . . . 0.0 111.389 -178.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -94.16 -9.57 35.96 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 120.672 -1.268 . . . . 0.0 109.58 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.67 11.29 54.0 Favored Glycine 0 N--CA 1.497 2.751 0 O-C-N 121.131 -0.981 . . . . 0.0 110.662 178.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 5.7 mmtp -94.21 83.26 4.22 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.921 -1.341 . . . . 0.0 108.464 179.631 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 57.9 t -77.55 -54.0 13.46 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.773 0 O-C-N 121.786 -0.571 . . . . 0.0 109.653 -179.317 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.479 ' HD3' ' H ' ' A' ' 85' ' ' LYS . 0.6 OUTLIER -53.42 -39.7 64.56 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 120.954 -1.092 . . . . 0.0 108.604 179.329 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -67.25 -42.33 84.13 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 178.248 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.412 ' O ' ' HB3' ' A' ' 90' ' ' ALA . . . -67.05 -51.87 49.23 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 119.564 -0.854 . . . . 0.0 109.1 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.522 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -59.95 -48.29 82.32 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 179.585 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -55.87 -33.42 64.56 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.412 ' HB3' ' O ' ' A' ' 87' ' ' ALA . . . -67.04 -27.58 67.51 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 178.19 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.522 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -53.06 -50.78 63.64 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 179.059 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -63.42 -24.65 67.93 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 178.619 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -75.23 -36.16 61.35 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 177.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.431 ' CD1' ' OE1' ' A' ' 71' ' ' GLN . 4.1 mp -64.78 -49.15 71.86 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 178.646 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -50.32 -42.92 53.49 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 24.4 m -71.32 -35.27 71.17 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.165 -0.96 . . . . 0.0 109.125 179.005 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.2 m -60.79 -44.89 96.24 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 179.343 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 86.2 mt -51.26 -37.89 18.77 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.374 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.2 tpm_? -56.27 -54.49 44.69 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-O 121.907 0.86 . . . . 0.0 109.571 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.491 ' O ' ' N ' ' A' ' 103' ' ' GLN . . . -63.37 -53.89 45.43 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 120.434 -1.416 . . . . 0.0 108.184 179.222 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.491 ' O ' ' CG ' ' A' ' 104' ' ' LYS . 0.6 OUTLIER -53.33 -21.75 6.16 Favored 'General case' 0 C--N 1.297 -1.688 0 O-C-N 120.697 -1.252 . . . . 0.0 107.724 179.366 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.488 ' O ' ' N ' ' A' ' 106' ' ' GLY . 0.0 OUTLIER -65.85 -28.25 68.83 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 176.917 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.491 ' N ' ' O ' ' A' ' 100' ' ' ALA . 0.0 OUTLIER -61.83 -18.93 61.84 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 105.358 -2.09 . . . . 0.0 105.358 178.822 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.491 ' CG ' ' O ' ' A' ' 101' ' ' TYR . 0.0 OUTLIER -79.63 -28.12 40.93 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 177.476 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.485 ' O ' ' CG ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -101.96 3.5 39.04 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 107.756 -1.201 . . . . 0.0 107.756 178.544 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.488 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.491 2.351 0 N-CA-C 109.312 -1.515 . . . . 0.0 109.312 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 . . . . . 0 N--CA 1.492 1.673 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 48.9 mt -89.57 -49.12 6.85 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -62.64 -22.29 66.33 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 178.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -72.99 -49.54 28.4 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -50.13 -44.17 52.2 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.207 -0.933 . . . . 0.0 108.683 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 16.2 m95 -54.7 -49.21 71.27 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.187 -0.946 . . . . 0.0 109.367 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -55.41 -29.49 58.65 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 120.875 -1.14 . . . . 0.0 109.083 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 35.4 m -69.39 -65.46 0.71 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 119.289 -0.965 . . . . 0.0 109.789 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.1 pp -58.55 -28.86 65.88 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.776 -1.202 . . . . 0.0 108.566 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -71.74 -59.7 2.61 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.932 -1.105 . . . . 0.0 109.268 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -57.25 -13.77 3.58 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.45 -0.781 . . . . 0.0 109.378 -179.765 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -74.25 -54.27 8.04 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 13.4 mt -55.53 -27.55 49.48 Favored 'General case' 0 N--CA 1.49 1.548 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.574 -178.336 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 9.0 ttpp -70.16 -46.64 64.24 Favored 'General case' 0 C--N 1.298 -1.672 0 C-N-CA 118.919 -1.112 . . . . 0.0 108.569 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.523 ' O ' ' N ' ' A' ' 20' ' ' ALA . 71.9 t -55.84 -26.69 21.06 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.579 0 O-C-N 121.415 -0.803 . . . . 0.0 109.944 -179.301 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.526 ' O ' ' N ' ' A' ' 20' ' ' ALA . 7.1 mt -71.23 -71.25 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 O-C-N 121.053 -1.03 . . . . 0.0 110.468 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -46.75 -28.78 1.63 Allowed 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.931 -1.106 . . . . 0.0 108.789 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.43 ' O ' ' OD2' ' A' ' 21' ' ' ASP . 1.0 OUTLIER -99.96 -1.47 37.07 Favored 'General case' 0 N--CA 1.498 1.928 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 179.522 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.526 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -58.26 -59.93 4.55 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.893 -1.129 . . . . 0.0 108.299 178.713 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.43 ' OD2' ' O ' ' A' ' 19' ' ' LYS . 1.4 m-20 69.55 -7.62 0.85 Allowed 'General case' 0 C--N 1.295 -1.765 0 O-C-N 121.75 -0.594 . . . . 0.0 110.566 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.432 ' N ' ' OD1' ' A' ' 22' ' ' ASN . 0.6 OUTLIER -142.96 143.05 31.8 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 120.724 -1.235 . . . . 0.0 109.569 178.048 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.94 -27.78 46.08 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.714 -0.616 . . . . 0.0 111.101 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.2 -51.61 62.9 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.029 -1.044 . . . . 0.0 110.887 -178.506 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.421 ' OE1' ' O ' ' A' ' 20' ' ' ALA . 13.8 mt-30 -68.37 -24.07 64.75 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 120.955 -1.091 . . . . 0.0 110.884 -178.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.572 HG12 ' HB2' ' A' ' 79' ' ' ALA . 49.1 t -70.78 -47.74 61.58 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.036 0 O-C-N 120.693 -1.254 . . . . 0.0 108.99 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.7 mtpt -54.91 -55.11 34.11 Favored 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 106.376 -1.712 . . . . 0.0 106.376 179.048 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.474 ' N ' ' OD1' ' A' ' 28' ' ' ASP . 2.6 m-20 -52.14 -37.99 56.13 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-N 114.33 -1.305 . . . . 0.0 109.574 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.81 -64.09 0.95 Allowed 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.357 -0.839 . . . . 0.0 110.333 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.406 ' HB3' HD12 ' A' ' 76' ' ' LEU . 90.0 mt -60.15 -23.37 63.87 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.165 -0.959 . . . . 0.0 109.955 -179.204 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 48.1 m -61.86 -46.11 90.87 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.036 -1.04 . . . . 0.0 108.93 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.481 ' O ' ' HB3' ' A' ' 35' ' ' ALA . 50.5 mttm -72.26 -28.71 63.3 Favored 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.809 -0.557 . . . . 0.0 109.623 -179.353 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' MET . . . . . 0.416 ' C ' ' N ' ' A' ' 35' ' ' ALA . 48.6 mtp -65.36 -63.46 1.09 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.808 -1.183 . . . . 0.0 108.557 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.8 ttt-85 -50.06 -22.92 1.8 Allowed 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 32' ' ' LYS . . . -75.11 -58.7 3.12 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.643 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.414 ' O ' ' N ' ' A' ' 40' ' ' ALA . . . -62.89 -31.0 71.96 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.169 -0.957 . . . . 0.0 109.64 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.83 -44.12 90.85 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.165 -0.959 . . . . 0.0 108.82 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 17.2 mt -64.79 -32.24 73.83 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.366 -0.834 . . . . 0.0 109.227 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -84.69 -23.87 29.21 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.125 -0.984 . . . . 0.0 109.138 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.525 ' O ' ' HB3' ' A' ' 43' ' ' ALA . . . -61.8 -34.01 75.14 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.428 -0.795 . . . . 0.0 110.348 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.501 ' C ' ' H ' ' A' ' 43' ' ' ALA . 0.8 OUTLIER -40.33 -63.06 0.67 Allowed 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.33 -0.856 . . . . 0.0 110.077 -179.885 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 67.7 mmtt -57.62 1.05 0.04 OUTLIER 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.523 -0.736 . . . . 0.0 110.459 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' A' ' 40' ' ' ALA . . . -84.12 145.57 28.35 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.817 -1.177 . . . . 0.0 110.842 -179.151 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 m -159.37 90.22 1.96 Allowed Pre-proline 0 N--CA 1.49 1.544 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.417 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 23.3 Cg_exo -53.57 -43.68 55.63 Favored 'Trans proline' 0 N--CA 1.49 1.297 0 C-N-CA 121.601 1.534 . . . . 0.0 112.367 -179.105 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.417 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 96.6 Cg_endo -84.96 -90.6 0.0 OUTLIER 'Trans proline' 0 C--N 1.317 -1.087 0 C-N-CA 121.372 1.382 . . . . 0.0 110.574 178.424 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.7 pttt -176.6 122.23 0.15 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.076 -1.015 . . . . 0.0 109.829 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.452 ' C ' ' N ' ' A' ' 50' ' ' ASP . 0.7 OUTLIER -80.34 -174.71 4.73 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 178.575 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 50.74 18.83 0.53 Allowed 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.007 -1.058 . . . . 0.0 108.165 -179.147 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.452 ' N ' ' C ' ' A' ' 48' ' ' LEU . 33.4 m-20 -148.61 -55.0 0.19 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.733 -0.604 . . . . 0.0 110.054 -179.66 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.7 ptpp? -65.69 -162.59 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.537 0 O-C-N 120.974 -1.079 . . . . 0.0 109.289 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 3.7 m -79.36 115.82 55.93 Favored Pre-proline 0 N--CA 1.487 1.415 0 O-C-N 121.095 -1.003 . . . . 0.0 109.0 179.205 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.441 ' O ' ' CB ' ' A' ' 54' ' ' ASP . 31.1 Cg_endo -86.72 -17.22 3.38 Favored 'Trans proline' 0 N--CA 1.493 1.496 0 C-N-CA 122.356 2.038 . . . . 0.0 111.441 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.441 ' CB ' ' O ' ' A' ' 53' ' ' PRO . 6.2 t0 75.4 164.22 0.26 Allowed 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.264 -1.014 . . . . 0.0 108.264 -178.659 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.688 ' O ' ' N ' ' A' ' 57' ' ' GLU . 0.1 OUTLIER -80.28 -47.4 1.33 Allowed Pre-proline 0 N--CA 1.497 1.898 0 O-C-N 120.638 -1.289 . . . . 0.0 112.18 -178.405 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.6 ' O ' ' N ' ' A' ' 59' ' ' LYS . 30.2 Cg_exo -39.98 62.58 0.0 OUTLIER 'Trans proline' 0 N--CA 1.505 2.154 0 C-N-CA 123.523 2.816 . . . . 0.0 115.363 -178.356 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.688 ' N ' ' O ' ' A' ' 55' ' ' SER . 30.3 mt-10 36.63 29.08 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.038 0 CA-C-O 121.437 0.637 . . . . 0.0 109.477 179.273 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.534 ' N ' ' O ' ' A' ' 56' ' ' PRO . 0.1 OUTLIER 65.16 -8.07 0.26 Allowed 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -177.902 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.6 ' N ' ' O ' ' A' ' 56' ' ' PRO . 4.2 tmtm? -50.2 -40.79 48.26 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-O 121.704 0.764 . . . . 0.0 109.015 179.021 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -56.65 -27.31 58.27 Favored 'General case' 0 C--N 1.296 -1.724 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -179.268 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -73.17 -53.61 10.54 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 177.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -62.85 -32.47 73.71 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.661 179.081 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -61.7 -38.08 86.54 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.154 -0.966 . . . . 0.0 108.542 179.2 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.1 -30.67 78.42 Favored Glycine 0 N--CA 1.481 1.675 0 N-CA-C 108.381 -1.888 . . . . 0.0 108.381 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.496 ' CE2' ' NZ ' ' A' ' 104' ' ' LYS . 56.2 m-85 -84.01 -39.51 19.57 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.35 -1.088 . . . . 0.0 108.26 178.292 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -69.34 -46.4 67.14 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 178.678 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 5.6 mm -56.69 -38.87 59.99 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 179.187 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.72 -48.17 82.08 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.404 -0.81 . . . . 0.0 109.545 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 53.7 t -60.94 -17.33 15.55 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 O-C-N 121.65 -0.656 . . . . 0.0 109.632 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -78.55 -43.61 12.01 Favored Glycine 0 N--CA 1.487 2.087 0 C-N-CA 119.609 -1.281 . . . . 0.0 110.792 -178.59 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.462 ' C ' ' NE2' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -71.7 -30.74 65.99 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.557 -1.555 . . . . 0.0 107.501 179.713 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 12.0 mt -74.01 -31.35 29.98 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 177.002 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -62.83 -57.52 10.57 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.252 -0.905 . . . . 0.0 110.099 -179.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -62.69 -29.2 70.47 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.132 -0.98 . . . . 0.0 109.746 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.32 -29.29 61.54 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 120.645 -1.284 . . . . 0.0 108.355 179.218 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.406 HD12 ' HB3' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -56.49 -33.18 65.72 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 106.171 -1.789 . . . . 0.0 106.171 178.185 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.4 tptt -69.03 -42.37 76.45 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.422 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 8.1 mp -59.51 -37.62 78.79 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.37 -0.831 . . . . 0.0 108.85 -178.366 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.572 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -63.4 -51.33 66.24 Favored 'General case' 0 C--N 1.298 -1.642 0 O-C-N 121.272 -0.893 . . . . 0.0 109.23 178.79 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -72.6 -11.07 60.5 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.418 -0.802 . . . . 0.0 111.012 -178.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -95.04 -10.86 29.56 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 120.904 -1.122 . . . . 0.0 109.513 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.83 12.92 48.62 Favored Glycine 0 N--CA 1.496 2.651 0 N-CA-C 110.693 -0.963 . . . . 0.0 110.693 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp -95.22 77.43 3.46 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.971 -1.311 . . . . 0.0 108.43 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.418 HG22 HG21 ' A' ' 26' ' ' VAL . 71.2 t -75.63 -52.01 19.3 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.747 0 O-C-N 121.864 -0.523 . . . . 0.0 109.646 -179.344 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.455 ' HD2' ' H ' ' A' ' 85' ' ' LYS . 4.7 mptt -53.74 -37.15 63.08 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.091 -1.078 . . . . 0.0 108.091 179.25 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -70.24 -42.61 72.0 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 178.334 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.65 -53.74 37.24 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 119.627 -0.829 . . . . 0.0 109.18 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.566 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -59.69 -46.03 90.31 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 179.52 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -58.62 -39.22 79.83 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.117 -0.99 . . . . 0.0 108.403 179.114 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.528 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -64.73 -29.58 70.56 Favored 'General case' 0 N--CA 1.485 1.31 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 178.428 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.566 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -49.17 -47.43 45.85 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.983 -1.073 . . . . 0.0 108.16 178.719 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -62.37 -27.06 68.81 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 178.296 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.528 ' N ' ' O ' ' A' ' 90' ' ' ALA . 1.6 tm0? -72.64 -36.39 67.99 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 177.939 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.403 HD11 ' OE1' ' A' ' 71' ' ' GLN . 10.0 mp -65.57 -48.24 73.06 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.459 -1.312 . . . . 0.0 107.459 178.639 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 3.6 mtpt -52.81 -48.37 66.99 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.371 -0.83 . . . . 0.0 109.189 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 45.4 m -69.28 -34.27 74.49 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.163 -0.961 . . . . 0.0 109.674 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.4 m -58.52 -48.04 82.16 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 4.2 mm -50.32 -33.7 10.67 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.312 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.22 -42.05 76.62 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 179.217 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.41 -28.18 69.07 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.609 -0.682 . . . . 0.0 109.48 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -67.83 -35.66 78.99 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 179.535 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -61.6 -32.77 72.9 Favored 'General case' 0 C--N 1.303 -1.451 0 C-N-CA 119.052 -1.059 . . . . 0.0 108.358 179.584 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.405 ' OE1' ' N ' ' A' ' 104' ' ' LYS . 0.4 OUTLIER -64.04 -23.45 67.34 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 105.178 -2.156 . . . . 0.0 105.178 177.846 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.496 ' NZ ' ' CE2' ' A' ' 65' ' ' PHE . 0.0 OUTLIER -83.86 -33.8 24.76 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 177.577 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.538 ' C ' ' CD1' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -89.98 4.77 49.13 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 120.947 -1.096 . . . . 0.0 108.55 179.39 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.395 0 CA-C-O 117.94 -1.478 . . . . 0.0 109.519 179.714 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 121.546 0.689 . . . . 0.0 109.419 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 69.2 mt -88.36 -51.94 5.47 Favored 'General case' 0 C--N 1.295 -1.762 0 O-C-N 121.608 -0.682 . . . . 0.0 109.326 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -64.47 -25.11 67.86 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -73.41 -43.4 60.55 Favored 'General case' 0 C--N 1.296 -1.741 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.424 ' ND2' ' HB2' ' A' ' 40' ' ' ALA . 0.1 OUTLIER -57.82 -40.61 80.44 Favored 'General case' 0 C--N 1.307 -1.264 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -179.886 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 8.2 m95 -52.67 -53.01 53.33 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.165 -0.959 . . . . 0.0 108.702 -179.347 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 51.1 tt0 -59.38 -30.84 68.71 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 120.918 -1.114 . . . . 0.0 108.434 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.3 m -67.98 -54.28 19.77 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 119.451 -0.899 . . . . 0.0 108.79 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.4 mt -58.27 -37.27 74.64 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 178.565 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -69.34 -60.86 2.06 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.385 -0.822 . . . . 0.0 109.809 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -55.67 -14.72 2.37 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.347 -0.846 . . . . 0.0 109.349 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.53 ' O ' HG22 ' A' ' 16' ' ' VAL . 2.2 m-20 -74.6 -54.62 7.11 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 107.637 -1.245 . . . . 0.0 107.637 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.5 mt -55.92 -22.38 25.62 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.537 -0.727 . . . . 0.0 110.312 -178.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 11.7 tttp -70.21 -57.61 4.72 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.068 -1.02 . . . . 0.0 109.102 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.617 ' O ' ' N ' ' A' ' 20' ' ' ALA . 14.9 m -52.68 -22.76 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 C-N-CA 118.864 -1.135 . . . . 0.0 110.316 -178.449 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 9.4 mt -70.2 -74.87 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 120.441 -1.412 . . . . 0.0 109.926 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -47.67 -28.57 2.46 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.143 -0.973 . . . . 0.0 108.724 -179.518 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.13 4.33 36.87 Favored 'General case' 0 N--CA 1.495 1.809 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.617 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -57.65 -38.45 75.09 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 179.047 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 63.57 -17.6 0.06 Allowed 'General case' 0 N--CA 1.494 1.753 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.225 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.544 ' H ' ' C ' ' A' ' 20' ' ' ALA . 0.6 OUTLIER -146.6 144.23 29.4 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.749 -1.219 . . . . 0.0 109.787 179.773 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -56.06 -15.75 4.04 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.721 -0.612 . . . . 0.0 110.106 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.51 -55.54 13.13 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.215 -0.928 . . . . 0.0 109.568 -179.495 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -68.34 -19.04 64.63 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.557 -0.714 . . . . 0.0 110.609 -179.42 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.555 HG12 ' HB2' ' A' ' 79' ' ' ALA . 47.5 t -70.8 -46.71 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 O-C-N 120.936 -1.102 . . . . 0.0 108.589 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.428 ' O ' ' OG1' ' A' ' 31' ' ' THR . 14.0 mtpt -55.58 -56.74 16.78 Favored 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 178.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -51.8 -34.14 38.64 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-N 114.403 -1.271 . . . . 0.0 109.64 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.84 -69.66 0.33 Allowed 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.289 -0.882 . . . . 0.0 110.32 -179.052 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 30' ' ' LEU . 93.0 mt -57.1 -19.99 22.79 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.52 -0.738 . . . . 0.0 109.414 -178.926 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.428 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 39.4 m -64.17 -40.76 96.81 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 178.443 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 58.2 mttt -73.94 -32.07 63.33 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 36.8 mtp -66.67 -69.09 0.33 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 120.988 -1.07 . . . . 0.0 108.74 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.3 ttt-85 -45.9 -29.18 1.31 Allowed 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.32 -64.76 0.95 Allowed 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 120.049 -0.66 . . . . 0.0 109.843 179.439 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.66 -33.17 73.5 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.043 -1.036 . . . . 0.0 109.224 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.25 -38.07 82.36 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 179.33 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.5 mt -65.68 -26.32 67.73 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 179.298 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 61.0 t0 -84.66 -37.42 21.05 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.12 -0.987 . . . . 0.0 110.041 -179.674 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.563 ' O ' ' N ' ' A' ' 42' ' ' LYS . . . -58.46 -69.34 0.19 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.07 -1.019 . . . . 0.0 109.607 -179.81 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.607 ' C ' ' H ' ' A' ' 43' ' ' ALA . 0.2 OUTLIER 11.78 -78.42 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.606 0 CA-C-O 121.702 0.763 . . . . 0.0 111.354 -179.581 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.563 ' N ' ' O ' ' A' ' 40' ' ' ALA . 44.7 mmtt -56.26 13.0 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.926 -0.483 . . . . 0.0 110.682 179.498 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.607 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -75.42 148.38 39.18 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.432 -1.418 . . . . 0.0 110.236 -178.508 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -153.58 76.51 6.11 Favored Pre-proline 0 N--CA 1.492 1.648 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.421 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 46.9 Cg_exo -49.67 -39.79 46.89 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.537 2.158 . . . . 0.0 113.89 179.781 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.421 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 88.6 Cg_endo -93.1 -93.72 0.0 OUTLIER 'Trans proline' 0 C--N 1.32 -0.967 0 C-N-CA 121.848 1.699 . . . . 0.0 111.589 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.444 ' CB ' ' NZ ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -177.78 103.06 0.05 OUTLIER 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.157 -0.965 . . . . 0.0 110.227 179.899 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.414 ' C ' ' N ' ' A' ' 50' ' ' ASP . 0.5 OUTLIER -82.85 -175.05 5.61 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 107.019 -1.474 . . . . 0.0 107.019 178.17 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 51.35 20.38 0.95 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.796 -1.19 . . . . 0.0 108.36 -179.054 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.414 ' N ' ' C ' ' A' ' 48' ' ' LEU . 7.7 m-20 -143.16 -61.33 0.42 Allowed 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 7.9 ptpp? -66.64 -146.98 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 178.532 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 25.9 t -77.96 131.92 68.83 Favored Pre-proline 0 C--N 1.307 -1.273 0 O-C-N 120.65 -1.281 . . . . 0.0 108.279 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -80.99 -11.61 12.27 Favored 'Trans proline' 0 N--CA 1.496 1.656 0 C-N-CA 122.354 2.036 . . . . 0.0 111.468 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 69.02 -128.2 0.1 Allowed 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 -178.824 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.805 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 24.2 t -168.27 -28.45 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.714 0 C-N-CA 118.645 -1.222 . . . . 0.0 113.523 -179.42 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.805 ' CD ' ' H ' ' A' ' 55' ' ' SER . 73.4 Cg_exo -54.75 45.65 0.03 OUTLIER 'Trans proline' 0 N--CA 1.503 2.081 0 C-N-CA 122.277 1.985 . . . . 0.0 113.205 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.678 ' N ' ' O ' ' A' ' 55' ' ' SER . 38.6 mt-10 46.98 27.94 0.8 Allowed 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 -179.383 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 8.9 mtm 65.4 -8.25 0.28 Allowed 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 -177.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.601 ' H ' ' C ' ' A' ' 57' ' ' GLU . 1.0 OUTLIER -50.21 -46.65 54.69 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-O 121.716 0.769 . . . . 0.0 109.875 179.191 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.463 ' H ' ' HB2' ' A' ' 56' ' ' PRO . 8.0 t70 -52.31 -17.81 1.32 Allowed 'General case' 0 C--N 1.293 -1.875 0 O-C-N 121.089 -1.007 . . . . 0.0 109.331 -178.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -74.74 -68.07 0.58 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.166 -0.959 . . . . 0.0 109.265 178.46 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.464 ' H ' ' CD ' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -58.46 -27.11 64.09 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 -179.644 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.594 ' CE1' HD11 ' A' ' 67' ' ' ILE . 3.5 t60 -60.99 -45.61 94.11 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.874 -0.788 . . . . 0.0 108.874 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -60.54 -32.09 76.9 Favored Glycine 0 N--CA 1.484 1.889 0 C-N-CA 118.89 -1.624 . . . . 0.0 109.214 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.505 ' O ' HG23 ' A' ' 69' ' ' VAL . 88.5 m-85 -82.0 -41.98 19.98 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.106 -1.232 . . . . 0.0 108.258 178.378 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 51.9 t0 -69.5 -46.41 66.64 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 179.379 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.594 HD11 ' CE1' ' A' ' 63' ' ' HIS . 17.7 mm -54.59 -47.08 72.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 178.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.9 tp -60.53 -47.28 86.88 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.459 -0.776 . . . . 0.0 108.964 179.342 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 65' ' ' PHE . 55.3 t -62.45 -21.77 27.94 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 O-C-N 121.181 -0.949 . . . . 0.0 110.072 -179.57 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -77.19 -49.4 7.5 Favored Glycine 0 N--CA 1.49 2.286 0 C-N-CA 119.686 -1.245 . . . . 0.0 110.471 -178.78 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.522 ' NE2' ' O ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -67.32 -28.01 67.64 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 120.67 -1.488 . . . . 0.0 107.519 179.743 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 4.5 mt -74.58 -33.06 31.19 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.474 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 176.218 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -60.27 -53.79 53.49 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.527 -0.733 . . . . 0.0 109.708 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -64.14 -31.53 72.76 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.439 -0.788 . . . . 0.0 109.764 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.25 -31.56 67.69 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 120.434 -1.416 . . . . 0.0 107.801 179.407 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.59 -33.38 66.16 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 178.087 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 5.8 tptt -67.13 -43.52 82.2 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-O 121.724 0.773 . . . . 0.0 109.526 178.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.9 mp -59.78 -32.04 70.23 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.555 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -64.11 -55.22 23.56 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.587 -0.696 . . . . 0.0 109.372 178.766 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -73.37 -10.63 59.94 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.431 -0.793 . . . . 0.0 111.494 -178.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -92.41 -10.91 36.35 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 120.791 -1.193 . . . . 0.0 109.575 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.22 12.39 51.96 Favored Glycine 0 N--CA 1.496 2.681 0 N-CA-C 110.299 -1.12 . . . . 0.0 110.299 178.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 17.3 mmtp -93.86 82.56 4.28 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.064 -1.257 . . . . 0.0 108.001 179.246 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 19.4 t -76.69 -60.45 2.31 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.809 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.956 -178.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.411 ' H ' ' HD2' ' A' ' 85' ' ' LYS . 7.6 mptt -49.43 -38.0 27.67 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.03 -1.044 . . . . 0.0 109.084 179.85 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.602 ' H ' ' CD ' ' A' ' 86' ' ' GLU . 35.3 mp0 -68.02 -46.3 71.57 Favored 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 179.052 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.2 -45.51 80.55 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 119.194 -1.003 . . . . 0.0 108.971 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.535 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -61.94 -58.82 6.43 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 179.488 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -53.4 -37.68 62.72 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.056 -1.027 . . . . 0.0 108.805 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.581 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -63.32 -35.08 79.19 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 178.356 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.535 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -48.24 -41.97 29.09 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.744 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -65.43 -26.41 67.95 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 178.248 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.581 ' N ' ' O ' ' A' ' 90' ' ' ALA . 1.6 tm0? -73.45 -39.91 64.6 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 177.741 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.495 ' CD1' ' OE1' ' A' ' 71' ' ' GLN . 11.3 mp -62.81 -42.89 99.91 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 107.456 -1.312 . . . . 0.0 107.456 178.866 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 3.6 mtpt -54.89 -47.96 73.63 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 179.431 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 87.0 m -69.38 -32.25 71.15 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.244 -0.91 . . . . 0.0 109.515 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.9 m -60.83 -48.12 83.25 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.094 -1.004 . . . . 0.0 108.457 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 95.9 mt -51.23 -36.71 17.07 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -53.29 -43.55 67.6 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.403 ' O ' ' HG3' ' A' ' 103' ' ' GLN . . . -64.32 -37.03 86.06 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.351 -0.843 . . . . 0.0 109.048 179.14 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.458 ' CD1' ' C ' ' A' ' 101' ' ' TYR . 0.5 OUTLIER -65.95 -28.21 68.74 Favored 'General case' 0 C--N 1.297 -1.682 0 O-C-N 120.26 -1.525 . . . . 0.0 107.832 179.41 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.503 ' O ' ' N ' ' A' ' 106' ' ' GLY . 0.3 OUTLIER -66.6 -32.1 73.22 Favored 'General case' 0 C--N 1.298 -1.636 0 C-N-CA 119.152 -1.019 . . . . 0.0 110.084 -179.541 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.403 ' HG3' ' O ' ' A' ' 100' ' ' ALA . 0.0 OUTLIER -66.84 -20.94 66.03 Favored 'General case' 0 N--CA 1.485 1.325 0 N-CA-C 104.71 -2.329 . . . . 0.0 104.71 177.999 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.77 -36.37 31.96 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 177.289 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.551 ' C ' ' CD1' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -94.49 6.84 47.56 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.064 -1.023 . . . . 0.0 108.475 179.335 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.503 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.49 2.3 0 CA-C-O 117.943 -1.476 . . . . 0.0 109.612 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.631 0.729 . . . . 0.0 109.186 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 43.7 mt -89.08 -49.83 6.52 Favored 'General case' 0 C--N 1.295 -1.766 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -65.32 -23.78 67.1 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 179.112 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -74.39 -51.86 13.78 Favored 'General case' 0 C--N 1.298 -1.658 0 C-N-CA 119.796 -0.762 . . . . 0.0 108.969 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.725 HD22 ' HB2' ' A' ' 40' ' ' ALA . 0.2 OUTLIER -53.39 -37.6 62.62 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 -179.77 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.402 ' HZ2' ' HH ' ' A' ' 101' ' ' TYR . 11.9 m0 -53.41 -52.85 58.02 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.227 -0.921 . . . . 0.0 108.556 -179.678 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -56.46 -29.44 61.71 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.289 -0.882 . . . . 0.0 109.2 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 59.4 m -69.46 -63.76 1.01 Allowed 'General case' 0 N--CA 1.486 1.354 0 O-C-N 121.076 -1.015 . . . . 0.0 110.164 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.3 pp -59.05 -30.54 68.12 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 118.382 -1.327 . . . . 0.0 108.026 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -70.91 -58.16 3.87 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.94 -1.1 . . . . 0.0 108.931 178.272 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -58.96 -11.41 3.35 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.502 -0.749 . . . . 0.0 109.886 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -74.44 -53.24 9.93 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 107.594 -1.261 . . . . 0.0 107.594 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.16 -37.17 69.16 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.711 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.585 ' HZ2' ' HE3' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -67.72 -40.92 84.2 Favored 'General case' 0 C--N 1.296 -1.718 0 C-N-CA 118.51 -1.276 . . . . 0.0 108.74 -179.286 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.553 ' O ' ' N ' ' A' ' 20' ' ' ALA . 69.3 t -60.25 -23.93 29.14 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 O-C-N 120.98 -1.075 . . . . 0.0 109.52 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.466 ' O ' ' N ' ' A' ' 20' ' ' ALA . 12.6 mt -70.41 -70.77 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.875 0 O-C-N 121.021 -1.049 . . . . 0.0 109.93 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -48.25 -25.18 1.42 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.12 -0.987 . . . . 0.0 108.893 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.585 ' HE3' ' HZ2' ' A' ' 15' ' ' LYS . 0.0 OUTLIER -103.38 -1.14 29.1 Favored 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 179.228 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.553 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -57.78 -38.13 74.92 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 107.686 -1.227 . . . . 0.0 107.686 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 58.13 -8.73 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.264 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.522 ' H ' ' C ' ' A' ' 20' ' ' ALA . 0.6 OUTLIER -147.11 144.2 28.86 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 120.574 -1.329 . . . . 0.0 109.745 178.636 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.07 -22.23 37.65 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.861 -0.524 . . . . 0.0 111.016 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.8 -54.96 19.96 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.138 -0.976 . . . . 0.0 110.351 -179.128 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.419 ' HB2' ' HB1' ' A' ' 20' ' ' ALA . 4.2 mt-30 -67.35 -16.57 64.33 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.147 -0.971 . . . . 0.0 110.614 -179.035 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.476 HG12 ' HB2' ' A' ' 79' ' ' ALA . 48.9 t -71.11 -48.38 55.56 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.019 0 O-C-N 120.916 -1.115 . . . . 0.0 108.39 179.659 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.8 mppt? -55.59 -50.94 68.76 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 179.068 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.437 ' N ' ' OD1' ' A' ' 28' ' ' ASP . 6.2 m-20 -54.67 -39.58 68.22 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-N 114.782 -1.099 . . . . 0.0 109.654 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.77 -62.08 1.54 Allowed 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.31 -0.868 . . . . 0.0 110.284 -179.257 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.474 HD23 ' SD ' ' A' ' 33' ' ' MET . 85.3 mt -62.95 -24.88 68.09 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.11 -0.994 . . . . 0.0 110.514 -179.037 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 31.6 m -60.86 -45.72 93.42 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.895 -1.128 . . . . 0.0 108.714 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 16.3 mmtm -71.44 -28.99 64.36 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-O 121.305 0.574 . . . . 0.0 109.517 -179.181 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' MET . . . . . 0.474 ' SD ' HD23 ' A' ' 30' ' ' LEU . 62.9 mtp -64.62 -67.66 0.42 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.153 -0.967 . . . . 0.0 108.812 178.858 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.473 ' O ' ' CD2' ' A' ' 38' ' ' LEU . 12.3 ttt-85 -48.72 -23.38 1.03 Allowed 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -179.323 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.403 ' N ' ' C ' ' A' ' 33' ' ' MET . . . -77.76 -58.27 3.36 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.756 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.95 -28.56 67.57 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.83 -1.169 . . . . 0.0 110.223 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -57.87 -58.77 6.92 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.98 -1.075 . . . . 0.0 108.609 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.473 ' CD2' ' O ' ' A' ' 34' ' ' ARG . 0.6 OUTLIER -62.34 -18.33 61.17 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.432 -0.793 . . . . 0.0 109.253 179.48 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -84.14 -39.15 19.8 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.773 -1.204 . . . . 0.0 108.248 178.652 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.725 ' HB2' HD22 ' A' ' 6' ' ' ASN . . . -61.47 -19.72 62.34 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.463 -0.773 . . . . 0.0 109.705 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.513 ' O ' ' N ' ' A' ' 43' ' ' ALA . 1.6 tm0? -46.43 -56.82 5.34 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.454 ' HG2' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -63.22 74.6 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.753 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.538 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.513 ' N ' ' O ' ' A' ' 41' ' ' GLN . . . -160.61 149.81 17.12 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.485 -1.384 . . . . 0.0 110.292 -179.223 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -154.91 74.35 5.66 Favored Pre-proline 0 N--CA 1.494 1.729 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.436 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 50.3 Cg_exo -46.8 -38.59 23.14 Favored 'Trans proline' 0 C--N 1.306 -1.688 0 C-N-CA 122.552 2.168 . . . . 0.0 114.315 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.436 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 73.0 Cg_endo -96.9 -92.01 0.0 OUTLIER 'Trans proline' 0 C--N 1.317 -1.111 0 C-N-CA 122.442 2.095 . . . . 0.0 112.149 -179.25 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 10.1 pttp -175.64 102.4 0.07 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.218 -0.927 . . . . 0.0 109.731 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.43 -177.34 6.46 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 178.705 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 52.07 22.37 1.85 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.751 -1.218 . . . . 0.0 108.291 -178.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -145.6 -56.8 0.31 Allowed 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -68.0 -163.79 0.04 OUTLIER 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.22 -0.925 . . . . 0.0 108.782 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.3 t -76.55 117.32 63.76 Favored Pre-proline 0 N--CA 1.486 1.363 0 O-C-N 120.998 -1.064 . . . . 0.0 108.948 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.585 ' C ' ' H ' ' A' ' 55' ' ' SER . 41.6 Cg_endo -83.25 -9.89 10.28 Favored 'Trans proline' 0 N--CA 1.496 1.645 0 C-N-CA 122.325 2.016 . . . . 0.0 111.494 -179.68 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.554 ' O ' ' CB ' ' A' ' 55' ' ' SER . 6.7 t0 63.14 -24.37 0.06 Allowed 'General case' 0 N--CA 1.491 1.577 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.595 -178.892 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.769 ' O ' ' N ' ' A' ' 57' ' ' GLU . 4.5 t 102.47 -26.44 0.0 OUTLIER Pre-proline 0 N--CA 1.52 3.029 0 N-CA-C 115.557 1.688 . . . . 0.0 115.557 177.787 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.55 ' O ' ' N ' ' A' ' 59' ' ' LYS . 85.7 Cg_exo -45.98 36.86 0.01 OUTLIER 'Trans proline' 0 N--CA 1.511 2.529 0 C-N-CA 122.677 2.251 . . . . 0.0 114.943 179.262 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.769 ' N ' ' O ' ' A' ' 55' ' ' SER . 25.3 tt0 50.41 23.4 1.25 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 120.426 -1.421 . . . . 0.0 107.189 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.503 ' SD ' ' O ' ' A' ' 57' ' ' GLU . 0.8 OUTLIER 66.41 -3.9 0.78 Allowed 'General case' 0 C--N 1.307 -1.282 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 -178.281 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.55 ' N ' ' O ' ' A' ' 56' ' ' PRO . 0.1 OUTLIER -52.93 -42.45 65.42 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 121.953 0.883 . . . . 0.0 109.396 179.514 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -55.39 -17.95 5.86 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 108.498 -0.926 . . . . 0.0 108.498 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.443 ' CD1' ' NZ ' ' A' ' 104' ' ' LYS . 30.8 t80 -75.11 -63.93 1.16 Allowed 'General case' 0 N--CA 1.492 1.627 0 CA-C-O 122.061 0.934 . . . . 0.0 109.44 178.688 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.544 ' O ' ' N ' ' A' ' 66' ' ' ASP . 0.0 OUTLIER -63.02 -31.88 73.11 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 -179.655 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.412 ' NE2' HD11 ' A' ' 67' ' ' ILE . 4.8 t60 -54.84 -38.9 68.01 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -65.63 -34.7 89.72 Favored Glycine 0 C--N 1.293 -1.848 0 N-CA-C 108.137 -1.985 . . . . 0.0 108.137 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -82.98 -32.97 26.75 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.304 -1.115 . . . . 0.0 108.517 178.187 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.544 ' N ' ' O ' ' A' ' 62' ' ' ARG . 14.6 t0 -72.25 -44.89 62.19 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 177.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.412 HD11 ' NE2' ' A' ' 63' ' ' HIS . 5.5 mm -63.13 -35.86 73.52 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.524 0 O-C-N 121.287 -0.883 . . . . 0.0 109.094 178.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.8 tp -54.18 -61.34 2.37 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 122.153 0.978 . . . . 0.0 108.96 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.439 HG22 ' O ' ' A' ' 66' ' ' ASP . 31.0 m -57.87 -13.32 2.45 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.835 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.548 -178.498 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -78.19 -54.82 4.26 Favored Glycine 0 N--CA 1.494 2.506 0 C-N-CA 119.806 -1.188 . . . . 0.0 111.172 -179.155 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.446 ' NE2' ' O ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -67.08 -29.12 68.79 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.316 -1.697 . . . . 0.0 107.9 -179.837 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 14.4 mt -71.05 -31.43 44.92 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 177.454 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -58.14 -52.22 66.45 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 119.205 -0.998 . . . . 0.0 109.347 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -64.4 -31.98 73.42 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.361 -0.837 . . . . 0.0 109.471 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.12 -30.22 63.47 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 120.698 -1.251 . . . . 0.0 108.389 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.81 -33.81 64.78 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 178.292 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.4 tptt -68.65 -46.54 68.89 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.33 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 8.1 mp -58.0 -33.41 68.9 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 -178.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.476 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -64.08 -50.07 69.82 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.35 -0.844 . . . . 0.0 108.862 178.183 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -74.2 -13.58 60.82 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.591 -0.693 . . . . 0.0 111.447 -178.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 82.5 mt-10 -93.09 -10.43 36.05 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.602 -1.311 . . . . 0.0 110.128 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 95.57 15.62 42.79 Favored Glycine 0 N--CA 1.496 2.641 0 N-CA-C 110.264 -1.134 . . . . 0.0 110.264 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.1 mmtt -96.44 75.66 2.89 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.205 -1.173 . . . . 0.0 108.312 179.154 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 22.0 t -73.29 -59.32 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.778 -0.576 . . . . 0.0 109.638 -179.187 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.522 ' HD2' ' H ' ' A' ' 85' ' ' LYS . 0.0 OUTLIER -48.41 -35.99 13.85 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.216 -0.927 . . . . 0.0 108.517 179.378 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.604 ' H ' ' CD ' ' A' ' 86' ' ' GLU . 27.2 mp0 -71.65 -47.84 51.68 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 178.432 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.34 -42.74 98.95 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.545 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.1 OUTLIER -60.75 -61.42 2.6 Favored 'General case' 0 C--N 1.296 -1.726 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 178.654 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -49.0 -37.59 20.81 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.154 -0.966 . . . . 0.0 109.07 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.547 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -63.08 -36.56 84.0 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 178.246 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.545 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -45.96 -46.97 16.58 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.456 ' OE1' ' O ' ' A' ' 88' ' ' GLN . 2.3 mp0 -62.76 -27.18 69.11 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.14 -0.975 . . . . 0.0 108.444 178.601 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.547 ' N ' ' O ' ' A' ' 90' ' ' ALA . 1.7 tm0? -72.69 -41.22 65.54 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 177.915 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.416 ' N ' HD12 ' A' ' 94' ' ' LEU . 9.5 mp -63.44 -43.09 98.42 Favored 'General case' 0 C--N 1.305 -1.354 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 3.9 mtpt -56.27 -40.9 74.98 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.29 -0.881 . . . . 0.0 108.813 178.806 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 13.5 m -67.47 -31.75 72.12 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.15 -0.969 . . . . 0.0 108.868 179.372 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.24 -42.61 98.92 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 178.859 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.2 mt -53.81 -32.92 22.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.9 tpt180 -58.64 -45.4 89.38 Favored 'General case' 0 C--N 1.302 -1.496 0 C-N-CA 119.023 -1.071 . . . . 0.0 108.414 179.585 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.64 -24.96 67.75 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.461 -0.774 . . . . 0.0 109.18 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.408 ' O ' ' N ' ' A' ' 105' ' ' TYR . 6.2 t80 -74.72 -32.11 62.04 Favored 'General case' 0 C--N 1.297 -1.711 0 O-C-N 120.557 -1.34 . . . . 0.0 108.028 179.287 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.407 ' O ' ' N ' ' A' ' 106' ' ' GLY . 1.0 OUTLIER -65.5 -40.94 93.62 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 120.991 -1.068 . . . . 0.0 110.72 -179.096 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.87 -22.26 66.96 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 105.514 -2.032 . . . . 0.0 105.514 179.136 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.443 ' NZ ' ' CD1' ' A' ' 61' ' ' PHE . 0.0 OUTLIER -81.82 -33.31 30.82 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 176.631 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.568 ' C ' ' CD1' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -90.61 3.77 53.18 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.117 -0.989 . . . . 0.0 108.59 179.7 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.491 2.342 0 CA-C-O 117.955 -1.469 . . . . 0.0 109.537 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.494 1.734 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 15.1 mt -87.38 -51.2 6.08 Favored 'General case' 0 C--N 1.296 -1.73 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 -179.581 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -64.36 -22.72 67.05 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -72.73 -44.78 61.24 Favored 'General case' 0 C--N 1.298 -1.657 0 C-N-CA 119.568 -0.853 . . . . 0.0 108.742 -179.617 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.493 HD22 ' HB2' ' A' ' 40' ' ' ALA . 0.1 OUTLIER -54.83 -44.11 73.61 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 -179.856 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 11.6 m95 -53.13 -48.08 68.18 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.556 -0.715 . . . . 0.0 109.524 -179.434 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -56.32 -33.0 65.17 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 120.805 -1.185 . . . . 0.0 108.163 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.3 m -68.19 -52.12 37.95 Favored 'General case' 0 C--N 1.306 -1.301 0 C-N-CA 119.185 -1.006 . . . . 0.0 108.371 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 25.9 mt -58.96 -38.84 80.0 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 178.397 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -68.33 -52.78 29.64 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.576 -0.849 . . . . 0.0 108.902 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -61.53 -15.39 37.88 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.599 -0.688 . . . . 0.0 109.628 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -74.94 -51.82 12.77 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 179.533 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.2 mt -57.61 -33.01 67.77 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-O 120.995 0.426 . . . . 0.0 111.425 -178.268 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -67.8 -47.62 68.58 Favored 'General case' 0 C--N 1.296 -1.754 0 O-C-N 121.066 -1.022 . . . . 0.0 108.654 -179.33 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.523 ' O ' ' N ' ' A' ' 20' ' ' ALA . 55.6 t -55.88 -25.49 19.01 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 C-N-CA 119.304 -0.958 . . . . 0.0 109.755 -179.1 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.487 ' O ' ' N ' ' A' ' 20' ' ' ALA . 7.2 mt -71.28 -72.48 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.181 0 O-C-N 120.936 -1.103 . . . . 0.0 110.213 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -46.8 -27.4 1.2 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.893 -1.129 . . . . 0.0 109.201 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -101.02 -4.07 28.16 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.474 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.523 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -57.49 -54.56 45.43 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 178.525 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 66.11 -0.92 1.27 Allowed 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.007 179.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.452 ' N ' ' OD1' ' A' ' 22' ' ' ASN . 0.7 OUTLIER -144.63 142.48 30.16 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.587 -1.321 . . . . 0.0 109.19 177.55 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -56.0 -19.38 12.37 Favored 'General case' 0 C--N 1.295 -1.792 0 O-C-N 121.599 -0.688 . . . . 0.0 110.794 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -71.41 -58.89 3.1 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.176 -0.953 . . . . 0.0 111.055 -179.095 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.515 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 5.0 mt-30 -64.3 -17.58 63.78 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.319 -0.863 . . . . 0.0 111.281 -177.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.518 HG12 ' HB2' ' A' ' 79' ' ' ALA . 55.4 t -70.7 -48.06 60.27 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 120.895 -1.128 . . . . 0.0 108.479 179.707 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.437 ' O ' ' OG1' ' A' ' 31' ' ' THR . 4.1 mtpt -56.27 -51.44 68.15 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 179.267 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.473 ' N ' ' OD1' ' A' ' 28' ' ' ASP . 2.8 m-20 -52.56 -38.03 59.03 Favored 'General case' 0 C--N 1.296 -1.741 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.754 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.52 -64.36 0.88 Allowed 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 119.663 -0.815 . . . . 0.0 110.009 -179.277 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.459 HD23 ' SD ' ' A' ' 33' ' ' MET . 18.1 mt -61.13 -24.45 66.27 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.295 -0.878 . . . . 0.0 110.126 -178.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.437 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 53.3 m -59.7 -41.11 90.01 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 178.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.0 mtpm? -72.87 -32.08 65.16 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.359 -179.721 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' MET . . . . . 0.459 ' SD ' HD23 ' A' ' 30' ' ' LEU . 46.8 mtp -67.16 -68.09 0.4 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.01 -1.056 . . . . 0.0 108.956 178.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 12.9 ttt-85 -45.73 -26.44 0.64 Allowed 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -179.659 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.409 ' N ' ' C ' ' A' ' 33' ' ' MET . . . -74.79 -66.18 0.78 Allowed 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 178.389 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.91 -27.55 68.93 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.145 -0.972 . . . . 0.0 109.819 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.03 -42.15 84.73 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.01 -1.056 . . . . 0.0 108.401 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 25.6 mt -65.57 -30.18 70.88 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.112 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -82.53 -35.72 27.01 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.175 -0.953 . . . . 0.0 109.04 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.493 ' HB2' HD22 ' A' ' 6' ' ' ASN . . . -53.73 -26.16 21.98 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 179.277 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -52.14 -46.1 65.26 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.669 -0.644 . . . . 0.0 109.764 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.455 ' HD3' ' H ' ' A' ' 42' ' ' LYS . 4.6 mptt -68.17 3.99 1.43 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.164 -0.96 . . . . 0.0 110.09 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -80.99 144.41 31.83 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.839 -1.163 . . . . 0.0 109.337 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.7 m -154.19 67.9 5.82 Favored Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.147 -0.971 . . . . 0.0 109.932 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.419 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 22.9 Cg_exo -56.64 -42.71 62.25 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 C-N-CA 122.305 2.003 . . . . 0.0 113.527 179.043 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.419 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 65.4 Cg_endo -83.43 -14.18 8.21 Favored 'Trans proline' 0 N--CA 1.494 1.534 0 C-N-CA 121.985 1.79 . . . . 0.0 112.23 -179.231 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 24.0 mtpt 74.2 109.84 0.07 Allowed 'General case' 0 N--CA 1.498 1.955 0 CA-C-O 121.581 0.705 . . . . 0.0 109.539 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.518 ' C ' ' H ' ' A' ' 50' ' ' ASP . 1.5 tt -87.05 -48.06 8.4 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.589 -0.694 . . . . 0.0 109.791 -179.144 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -68.34 40.53 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.082 -1.011 . . . . 0.0 109.381 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.518 ' H ' ' C ' ' A' ' 48' ' ' LEU . 5.6 t0 -146.55 -70.09 0.25 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.251 -0.906 . . . . 0.0 109.598 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.403 ' O ' ' O ' ' A' ' 50' ' ' ASP . 21.9 pttp -64.28 -141.16 0.0 OUTLIER 'General case' 0 C--N 1.298 -1.664 0 O-C-N 121.351 -0.843 . . . . 0.0 108.958 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 38.5 t -74.22 133.51 78.02 Favored Pre-proline 0 N--CA 1.485 1.314 0 O-C-N 120.594 -1.317 . . . . 0.0 109.378 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.41 ' O ' ' CB ' ' A' ' 54' ' ' ASP . 31.4 Cg_endo -83.47 -16.82 6.69 Favored 'Trans proline' 0 N--CA 1.499 1.836 0 C-N-CA 122.489 2.126 . . . . 0.0 112.627 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.41 ' CB ' ' O ' ' A' ' 53' ' ' PRO . 1.0 OUTLIER 77.47 -133.85 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.611 -0.681 . . . . 0.0 109.768 -179.053 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.784 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 12.6 p -167.97 -30.02 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.581 0 O-C-N 120.745 -1.222 . . . . 0.0 113.454 -179.269 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.784 ' CD ' ' H ' ' A' ' 55' ' ' SER . 73.2 Cg_exo -55.63 41.74 0.03 OUTLIER 'Trans proline' 0 N--CA 1.503 2.065 0 C-N-CA 122.243 1.962 . . . . 0.0 113.435 -179.421 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.626 ' N ' ' O ' ' A' ' 55' ' ' SER . 13.2 tt0 50.32 23.63 1.28 Allowed 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 -179.212 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.418 ' N ' ' C ' ' A' ' 56' ' ' PRO . 1.1 mpt? 67.94 -5.78 0.8 Allowed 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 -178.187 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.522 ' N ' ' O ' ' A' ' 56' ' ' PRO . 0.2 OUTLIER -47.75 -51.95 20.4 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-O 121.735 0.779 . . . . 0.0 108.963 178.902 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -52.41 -25.48 10.07 Favored 'General case' 0 C--N 1.3 -1.579 0 C-N-CA 120.497 -0.481 . . . . 0.0 109.842 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -75.81 -57.1 4.08 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 178.526 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -61.98 -33.83 75.03 Favored 'General case' 0 C--N 1.302 -1.479 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.683 179.402 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.401 ' O ' ' N ' ' A' ' 67' ' ' ILE . 1.3 t60 -61.34 -38.97 88.85 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.242 -0.911 . . . . 0.0 108.925 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.58 -32.04 82.89 Favored Glycine 0 N--CA 1.484 1.891 0 N-CA-C 108.874 -1.69 . . . . 0.0 108.874 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.553 ' O ' HG23 ' A' ' 69' ' ' VAL . 52.7 m-85 -81.34 -41.64 21.74 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.185 -1.185 . . . . 0.0 107.995 178.36 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -69.96 -45.38 67.54 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 179.117 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.401 ' N ' ' O ' ' A' ' 63' ' ' HIS . 4.6 mm -55.1 -49.86 68.38 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 178.884 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.462 HD13 HG21 ' A' ' 97' ' ' THR . 14.0 tp -59.03 -41.95 89.03 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.553 HG23 ' O ' ' A' ' 65' ' ' PHE . 41.7 t -60.89 -18.96 18.55 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 178.952 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -79.6 -46.49 7.9 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 110.567 -1.013 . . . . 0.0 110.567 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.533 ' NE2' ' O ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -67.73 -31.26 71.07 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 120.426 -1.632 . . . . 0.0 106.943 179.506 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 14.3 mt -72.84 -32.47 40.36 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.493 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 176.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -63.18 -52.04 63.93 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.454 -0.778 . . . . 0.0 110.013 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.52 -28.53 69.71 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.166 -0.959 . . . . 0.0 109.756 -179.048 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.57 -35.28 67.91 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 120.529 -1.357 . . . . 0.0 108.038 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.1 -33.04 64.72 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 178.349 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 6.8 tptt -67.48 -46.14 73.82 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 178.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 mp -58.48 -33.6 69.97 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.518 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -63.92 -50.59 68.08 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.026 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -74.43 -12.61 60.55 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.639 -0.663 . . . . 0.0 111.395 -178.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -93.76 -10.63 33.57 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 120.622 -1.299 . . . . 0.0 110.536 -178.802 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 99.31 11.14 46.11 Favored Glycine 0 N--CA 1.498 2.772 0 C-N-CA 119.92 -1.133 . . . . 0.0 110.368 179.521 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.4 mmtp -95.91 85.06 3.98 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.094 -1.239 . . . . 0.0 108.282 179.056 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 30.9 t -77.22 -59.4 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.225 -178.77 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.468 ' HD2' ' H ' ' A' ' 85' ' ' LYS . 7.8 mptt -54.49 -37.08 64.86 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 120.771 -1.206 . . . . 0.0 109.221 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -66.93 -42.71 84.85 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 178.439 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.11 -49.09 68.72 Favored 'General case' 0 C--N 1.306 -1.316 0 C-N-CA 119.404 -0.918 . . . . 0.0 108.805 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.43 ' O ' ' OE1' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -61.55 -48.49 80.75 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 179.442 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -54.52 -33.11 59.38 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 120.978 -1.076 . . . . 0.0 108.419 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.514 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -66.39 -32.92 74.6 Favored 'General case' 0 C--N 1.306 -1.286 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 178.55 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -48.19 -50.32 29.54 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.43 ' OE1' ' O ' ' A' ' 88' ' ' GLN . 19.7 mp0 -60.57 -27.96 68.1 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 178.167 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.514 ' N ' ' O ' ' A' ' 90' ' ' ALA . 1.7 tm0? -74.22 -40.24 62.57 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 106.896 -1.52 . . . . 0.0 106.896 178.404 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.457 ' CD1' ' OE1' ' A' ' 71' ' ' GLN . 8.7 mp -64.07 -42.19 97.06 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 179.264 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 6.2 mtpt -57.94 -44.48 86.96 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.885 -1.135 . . . . 0.0 108.256 178.531 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 23.9 m -66.96 -27.79 67.75 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.154 -0.967 . . . . 0.0 109.214 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.462 HG21 HD13 ' A' ' 68' ' ' LEU . 0.9 OUTLIER -62.21 -40.55 96.48 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 178.435 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 69.4 mt -49.83 -39.73 15.33 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.45 -43.95 80.02 Favored 'General case' 0 C--N 1.302 -1.466 0 C-N-CA 118.31 -1.356 . . . . 0.0 108.046 179.213 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.632 ' O ' ' NE2' ' A' ' 103' ' ' GLN . . . -65.83 -27.44 68.25 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.841 0.829 . . . . 0.0 109.305 179.316 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.44 ' O ' ' N ' ' A' ' 105' ' ' TYR . 12.4 t80 -71.71 -27.89 63.32 Favored 'General case' 0 C--N 1.294 -1.821 0 O-C-N 120.384 -1.448 . . . . 0.0 107.794 179.515 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -67.39 -41.84 84.33 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.109 -0.994 . . . . 0.0 110.229 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.632 ' NE2' ' O ' ' A' ' 100' ' ' ALA . 0.7 OUTLIER -62.09 -21.74 65.23 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 105.403 -2.073 . . . . 0.0 105.403 178.663 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.48 -34.95 23.27 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 177.247 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.558 ' C ' ' CD1' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -88.54 8.24 29.15 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.921 -1.112 . . . . 0.0 109.018 -179.617 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.317 0 CA-C-O 117.958 -1.468 . . . . 0.0 109.485 179.868 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 . . . . . 0 N--CA 1.493 1.688 0 CA-C-O 121.64 0.733 . . . . 0.0 109.37 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 17.3 mt -89.07 -49.2 6.9 Favored 'General case' 0 C--N 1.295 -1.777 0 CA-C-O 121.631 0.729 . . . . 0.0 109.083 -178.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -66.86 -23.83 66.07 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 179.03 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -76.2 -49.91 15.92 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.851 -179.208 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.641 HD22 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -52.03 -42.81 63.36 Favored 'General case' 0 C--N 1.307 -1.245 0 O-C-N 121.252 -0.905 . . . . 0.0 108.695 -179.091 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.641 ' N ' HD22 ' A' ' 6' ' ' ASN . 11.0 m95 -57.61 -51.13 70.74 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.1 -1.0 . . . . 0.0 109.245 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -58.61 -30.16 67.03 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.131 -0.981 . . . . 0.0 108.726 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 46.5 m -67.96 -54.51 18.07 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 119.257 -0.977 . . . . 0.0 108.601 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.8 mt -59.05 -37.76 77.8 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 106.966 -1.494 . . . . 0.0 106.966 178.393 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -68.3 -55.07 13.38 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 119.725 -0.79 . . . . 0.0 109.104 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -59.05 -16.4 18.57 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.562 -0.711 . . . . 0.0 109.626 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -74.53 -53.55 9.23 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 179.617 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.9 mt -58.07 -30.69 66.41 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 122.011 -0.431 . . . . 0.0 111.278 -178.198 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.9 ttpp -69.15 -43.11 74.96 Favored 'General case' 0 C--N 1.295 -1.794 0 C-N-CA 118.622 -1.231 . . . . 0.0 108.963 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.532 ' O ' ' N ' ' A' ' 20' ' ' ALA . 53.7 t -57.93 -26.35 28.25 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.61 0 O-C-N 121.11 -0.994 . . . . 0.0 109.52 -179.498 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.489 ' O ' ' N ' ' A' ' 20' ' ' ALA . 9.6 mt -71.66 -72.25 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.084 -1.01 . . . . 0.0 110.499 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -47.12 -27.46 1.41 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.017 -1.052 . . . . 0.0 109.139 -179.395 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.74 2.47 30.33 Favored 'General case' 0 N--CA 1.5 2.061 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 178.853 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.608 ' C ' ' H ' ' A' ' 22' ' ' ASN . . . -56.66 -40.44 75.5 Favored 'General case' 0 N--CA 1.491 1.579 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 178.809 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 57.25 -13.28 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.988 -0.445 . . . . 0.0 110.84 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.608 ' H ' ' C ' ' A' ' 20' ' ' ALA . 0.4 OUTLIER -146.83 145.57 29.92 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 120.656 -1.278 . . . . 0.0 108.814 178.834 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -53.98 -35.44 61.83 Favored 'General case' 0 C--N 1.296 -1.747 0 O-C-N 121.901 -0.5 . . . . 0.0 111.761 -179.172 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.77 -49.36 76.84 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 120.987 -1.07 . . . . 0.0 110.671 -178.163 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.547 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 18.9 mt-30 -67.3 -17.68 64.87 Favored 'General case' 0 C--N 1.3 -1.551 0 O-C-N 121.038 -1.039 . . . . 0.0 110.271 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.449 HG12 ' HB2' ' A' ' 79' ' ' ALA . 47.2 t -73.05 -51.05 28.05 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.078 -1.014 . . . . 0.0 108.587 179.432 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.427 ' O ' ' OG1' ' A' ' 31' ' ' THR . 3.2 mppt? -54.21 -44.65 71.84 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -53.89 -38.79 65.16 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.046 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.77 -65.03 0.79 Allowed 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.483 -0.761 . . . . 0.0 110.452 -179.458 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 26.3 mt -61.7 -27.86 69.0 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.144 -0.972 . . . . 0.0 110.392 -178.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.427 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 33.7 m -62.25 -40.38 95.99 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 178.557 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 12.2 mmmt -72.39 -30.36 64.59 Favored 'General case' 0 C--N 1.296 -1.719 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.386 -179.346 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' MET . . . . . 0.409 ' O ' ' C ' ' A' ' 34' ' ' ARG . 48.7 mtt -63.71 -67.55 0.42 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.024 -1.048 . . . . 0.0 108.797 178.731 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.721 HH21 ' CB ' ' A' ' 73' ' ' ASP . 0.3 OUTLIER -44.01 -29.89 0.65 Allowed 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 -179.243 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.24 -59.1 2.89 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 178.623 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.77 -34.81 78.73 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.119 -0.988 . . . . 0.0 109.451 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.55 -38.46 71.93 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.194 -0.941 . . . . 0.0 108.697 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 11.9 mt -67.8 -29.0 68.07 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -85.11 -38.78 18.69 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.077 -1.015 . . . . 0.0 109.336 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.413 ' O ' ' CB ' ' A' ' 43' ' ' ALA . . . -56.5 -23.13 37.4 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.159 -0.963 . . . . 0.0 108.719 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.49 ' C ' ' H ' ' A' ' 43' ' ' ALA . 0.5 OUTLIER -52.19 -51.55 57.42 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.264 -0.898 . . . . 0.0 108.94 179.315 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -67.04 10.11 0.16 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.406 -0.809 . . . . 0.0 109.444 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.49 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -79.37 128.71 33.67 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.878 -1.139 . . . . 0.0 108.772 179.682 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.665 HG23 ' O ' ' A' ' 44' ' ' THR . 12.2 t -154.56 61.93 3.4 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.335 -0.853 . . . . 0.0 109.637 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.453 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 86.4 Cg_exo -43.06 -37.31 6.36 Favored 'Trans proline' 0 C--N 1.304 -1.788 0 C-N-CA 122.716 2.277 . . . . 0.0 114.284 179.049 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.453 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 23.1 Cg_endo -93.75 -16.28 0.72 Allowed 'Trans proline' 0 N--CA 1.483 0.86 0 C-N-CA 122.566 2.177 . . . . 0.0 111.847 -179.198 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 21.3 mttm 80.06 98.29 0.06 Allowed 'General case' 0 N--CA 1.5 2.027 0 CA-C-O 121.25 0.547 . . . . 0.0 109.659 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.511 HD23 ' O ' ' A' ' 48' ' ' LEU . 1.0 OUTLIER -84.28 9.19 13.61 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.371 -0.831 . . . . 0.0 109.323 -179.89 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -99.61 27.82 5.08 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -148.87 -50.33 0.15 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.385 -0.822 . . . . 0.0 110.324 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -65.56 -160.55 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.181 -0.95 . . . . 0.0 109.377 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 20.8 t -73.13 129.99 85.4 Favored Pre-proline 0 N--CA 1.485 1.312 0 O-C-N 120.908 -1.12 . . . . 0.0 109.184 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -82.67 -9.11 11.19 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 122.64 2.227 . . . . 0.0 111.437 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 72.59 -114.48 0.05 Allowed 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 -178.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.737 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 1.4 t -167.87 -32.45 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.719 0 O-C-N 120.2 -1.563 . . . . 0.0 113.288 -179.498 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.737 ' CD ' ' H ' ' A' ' 55' ' ' SER . 68.1 Cg_exo -56.44 40.98 0.04 OUTLIER 'Trans proline' 0 N--CA 1.502 2.024 0 C-N-CA 122.068 1.845 . . . . 0.0 112.774 -179.739 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.645 ' N ' ' O ' ' A' ' 55' ' ' SER . 41.1 tt0 50.79 23.18 1.32 Allowed 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 106.999 -1.482 . . . . 0.0 106.999 -178.883 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.476 ' SD ' ' O ' ' A' ' 57' ' ' GLU . 0.3 OUTLIER 66.38 -3.51 0.83 Allowed 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 -178.272 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.558 ' N ' ' O ' ' A' ' 56' ' ' PRO . 0.9 OUTLIER -48.43 -48.38 37.41 Favored 'General case' 0 N--CA 1.487 1.404 0 CA-C-O 121.851 0.834 . . . . 0.0 109.424 178.984 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -51.13 -26.6 6.88 Favored 'General case' 0 C--N 1.295 -1.792 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 -179.015 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -77.93 -57.1 3.98 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 120.842 -1.161 . . . . 0.0 107.924 177.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.6 mtt-85 -58.44 -30.6 67.04 Favored 'General case' 0 N--CA 1.488 1.435 0 CA-C-O 121.366 0.603 . . . . 0.0 109.483 179.513 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.614 ' NE2' HD11 ' A' ' 67' ' ' ILE . 1.8 t60 -63.65 -39.74 95.1 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.276 -0.89 . . . . 0.0 109.041 179.474 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -61.51 -31.92 79.32 Favored Glycine 0 N--CA 1.486 2.009 0 C-N-CA 118.737 -1.697 . . . . 0.0 109.132 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -81.8 -40.08 23.08 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.054 -1.262 . . . . 0.0 108.291 178.304 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -70.73 -48.62 53.55 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 178.766 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.614 HD11 ' NE2' ' A' ' 63' ' ' HIS . 20.5 mm -56.49 -39.06 59.42 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 15.8 tp -56.99 -44.3 82.58 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.4 HG13 ' HG2' ' A' ' 34' ' ' ARG . 20.3 t -63.01 -17.22 18.99 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.45 0 O-C-N 120.918 -1.114 . . . . 0.0 109.095 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -76.24 -40.91 27.75 Favored Glycine 0 N--CA 1.487 2.079 0 C-N-CA 119.859 -1.162 . . . . 0.0 111.011 -178.485 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.592 HE21 ' C ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -78.38 -32.67 49.02 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.998 -1.295 . . . . 0.0 107.841 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 7.0 mt -74.19 -30.45 26.98 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.679 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 177.029 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.721 ' CB ' HH21 ' A' ' 34' ' ' ARG . 0.0 OUTLIER -61.1 -52.57 64.36 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 119.679 -0.808 . . . . 0.0 109.528 -179.658 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -62.27 -32.11 72.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.032 -1.042 . . . . 0.0 108.978 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.46 -34.55 65.44 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 120.87 -1.144 . . . . 0.0 108.252 179.148 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.71 -30.34 55.64 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 106.943 -1.503 . . . . 0.0 106.943 178.638 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.6 tptt -70.85 -48.94 51.23 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-O 121.657 0.742 . . . . 0.0 109.66 178.515 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.445 HD23 ' HB3' ' A' ' 86' ' ' GLU . 8.1 mp -56.93 -34.66 68.19 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 -179.428 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.449 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -64.62 -49.7 70.02 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -73.08 -14.31 61.37 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.634 -0.666 . . . . 0.0 111.314 -179.055 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -94.55 -10.1 33.18 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.801 -1.187 . . . . 0.0 110.312 -178.741 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 97.38 12.6 47.84 Favored Glycine 0 N--CA 1.499 2.877 0 C-N-CA 120.237 -0.982 . . . . 0.0 110.77 178.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 14.3 mmtp -94.94 83.84 4.04 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.009 -1.289 . . . . 0.0 108.687 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 26.1 t -77.34 -56.45 7.87 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 O-C-N 121.79 -0.569 . . . . 0.0 110.009 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.496 ' HD2' ' H ' ' A' ' 85' ' ' LYS . 8.6 mptt -49.64 -39.42 35.94 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.221 -0.924 . . . . 0.0 108.648 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.547 ' OE1' ' N ' ' A' ' 86' ' ' GLU . 47.7 mp0 -70.18 -44.55 68.52 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 121.402 -0.811 . . . . 0.0 109.007 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.13 -38.91 86.38 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 119.359 -0.936 . . . . 0.0 109.338 -179.704 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.425 ' O ' ' N ' ' A' ' 91' ' ' ALA . 3.6 tt0 -61.39 -62.77 1.59 Allowed 'General case' 0 C--N 1.294 -1.825 0 CA-C-O 121.632 0.729 . . . . 0.0 109.607 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -49.76 -34.95 20.68 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.097 -1.002 . . . . 0.0 109.583 -179.317 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.531 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -62.03 -35.13 77.67 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 178.697 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.425 ' N ' ' O ' ' A' ' 88' ' ' GLN . . . -50.22 -43.43 52.78 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.027 -1.046 . . . . 0.0 108.204 178.664 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -62.8 -23.91 67.48 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 178.4 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.531 ' N ' ' O ' ' A' ' 90' ' ' ALA . 1.6 tm0? -73.8 -37.92 64.77 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 106.441 -1.688 . . . . 0.0 106.441 177.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.435 ' N ' HD12 ' A' ' 94' ' ' LEU . 10.9 mp -68.29 -45.46 72.98 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -50.26 -38.99 43.63 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 107.85 -1.166 . . . . 0.0 107.85 179.281 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 34.7 m -72.79 -32.07 65.31 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.425 -0.797 . . . . 0.0 109.238 177.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.9 m -58.65 -46.97 85.99 Favored 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 4.3 mm -49.15 -40.91 13.76 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 179.305 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 10.1 ttt180 -64.5 -55.36 21.22 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 119.22 -0.992 . . . . 0.0 109.294 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.404 ' O ' ' OE1' ' A' ' 103' ' ' GLN . . . -63.4 -19.25 64.52 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.181 -0.949 . . . . 0.0 109.021 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.422 ' CD1' ' C ' ' A' ' 101' ' ' TYR . 9.1 t80 -74.56 -31.11 61.98 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 178.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.4 ' OD1' ' C ' ' A' ' 102' ' ' ASN . 0.2 OUTLIER -66.67 -42.36 86.7 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.998 -1.064 . . . . 0.0 110.096 -179.908 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.517 ' OE1' ' N ' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -63.2 -15.76 57.99 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 116.808 -1.957 . . . . 0.0 105.778 179.443 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.517 ' N ' ' OE1' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -82.27 -34.19 28.84 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 106.759 -1.571 . . . . 0.0 106.759 175.572 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.527 ' O ' ' CG ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -91.76 6.36 46.28 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 179.338 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.32 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 179.63 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 . . . . . 0 N--CA 1.491 1.595 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.7 pp -88.53 -32.14 18.33 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 107.175 -1.417 . . . . 0.0 107.175 179.237 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -67.94 -25.1 65.29 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 105.579 -2.008 . . . . 0.0 105.579 177.037 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -72.95 -36.52 67.18 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.771 HD22 ' HB2' ' A' ' 40' ' ' ALA . 0.1 OUTLIER -56.95 -41.28 78.0 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 179.452 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 16.9 m95 -57.88 -46.91 84.16 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.079 -1.013 . . . . 0.0 108.841 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -63.2 -28.89 70.35 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 120.884 -1.135 . . . . 0.0 108.548 179.238 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 89.0 m -68.55 -62.86 1.2 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.464 -0.773 . . . . 0.0 109.733 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.2 pp -57.25 -31.3 65.41 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 118.451 -1.3 . . . . 0.0 108.181 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -70.03 -62.59 1.33 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.072 -1.018 . . . . 0.0 109.651 178.67 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -58.11 -11.89 2.97 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.368 -0.832 . . . . 0.0 109.79 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.462 ' O ' HG22 ' A' ' 16' ' ' VAL . 2.1 m-20 -72.65 -53.23 12.36 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 179.063 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.2 mt -56.75 -24.85 52.92 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.667 -178.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -68.67 -54.99 12.92 Favored 'General case' 0 C--N 1.301 -1.52 0 C-N-CA 118.414 -1.314 . . . . 0.0 109.166 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.636 ' O ' ' N ' ' A' ' 20' ' ' ALA . 12.5 m -55.01 -20.96 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 120.731 -1.23 . . . . 0.0 110.448 -179.048 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.498 ' O ' ' N ' ' A' ' 20' ' ' ALA . 10.6 mt -71.53 -72.88 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 O-C-N 120.373 -1.454 . . . . 0.0 109.622 179.416 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -47.71 -27.37 1.93 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.837 -1.164 . . . . 0.0 108.749 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.4 -0.19 32.94 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.636 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -57.99 -49.0 78.34 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 179.405 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 67.88 -12.33 0.31 Allowed 'General case' 0 C--N 1.296 -1.742 0 O-C-N 121.772 -0.58 . . . . 0.0 109.926 179.336 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.495 ' N ' ' OD1' ' A' ' 22' ' ' ASN . 0.5 OUTLIER -144.84 143.8 30.8 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.946 -1.096 . . . . 0.0 109.554 178.925 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.21 -24.91 57.7 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 121.882 -0.511 . . . . 0.0 111.193 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.46 -51.61 64.92 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.073 -1.017 . . . . 0.0 109.965 -179.154 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.509 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 9.4 mt-30 -68.46 -17.55 64.22 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.285 -0.885 . . . . 0.0 110.548 -179.475 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.442 HG12 ' HB2' ' A' ' 79' ' ' ALA . 48.9 t -71.74 -50.23 40.2 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 O-C-N 120.962 -1.087 . . . . 0.0 108.661 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.455 ' O ' ' OG1' ' A' ' 31' ' ' THR . 5.1 mppt? -54.5 -53.22 57.27 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 106.954 -1.498 . . . . 0.0 106.954 179.164 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -52.36 -38.87 59.86 Favored 'General case' 0 C--N 1.296 -1.738 0 CA-C-N 114.717 -1.129 . . . . 0.0 109.453 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.58 -67.75 0.46 Allowed 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.468 -0.77 . . . . 0.0 110.433 -179.098 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.493 ' HB3' HD12 ' A' ' 76' ' ' LEU . 33.9 mt -59.16 -25.77 64.2 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.345 -0.847 . . . . 0.0 109.913 -178.735 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.455 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 20.8 m -61.39 -38.98 89.01 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 179.124 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 33.1 mttm -74.17 -31.06 62.54 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' MET . . . . . 0.442 ' SD ' HD23 ' A' ' 30' ' ' LEU . 41.2 mtp -66.65 -65.38 0.69 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.993 -1.067 . . . . 0.0 108.173 178.205 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.445 HH11 ' HD3' ' A' ' 34' ' ' ARG . 18.2 ttt-85 -47.68 -25.56 1.24 Allowed 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.0 -60.12 2.41 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 119.843 -0.743 . . . . 0.0 109.025 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.78 -33.21 75.15 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.018 -1.051 . . . . 0.0 109.826 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.48 -39.73 73.72 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.087 -1.008 . . . . 0.0 108.795 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.5 mt -65.96 -32.11 73.41 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.405 -0.809 . . . . 0.0 108.878 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -86.22 -36.61 19.33 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.224 -0.922 . . . . 0.0 109.986 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.771 ' HB2' HD22 ' A' ' 6' ' ' ASN . . . -60.02 -22.24 62.36 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.151 -0.968 . . . . 0.0 110.461 -179.075 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.579 ' C ' ' H ' ' A' ' 43' ' ' ALA . 5.0 tm0? -48.84 -66.54 0.38 Allowed 'General case' 0 C--N 1.3 -1.556 0 O-C-N 120.879 -1.138 . . . . 0.0 109.335 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.455 ' HD2' ' H ' ' A' ' 42' ' ' LYS . 2.8 mptp? -53.96 5.04 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.625 -0.672 . . . . 0.0 110.71 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.579 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -78.48 134.47 37.32 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.607 -1.308 . . . . 0.0 109.515 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -152.18 72.1 7.74 Favored Pre-proline 0 N--CA 1.492 1.656 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.44 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 52.0 Cg_exo -46.81 -39.12 23.91 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.521 2.147 . . . . 0.0 113.905 -179.305 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.44 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 89.5 Cg_endo -97.63 -95.75 0.0 OUTLIER 'Trans proline' 0 C--N 1.319 -1.02 0 C-N-CA 122.426 2.084 . . . . 0.0 111.852 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 4.0 pttt -175.6 116.57 0.15 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.283 -0.886 . . . . 0.0 110.005 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.54 ' CD2' ' H ' ' A' ' 49' ' ' GLU . 0.4 OUTLIER -83.86 -172.66 4.28 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 178.116 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.54 ' H ' ' CD2' ' A' ' 48' ' ' LEU . 59.8 mt-10 49.27 23.3 0.79 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.76 -1.212 . . . . 0.0 108.814 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.403 ' N ' ' C ' ' A' ' 48' ' ' LEU . 4.3 m-20 -140.49 -70.5 0.38 Allowed 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.421 ' HG3' ' N ' ' A' ' 52' ' ' SER . 17.5 pttp -66.96 -121.69 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 178.607 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.421 ' N ' ' HG3' ' A' ' 51' ' ' LYS . 9.1 t -81.89 114.1 47.91 Favored Pre-proline 0 N--CA 1.488 1.446 0 O-C-N 120.539 -1.351 . . . . 0.0 109.581 179.134 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -90.19 -16.24 1.8 Allowed 'Trans proline' 0 N--CA 1.491 1.372 0 C-N-CA 122.452 2.101 . . . . 0.0 112.023 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 65.05 -131.6 0.27 Allowed 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 -178.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.756 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 7.5 t -170.06 -33.84 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 120.859 -1.151 . . . . 0.0 112.363 179.632 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.756 ' CD ' ' H ' ' A' ' 55' ' ' SER . 95.0 Cg_exo -51.52 59.35 0.02 OUTLIER 'Trans proline' 0 N--CA 1.505 2.178 0 C-N-CA 122.608 2.205 . . . . 0.0 114.116 -178.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.634 ' N ' ' O ' ' A' ' 55' ' ' SER . 93.5 mt-10 42.42 29.51 0.16 Allowed 'General case' 0 N--CA 1.493 1.725 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.473 ' SD ' ' C ' ' A' ' 57' ' ' GLU . 1.3 mpt? 65.27 -8.17 0.27 Allowed 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 -178.107 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.61 ' H ' ' C ' ' A' ' 57' ' ' GLU . 2.4 tmtm? -48.1 -43.27 30.77 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-O 121.804 0.811 . . . . 0.0 109.169 179.296 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -56.29 -27.08 54.23 Favored 'General case' 0 C--N 1.294 -1.834 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 -179.226 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -73.94 -53.14 10.78 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.662 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.5 mtt85 -61.79 -33.0 73.33 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.392 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.427 ' O ' ' N ' ' A' ' 67' ' ' ILE . 0.7 OUTLIER -63.29 -35.88 81.84 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.226 -0.921 . . . . 0.0 108.704 179.594 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.34 -31.82 80.11 Favored Glycine 0 N--CA 1.485 1.915 0 N-CA-C 108.326 -1.91 . . . . 0.0 108.326 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.466 ' HZ ' ' HZ1' ' A' ' 104' ' ' LYS . 65.4 m-85 -81.67 -38.01 26.56 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 178.011 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -72.14 -47.4 51.33 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.427 ' N ' ' O ' ' A' ' 63' ' ' HIS . 4.8 mm -56.2 -48.88 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 179.037 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 14.8 tp -57.41 -44.93 84.99 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 65' ' ' PHE . 32.1 t -65.92 -19.93 26.49 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.366 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 178.473 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -77.75 -48.39 7.92 Favored Glycine 0 N--CA 1.488 2.145 0 C-N-CA 120.1 -1.047 . . . . 0.0 110.549 -178.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.58 HE21 ' C ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -71.37 -29.79 65.38 Favored 'General case' 0 C--N 1.305 -1.341 0 O-C-N 120.823 -1.398 . . . . 0.0 107.583 179.725 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 8.1 mt -75.16 -33.64 29.27 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.507 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 176.158 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -62.74 -58.69 6.59 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.256 -0.902 . . . . 0.0 109.332 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.72 -26.81 67.45 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.64 -31.13 63.35 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 107.821 -1.178 . . . . 0.0 107.821 178.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.493 HD12 ' HB3' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -57.07 -33.55 67.38 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 106.236 -1.764 . . . . 0.0 106.236 178.155 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.8 tptt -68.16 -48.17 66.06 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.517 179.07 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.5 mp -57.69 -34.95 69.97 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.442 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -64.21 -50.4 68.2 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 178.212 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -73.44 -12.0 60.65 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.47 -0.769 . . . . 0.0 111.352 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -95.12 -12.81 25.8 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.663 -1.273 . . . . 0.0 110.23 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 99.28 11.85 43.96 Favored Glycine 0 N--CA 1.495 2.607 0 C-N-CA 120.206 -0.997 . . . . 0.0 110.688 179.299 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.3 mmtp -93.65 78.68 4.28 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 120.887 -1.361 . . . . 0.0 108.135 179.203 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 26.3 t -75.91 -50.67 22.37 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.679 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.72 -179.042 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.455 ' HD2' ' H ' ' A' ' 85' ' ' LYS . 6.9 mptt -53.0 -38.7 62.53 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 120.936 -1.102 . . . . 0.0 108.18 179.119 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.541 ' CD ' ' N ' ' A' ' 86' ' ' GLU . 4.7 mp0 -69.08 -42.95 75.52 Favored 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 178.715 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.5 -51.97 44.72 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 119.532 -0.867 . . . . 0.0 109.707 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.5 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -60.44 -49.45 77.51 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 -179.893 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -55.0 -37.29 66.39 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.853 -1.155 . . . . 0.0 108.402 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.518 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -65.68 -31.91 73.18 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 178.313 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.5 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -49.87 -43.24 49.09 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 178.858 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -65.43 -27.51 68.57 Favored 'General case' 0 C--N 1.306 -1.285 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 178.128 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.518 ' N ' ' O ' ' A' ' 90' ' ' ALA . 1.6 tm0? -73.42 -41.25 63.5 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 106.605 -1.628 . . . . 0.0 106.605 177.805 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.449 HD11 ' OE1' ' A' ' 71' ' ' GLN . 7.4 mp -67.56 -37.05 82.1 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 108.315 -0.995 . . . . 0.0 108.315 179.038 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 2.4 mtpt -53.89 -39.42 65.75 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 120.049 -1.657 . . . . 0.0 106.685 177.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.3 m -71.05 -26.01 62.89 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.373 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.431 ' O ' ' N ' ' A' ' 101' ' ' TYR . 1.2 m -60.84 -46.33 91.0 Favored 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 179.321 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 81.4 mt -51.33 -43.01 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 179.564 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -62.95 -56.76 14.33 Favored 'General case' 0 C--N 1.307 -1.269 0 C-N-CA 119.633 -0.827 . . . . 0.0 109.816 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.432 ' O ' ' HG3' ' A' ' 103' ' ' GLN . . . -63.68 -21.68 66.51 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.858 -1.151 . . . . 0.0 108.828 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.629 ' CE2' ' NZ ' ' A' ' 104' ' ' LYS . 11.2 t80 -75.89 -27.46 57.72 Favored 'General case' 0 C--N 1.291 -1.938 0 O-C-N 120.351 -1.468 . . . . 0.0 107.328 178.823 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.406 ' O ' ' N ' ' A' ' 106' ' ' GLY . 0.2 OUTLIER -67.06 -36.25 81.63 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 119.588 -0.845 . . . . 0.0 109.944 -179.762 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.432 ' HG3' ' O ' ' A' ' 100' ' ' ALA . 0.0 OUTLIER -65.32 -23.68 67.07 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 105.158 -2.164 . . . . 0.0 105.158 178.814 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.629 ' NZ ' ' CE2' ' A' ' 101' ' ' TYR . 0.0 OUTLIER -80.95 -30.86 35.13 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 176.601 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.549 ' C ' ' CD1' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -94.84 7.74 44.96 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.186 -0.947 . . . . 0.0 108.782 179.994 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.406 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.492 2.413 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.503 0.668 . . . . 0.0 109.296 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 60.9 mt -89.26 -48.27 7.48 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -63.64 -23.71 67.49 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 178.723 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -72.97 -47.37 45.97 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ASN . . . . . 0.524 HD22 ' HB2' ' A' ' 40' ' ' ALA . 0.1 OUTLIER -53.99 -38.85 65.51 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 -179.814 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 8.2 m95 -55.89 -55.58 30.87 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.146 -0.971 . . . . 0.0 109.621 -179.397 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -52.47 -29.8 26.62 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 120.586 -1.321 . . . . 0.0 109.689 -179.053 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 53.5 m -68.94 -65.38 0.71 Allowed 'General case' 0 N--CA 1.487 1.421 0 O-C-N 120.837 -1.165 . . . . 0.0 109.599 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.6 pp -57.99 -30.29 65.94 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 118.66 -1.216 . . . . 0.0 108.454 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -71.62 -59.94 2.49 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.862 -1.149 . . . . 0.0 109.209 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.5 t0 -57.38 -13.09 3.01 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.291 -0.881 . . . . 0.0 109.632 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.456 ' O ' HG22 ' A' ' 16' ' ' VAL . 2.1 m-20 -72.73 -52.37 15.41 Favored 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 107.166 -1.42 . . . . 0.0 107.166 179.214 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.6 mt -56.16 -25.9 48.33 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-O 121.058 0.456 . . . . 0.0 110.779 -179.004 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 25.3 ttmt -68.68 -56.16 9.08 Favored 'General case' 0 C--N 1.3 -1.55 0 C-N-CA 118.669 -1.212 . . . . 0.0 109.215 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.643 ' O ' ' N ' ' A' ' 20' ' ' ALA . 14.3 m -54.28 -20.42 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 C-N-CA 118.771 -1.172 . . . . 0.0 110.578 -178.701 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 9.3 mt -71.28 -72.08 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 O-C-N 120.339 -1.476 . . . . 0.0 109.093 179.212 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -48.47 -27.4 2.65 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.871 -1.143 . . . . 0.0 108.639 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -101.61 0.2 35.9 Favored 'General case' 0 N--CA 1.495 1.825 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.643 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -59.93 -43.56 94.87 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 179.82 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 59.46 -9.08 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.036 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.522 ' H ' ' C ' ' A' ' 20' ' ' ALA . 0.6 OUTLIER -146.32 143.29 29.03 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 120.604 -1.31 . . . . 0.0 109.653 178.609 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.78 -29.71 54.89 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.679 -0.638 . . . . 0.0 111.423 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.67 -50.85 70.82 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.958 -1.089 . . . . 0.0 110.107 -178.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.499 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 6.3 mt-30 -68.7 -19.11 64.36 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.137 -0.977 . . . . 0.0 110.395 -179.582 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.484 HG12 ' HB2' ' A' ' 79' ' ' ALA . 43.0 t -71.95 -50.59 36.67 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 120.945 -1.097 . . . . 0.0 108.709 179.639 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.432 ' O ' ' OG1' ' A' ' 31' ' ' THR . 5.1 mtpt -54.79 -55.3 31.57 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 179.359 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -50.31 -38.36 41.19 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.85 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.56 -62.89 1.2 Allowed 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.243 -0.911 . . . . 0.0 110.05 -179.278 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 71.7 mt -61.46 -20.47 63.16 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.378 -0.826 . . . . 0.0 110.25 -179.024 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.432 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 56.7 m -61.21 -47.48 85.9 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 178.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.492 ' CB ' ' NZ ' ' A' ' 32' ' ' LYS . 0.4 OUTLIER -70.93 -25.81 62.91 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 121.807 -0.558 . . . . 0.0 109.793 -179.028 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 33' ' ' MET . . . . . 0.448 ' C ' ' N ' ' A' ' 35' ' ' ALA . 28.2 mtp -67.35 -66.94 0.5 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.784 -1.197 . . . . 0.0 108.905 178.586 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 22.0 ttt-85 -48.37 -21.58 0.55 Allowed 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.448 ' N ' ' C ' ' A' ' 33' ' ' MET . . . -75.06 -63.02 1.35 Allowed 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 178.201 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.25 -28.52 69.78 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.163 -0.961 . . . . 0.0 109.565 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.79 -41.83 87.6 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.071 -1.018 . . . . 0.0 108.648 179.645 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 22.7 mt -65.91 -28.62 69.08 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -85.94 -35.63 20.35 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.26 -0.9 . . . . 0.0 109.821 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.524 ' HB2' HD22 ' A' ' 6' ' ' ASN . . . -55.64 -29.83 59.93 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.028 -1.045 . . . . 0.0 108.974 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.478 ' NE2' ' C ' ' A' ' 41' ' ' GLN . 1.0 OUTLIER -48.06 -53.02 17.78 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-O 122.112 0.958 . . . . 0.0 108.546 178.824 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.434 ' HG2' ' H ' ' A' ' 42' ' ' LYS . 1.6 mmmm -65.35 6.92 0.24 Allowed 'General case' 0 C--N 1.297 -1.688 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.762 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.463 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -81.66 145.56 30.5 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.827 -1.17 . . . . 0.0 110.127 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.6 p -152.05 67.91 7.19 Favored Pre-proline 0 N--CA 1.492 1.661 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.443 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 73.3 Cg_exo -42.87 -38.7 7.05 Favored 'Trans proline' 0 C--N 1.304 -1.795 0 C-N-CA 122.457 2.105 . . . . 0.0 113.376 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.443 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 94.3 Cg_endo -103.07 -98.04 0.0 OUTLIER 'Trans proline' 0 C--N 1.32 -0.935 0 C-N-CA 122.647 2.232 . . . . 0.0 111.983 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.2 102.78 0.08 Allowed 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 -179.348 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.441 HD23 ' O ' ' A' ' 48' ' ' LEU . 1.2 tt -82.05 34.61 0.41 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.796 -1.19 . . . . 0.0 109.733 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.437 ' O ' ' OD1' ' A' ' 50' ' ' ASP . 7.4 pt-20 -133.84 22.67 3.9 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 178.28 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.437 ' OD1' ' O ' ' A' ' 49' ' ' GLU . 0.4 OUTLIER -151.75 -44.76 0.11 Allowed 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -179.161 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.475 ' HG3' ' N ' ' A' ' 52' ' ' SER . 10.3 ptmm? -66.89 -152.78 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.55 -0.719 . . . . 0.0 109.543 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.475 ' N ' ' HG3' ' A' ' 51' ' ' LYS . 7.5 t -77.03 118.73 73.87 Favored Pre-proline 0 N--CA 1.485 1.315 0 O-C-N 120.787 -1.195 . . . . 0.0 109.173 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -83.54 -15.36 7.44 Favored 'Trans proline' 0 N--CA 1.493 1.477 0 C-N-CA 122.327 2.018 . . . . 0.0 111.761 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 47.9 t0 60.47 -132.84 0.79 Allowed 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 -179.077 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.813 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 11.7 t -165.6 -26.97 0.0 OUTLIER Pre-proline 0 N--CA 1.495 1.79 0 O-C-N 120.328 -1.483 . . . . 0.0 113.898 -179.273 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.813 ' CD ' ' H ' ' A' ' 55' ' ' SER . 62.7 Cg_exo -56.51 47.29 0.04 OUTLIER 'Trans proline' 0 N--CA 1.504 2.106 0 C-N-CA 122.204 1.936 . . . . 0.0 113.346 -179.605 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.61 ' N ' ' O ' ' A' ' 55' ' ' SER . 0.6 OUTLIER 48.64 27.5 1.52 Allowed 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 -179.005 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.498 ' SD ' ' OE2' ' A' ' 57' ' ' GLU . 1.6 mpp? 64.04 -4.75 0.35 Allowed 'General case' 0 C--N 1.308 -1.202 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -178.213 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.545 ' N ' ' O ' ' A' ' 56' ' ' PRO . 0.1 OUTLIER -48.2 -44.76 33.06 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.947 0.88 . . . . 0.0 108.668 179.009 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.412 ' H ' ' HB2' ' A' ' 56' ' ' PRO . 2.7 t70 -56.41 -25.92 51.62 Favored 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.488 ' N ' ' O ' ' A' ' 58' ' ' MET . 15.6 t80 -76.18 -54.08 7.34 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 177.71 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.4 mtt85 -59.55 -30.35 68.56 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 179.142 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.703 ' CE1' HD11 ' A' ' 67' ' ' ILE . 2.4 t60 -61.98 -40.97 97.44 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -62.16 -33.57 86.3 Favored Glycine 0 N--CA 1.484 1.863 0 N-CA-C 109.091 -1.604 . . . . 0.0 109.091 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -81.79 -37.9 26.42 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.012 -1.287 . . . . 0.0 108.264 178.543 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -71.99 -47.44 52.0 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 178.882 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.703 HD11 ' CE1' ' A' ' 63' ' ' HIS . 15.8 mm -54.55 -45.09 71.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 12.8 tp -57.81 -44.49 86.42 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 42.6 t -60.7 -15.15 10.75 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 O-C-N 121.076 -1.015 . . . . 0.0 109.265 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -79.64 -47.66 7.15 Favored Glycine 0 N--CA 1.49 2.265 0 C-N-CA 119.786 -1.197 . . . . 0.0 110.682 -179.095 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.55 HE21 ' C ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -69.6 -29.84 67.46 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.699 -1.471 . . . . 0.0 107.532 179.894 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 4.7 mt -73.46 -34.34 42.46 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 176.479 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -63.28 -56.11 19.22 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.445 -0.784 . . . . 0.0 109.694 -179.694 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -62.2 -29.09 70.14 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.225 -0.922 . . . . 0.0 109.354 -179.437 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.31 -29.59 62.8 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 120.642 -1.286 . . . . 0.0 108.229 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.69 -33.84 66.84 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 106.211 -1.774 . . . . 0.0 106.211 178.161 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.1 tptt -68.4 -46.79 69.03 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.301 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.8 mp -57.4 -35.1 69.6 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.484 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -63.74 -50.1 70.41 Favored 'General case' 0 C--N 1.297 -1.705 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 178.172 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -74.87 -13.07 60.51 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.494 -0.753 . . . . 0.0 111.616 -178.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -93.84 -9.23 38.04 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 120.606 -1.309 . . . . 0.0 110.205 -179.119 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 97.35 12.65 47.78 Favored Glycine 0 N--CA 1.499 2.854 0 O-C-N 121.032 -1.042 . . . . 0.0 110.592 178.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.4 mmtp -95.08 81.24 3.66 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.044 -1.268 . . . . 0.0 108.127 179.235 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 53.1 t -76.51 -61.83 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.414 -178.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.3 mtmm -49.81 -34.95 21.13 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.03 -1.044 . . . . 0.0 108.427 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.611 ' H ' ' CD ' ' A' ' 86' ' ' GLU . 29.8 mp0 -68.27 -45.8 72.17 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 178.216 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.13 -46.52 73.86 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 119.463 -0.895 . . . . 0.0 108.871 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.474 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -59.71 -51.88 67.9 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 179.456 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.24 -33.85 71.5 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 120.902 -1.124 . . . . 0.0 108.338 179.049 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -66.35 -26.95 67.52 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 178.569 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -56.64 -47.45 79.7 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 178.624 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -64.72 -22.79 67.06 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 178.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -72.93 -39.59 66.14 Favored 'General case' 0 N--CA 1.485 1.275 0 N-CA-C 106.18 -1.785 . . . . 0.0 106.18 177.908 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.433 ' CD1' ' OE1' ' A' ' 71' ' ' GLN . 3.9 mp -63.46 -50.63 68.96 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 178.787 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 4.5 mtpp -50.33 -42.53 52.97 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 178.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 5.3 m -70.88 -40.95 71.95 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.34 -0.85 . . . . 0.0 109.034 179.048 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -61.15 -40.43 93.84 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 72.9 mt -54.94 -33.15 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -59.32 -50.82 72.52 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 119.656 -0.818 . . . . 0.0 109.564 -179.025 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.66 -34.91 78.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.824 -1.172 . . . . 0.0 108.619 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.489 ' CD1' ' C ' ' A' ' 101' ' ' TYR . 1.1 t80 -68.09 -26.11 65.66 Favored 'General case' 0 C--N 1.293 -1.871 0 O-C-N 120.579 -1.326 . . . . 0.0 107.829 179.131 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.52 ' O ' ' N ' ' A' ' 106' ' ' GLY . 0.1 OUTLIER -65.92 -34.91 79.21 Favored 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 119.162 -1.015 . . . . 0.0 110.057 -179.442 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -21.83 66.58 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 104.759 -2.311 . . . . 0.0 104.759 178.662 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.5 -33.9 41.74 Favored 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 176.849 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.549 ' C ' ' CD1' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -94.1 3.14 55.72 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.122 -0.986 . . . . 0.0 108.442 179.016 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.52 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.491 2.36 0 CA-C-O 118.049 -1.417 . . . . 0.0 109.625 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -87.28 -15.69 37.33 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.483 -0.761 . . . . 0.0 109.088 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 44.4 mt -88.93 -50.08 6.41 Favored 'General case' 0 C--N 1.295 -1.771 0 CA-C-O 121.556 0.694 . . . . 0.0 109.172 -179.218 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.796 ' CB ' ' CD ' ' A' ' 4' ' ' GLU . . . -65.75 -26.34 67.68 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 178.91 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -76.87 -45.14 29.35 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.701 -179.591 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.553 ' ND2' ' HB2' ' A' ' 40' ' ' ALA . 0.1 OUTLIER -52.33 -46.8 66.21 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 -179.19 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 10.8 m95 -51.73 -57.76 8.33 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 179.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -58.5 -29.54 66.33 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 178.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.0 m -69.03 -55.41 10.91 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 119.328 -0.949 . . . . 0.0 108.986 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.8 mt -53.68 -40.82 66.27 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 106.845 -1.539 . . . . 0.0 106.845 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -68.21 -60.94 2.09 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 120.058 -0.657 . . . . 0.0 109.678 178.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -58.59 -13.6 6.14 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.394 -0.816 . . . . 0.0 110.153 -179.156 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.411 ' ND2' ' HG2' ' A' ' 33' ' ' MET . 4.8 m-20 -75.72 -54.69 6.55 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 179.331 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.4 mt -56.37 -28.58 59.59 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.296 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.2 ttpt -71.97 -42.71 66.22 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 120.802 -1.186 . . . . 0.0 108.942 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.573 ' O ' ' N ' ' A' ' 20' ' ' ALA . 72.5 t -59.33 -24.56 28.21 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.538 0 C-N-CA 119.323 -0.951 . . . . 0.0 109.256 -179.41 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.456 ' O ' ' N ' ' A' ' 20' ' ' ALA . 10.4 mt -70.94 -72.19 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.171 -0.956 . . . . 0.0 109.669 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -46.55 -28.3 1.38 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.249 -0.907 . . . . 0.0 109.139 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.69 1.98 32.55 Favored 'General case' 0 N--CA 1.504 2.234 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 179.082 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.573 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -57.08 -47.5 80.86 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.897 -1.127 . . . . 0.0 108.011 179.273 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 67.13 -13.51 0.2 Allowed 'General case' 0 C--N 1.297 -1.711 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.728 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.49 ' H ' ' C ' ' A' ' 20' ' ' ALA . 0.4 OUTLIER -146.17 146.41 30.82 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 120.842 -1.161 . . . . 0.0 110.029 179.043 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -58.62 -24.11 60.36 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.863 -0.523 . . . . 0.0 110.966 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.3 -51.29 64.21 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.0 -1.063 . . . . 0.0 110.017 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.519 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 7.0 mt-30 -69.33 -18.31 63.8 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.194 -0.941 . . . . 0.0 110.473 -179.502 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.552 HG12 ' HB2' ' A' ' 79' ' ' ALA . 61.6 t -71.17 -49.04 51.32 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 120.887 -1.133 . . . . 0.0 108.337 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.474 ' O ' ' OG1' ' A' ' 31' ' ' THR . 8.4 mtpt -56.53 -55.26 35.99 Favored 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 106.754 -1.573 . . . . 0.0 106.754 179.024 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -51.13 -40.12 57.78 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 114.675 -1.148 . . . . 0.0 109.244 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.02 -63.33 1.08 Allowed 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.387 -0.821 . . . . 0.0 109.402 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.484 HD23 ' SD ' ' A' ' 33' ' ' MET . 86.7 mt -62.95 -24.54 67.93 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.249 -0.907 . . . . 0.0 109.68 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.474 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 53.6 m -61.19 -39.68 91.09 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.942 -1.099 . . . . 0.0 108.344 179.284 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 39.3 mtpt -74.0 -30.68 62.59 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' MET . . . . . 0.484 ' SD ' HD23 ' A' ' 30' ' ' LEU . 34.5 mtp -66.23 -73.15 0.14 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.106 -0.996 . . . . 0.0 109.293 178.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.693 HH21 ' CB ' ' A' ' 73' ' ' ASP . 0.0 OUTLIER -46.04 -26.47 0.74 Allowed 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -179.168 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.402 ' N ' ' C ' ' A' ' 33' ' ' MET . . . -73.42 -63.36 1.21 Allowed 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 119.896 -0.722 . . . . 0.0 109.36 179.625 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.414 ' HB1' HD21 ' A' ' 6' ' ' ASN . . . -62.43 -28.0 69.5 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.073 -1.017 . . . . 0.0 109.426 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.35 -45.51 93.21 Favored 'General case' 0 N--CA 1.487 1.421 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 14.8 mt -65.77 -24.25 66.9 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 179.288 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -83.15 -47.86 11.16 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 179.442 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.553 ' HB2' ' ND2' ' A' ' 6' ' ' ASN . . . -60.0 -9.78 3.48 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.389 -0.819 . . . . 0.0 109.465 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.478 ' NE2' ' C ' ' A' ' 41' ' ' GLN . 1.3 tm0? -50.76 -57.1 9.17 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 120.683 -1.26 . . . . 0.0 108.017 179.233 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.423 ' HD3' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -74.32 32.2 0.09 Allowed 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.785 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.458 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -77.3 137.91 39.06 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.969 -1.082 . . . . 0.0 109.992 -179.103 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.63 ' N ' ' CD ' ' A' ' 45' ' ' PRO . 12.4 t -156.91 40.05 0.1 Allowed Pre-proline 0 N--CA 1.489 1.509 0 O-C-N 121.529 -0.732 . . . . 0.0 110.188 179.059 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.63 ' CD ' ' N ' ' A' ' 44' ' ' THR . 6.0 Cg_exo -45.28 -36.01 12.08 Favored 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 122.484 2.123 . . . . 0.0 113.923 178.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.48 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 46.7 Cg_endo -95.06 -12.93 0.79 Allowed 'Trans proline' 0 C--N 1.321 -0.872 0 C-N-CA 122.497 2.131 . . . . 0.0 111.333 -178.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.497 ' O ' ' NZ ' ' A' ' 51' ' ' LYS . 10.7 mtpt 82.89 105.93 0.06 Allowed 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.494 HD21 ' CZ ' ' A' ' 61' ' ' PHE . 1.1 mt -79.59 4.38 16.09 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.361 -0.837 . . . . 0.0 108.971 -179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -98.55 18.79 15.86 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -147.0 42.59 1.13 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.801 -0.562 . . . . 0.0 110.067 -179.225 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.497 ' NZ ' ' O ' ' A' ' 47' ' ' LYS . 9.9 ptpp? -171.3 -143.07 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 108.636 -0.875 . . . . 0.0 108.636 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 28.5 t -76.74 116.28 55.38 Favored Pre-proline 0 N--CA 1.485 1.295 0 O-C-N 120.658 -1.276 . . . . 0.0 109.431 179.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -85.76 -12.35 6.34 Favored 'Trans proline' 0 N--CA 1.492 1.402 0 C-N-CA 122.359 2.039 . . . . 0.0 111.471 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.427 ' OD1' ' N ' ' A' ' 54' ' ' ASP . 1.2 m-20 65.89 -126.73 0.29 Allowed 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 -178.508 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.704 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 0.7 OUTLIER -170.43 -37.44 0.0 OUTLIER Pre-proline 0 N--CA 1.488 1.442 0 O-C-N 120.614 -1.304 . . . . 0.0 111.972 -179.904 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.704 ' CD ' ' H ' ' A' ' 55' ' ' SER . 86.8 Cg_exo -54.02 48.56 0.03 OUTLIER 'Trans proline' 0 N--CA 1.504 2.118 0 C-N-CA 122.756 2.304 . . . . 0.0 113.606 -179.337 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.652 ' N ' ' O ' ' A' ' 55' ' ' SER . 1.2 mp0 45.58 29.71 0.67 Allowed 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 -179.15 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.447 ' O ' ' N ' ' A' ' 61' ' ' PHE . 7.6 mtm 63.73 -6.59 0.23 Allowed 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -178.492 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.567 ' H ' ' C ' ' A' ' 57' ' ' GLU . 0.0 OUTLIER -48.37 -39.23 21.57 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 122.065 0.936 . . . . 0.0 108.921 178.929 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.42 -21.32 64.01 Favored 'General case' 0 C--N 1.289 -2.05 0 O-C-N 121.365 -0.834 . . . . 0.0 108.868 -179.318 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.494 ' CZ ' HD21 ' A' ' 48' ' ' LEU . 3.0 t80 -74.94 -54.35 7.37 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.296 -0.877 . . . . 0.0 109.632 179.031 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.452 ' CD ' ' H ' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -65.4 -33.82 76.85 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.994 -1.066 . . . . 0.0 108.791 179.838 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.427 ' O ' ' N ' ' A' ' 67' ' ' ILE . 1.9 t60 -58.15 -38.91 77.52 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.83 -31.84 82.26 Favored Glycine 0 N--CA 1.483 1.823 0 N-CA-C 108.309 -1.917 . . . . 0.0 108.309 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 -82.39 -39.27 22.94 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.316 -1.108 . . . . 0.0 108.145 178.341 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -70.45 -47.04 62.58 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 178.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.427 ' N ' ' O ' ' A' ' 63' ' ' HIS . 4.7 mm -55.38 -42.57 67.77 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.357 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 178.775 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 11.7 tp -57.39 -46.23 83.67 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 179.148 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.449 HG13 ' CG ' ' A' ' 34' ' ' ARG . 37.7 t -59.99 -12.91 4.59 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.472 0 O-C-N 121.098 -1.001 . . . . 0.0 108.659 179.176 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -77.4 -44.03 14.26 Favored Glycine 0 N--CA 1.487 2.067 0 C-N-CA 119.812 -1.185 . . . . 0.0 110.597 -179.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.448 ' CD ' ' C ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -76.48 -37.81 56.26 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.889 -1.359 . . . . 0.0 107.555 179.528 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 51.9 mt -68.05 -29.48 44.83 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 N-CA-C 107.015 -1.476 . . . . 0.0 107.015 177.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.693 ' CB ' HH21 ' A' ' 34' ' ' ARG . 0.0 OUTLIER -63.17 -51.65 65.56 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.441 -0.787 . . . . 0.0 109.527 179.777 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -64.18 -32.01 73.43 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.106 -0.996 . . . . 0.0 109.787 -179.376 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.1 -37.76 64.05 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 120.741 -1.224 . . . . 0.0 108.814 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.95 -27.98 47.77 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 178.768 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.2 tptt -69.66 -47.23 64.05 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-O 121.667 0.746 . . . . 0.0 109.198 178.148 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.1 mp -58.69 -32.03 68.77 Favored 'General case' 0 C--N 1.306 -1.294 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.552 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -65.46 -52.83 50.24 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.237 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 5.7 t30 . . . . . 0 N--CA 1.488 1.426 0 O-C-N 121.54 -0.725 . . . . 0.0 . -178.934 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.214 -0.78 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 98.27 15.22 36.18 Favored Glycine 0 N--CA 1.499 2.896 0 O-C-N 121.189 -0.944 . . . . 0.0 110.796 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 33.9 mmtt -98.57 84.21 3.13 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.071 -1.252 . . . . 0.0 108.675 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 53.6 t -75.33 -63.9 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 -179.372 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.527 ' HD3' ' H ' ' A' ' 85' ' ' LYS . 0.8 OUTLIER -47.88 -37.31 13.81 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.499 -0.75 . . . . 0.0 109.065 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -68.37 -44.18 75.75 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 178.153 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.52 -47.01 68.08 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.948 0.88 . . . . 0.0 109.046 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.528 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.8 OUTLIER -56.26 -54.14 48.9 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 179.734 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -56.19 -41.58 75.75 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.069 -1.02 . . . . 0.0 108.906 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.576 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -61.25 -35.85 78.37 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 178.597 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -47.53 -43.69 25.1 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.059 -1.026 . . . . 0.0 108.717 179.123 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -63.1 -26.82 69.0 Favored 'General case' 0 N--CA 1.485 1.313 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 178.235 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.576 ' N ' ' O ' ' A' ' 90' ' ' ALA . 1.7 tm0? -72.48 -38.99 68.05 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 106.492 -1.67 . . . . 0.0 106.492 177.615 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.464 ' N ' HD12 ' A' ' 94' ' ' LEU . 11.1 mp -65.74 -40.48 92.16 Favored 'General case' 0 C--N 1.307 -1.264 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 3.9 mtpt -55.06 -38.24 67.77 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 178.429 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 6.8 m -69.3 -30.74 68.88 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.477 -0.765 . . . . 0.0 108.945 178.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -60.96 -41.92 97.29 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 18.8 mt -51.6 -38.97 22.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -51.2 61.69 Favored 'General case' 0 C--N 1.302 -1.489 0 C-N-CA 119.152 -1.019 . . . . 0.0 109.057 179.346 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.35 -21.71 66.71 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.034 -1.042 . . . . 0.0 109.067 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.535 ' OH ' ' CE1' ' A' ' 105' ' ' TYR . 10.5 t80 -72.92 -32.89 65.61 Favored 'General case' 0 C--N 1.298 -1.674 0 N-CA-C 107.327 -1.361 . . . . 0.0 107.327 179.168 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.515 ' O ' ' N ' ' A' ' 106' ' ' GLY . 1.2 t30 -64.1 -30.48 71.55 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 178.327 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.491 ' OE1' ' N ' ' A' ' 104' ' ' LYS . 0.3 OUTLIER -65.43 -27.21 68.37 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 104.95 -2.241 . . . . 0.0 104.95 177.931 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.491 ' N ' ' OE1' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -79.34 -47.25 16.12 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 105.414 -2.069 . . . . 0.0 105.414 176.489 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.535 ' CE1' ' OH ' ' A' ' 101' ' ' TYR . 0.6 OUTLIER -86.2 30.86 0.66 Allowed 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 177.191 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.495 2.578 0 CA-C-O 117.964 -1.465 . . . . 0.0 109.517 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 121.576 0.703 . . . . 0.0 109.678 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -85.24 -18.89 32.63 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.349 -0.844 . . . . 0.0 109.673 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 25.5 mt -88.5 -49.53 6.85 Favored 'General case' 0 C--N 1.296 -1.724 0 O-C-N 121.489 -0.757 . . . . 0.0 109.085 -179.028 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -62.83 -23.48 67.3 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 106.56 -1.644 . . . . 0.0 106.56 178.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.73 -53.22 9.64 Favored 'General case' 0 C--N 1.299 -1.622 0 C-N-CA 119.778 -0.769 . . . . 0.0 109.295 -179.642 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.575 HD22 ' HB2' ' A' ' 40' ' ' ALA . 0.1 OUTLIER -53.71 -44.15 69.6 Favored 'General case' 0 N--CA 1.485 1.324 0 O-C-N 121.243 -0.911 . . . . 0.0 108.673 -179.306 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 7.6 m95 -50.06 -54.43 20.35 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.103 -0.998 . . . . 0.0 109.241 -179.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -53.7 -25.57 18.95 Favored 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.237 -0.914 . . . . 0.0 109.308 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.2 m -68.37 -65.06 0.75 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.073 -1.017 . . . . 0.0 110.059 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.652 ' H ' HD23 ' A' ' 10' ' ' LEU . 0.1 OUTLIER -60.27 -31.25 70.05 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 118.436 -1.305 . . . . 0.0 107.546 179.763 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -69.29 -55.19 11.21 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.982 -1.074 . . . . 0.0 108.487 178.636 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.428 ' O ' ' OD1' ' A' ' 12' ' ' ASP . 42.7 t0 -61.01 -14.81 25.68 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.457 -0.777 . . . . 0.0 110.092 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.411 ' ND2' ' HG2' ' A' ' 33' ' ' MET . 3.9 m-20 -72.85 -47.62 44.61 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 178.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.677 HD13 ' HZ3' ' A' ' 95' ' ' LYS . 3.8 mt -57.07 -33.19 67.01 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.738 -178.87 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 6.4 ttpp -68.32 -42.86 78.74 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 118.862 -1.135 . . . . 0.0 108.563 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.556 ' O ' ' N ' ' A' ' 20' ' ' ALA . 57.3 t -57.87 -24.47 23.27 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 O-C-N 121.304 -0.873 . . . . 0.0 109.379 -179.502 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.489 ' O ' ' N ' ' A' ' 20' ' ' ALA . 12.1 mt -71.31 -72.99 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 121.165 -0.96 . . . . 0.0 110.318 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -46.72 -27.63 1.25 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.941 -1.099 . . . . 0.0 108.985 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -102.52 0.97 34.4 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 179.238 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.556 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -58.23 -39.36 78.86 Favored 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 178.755 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 59.13 -11.0 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.059 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.525 ' H ' ' C ' ' A' ' 20' ' ' ALA . 0.5 OUTLIER -147.86 143.28 27.32 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.549 -1.345 . . . . 0.0 110.11 178.949 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.51 -20.58 32.35 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.779 -0.576 . . . . 0.0 111.488 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.08 -50.55 61.32 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.718 -1.239 . . . . 0.0 109.72 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.426 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 4.2 mt-30 -70.22 -19.46 63.15 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.336 -0.853 . . . . 0.0 110.597 -179.499 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.5 HG12 ' HB2' ' A' ' 79' ' ' ALA . 48.7 t -70.26 -47.27 67.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 120.883 -1.136 . . . . 0.0 108.606 -179.778 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.4 ' O ' ' OG1' ' A' ' 31' ' ' THR . 8.2 mtpt -55.5 -55.66 29.3 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 106.407 -1.701 . . . . 0.0 106.407 178.742 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -52.99 -34.08 54.51 Favored 'General case' 0 C--N 1.298 -1.664 0 CA-C-N 114.447 -1.251 . . . . 0.0 109.758 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.61 -65.83 0.65 Allowed 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.26 -0.9 . . . . 0.0 109.54 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.736 HD23 ' SD ' ' A' ' 33' ' ' MET . 53.9 mt -61.9 -18.65 60.96 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.318 -0.864 . . . . 0.0 109.972 -179.467 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.4 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 42.8 m -62.65 -51.31 67.74 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.055 -1.028 . . . . 0.0 109.259 179.453 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -69.74 -24.73 63.58 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.663 -0.648 . . . . 0.0 109.307 -179.234 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' MET . . . . . 0.736 ' SD ' HD23 ' A' ' 30' ' ' LEU . 69.1 mtp -66.43 -61.82 1.79 Allowed 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 178.389 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.54 ' HE ' HG12 ' A' ' 69' ' ' VAL . 0.1 OUTLIER -47.67 -27.94 2.16 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 179.622 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.86 -66.18 0.82 Allowed 'General case' 0 N--CA 1.488 1.452 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.93 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.71 -30.33 71.34 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.898 -1.126 . . . . 0.0 110.033 -179.274 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.45 -43.19 93.22 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.052 -1.03 . . . . 0.0 108.502 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 28.3 mt -66.33 -22.12 66.27 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.321 -0.862 . . . . 0.0 108.758 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -83.47 -45.09 14.02 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.216 -0.927 . . . . 0.0 109.739 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.575 ' HB2' HD22 ' A' ' 6' ' ' ASN . . . -55.2 -22.54 18.02 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.154 -0.966 . . . . 0.0 108.987 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -48.28 -51.34 26.24 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.312 -0.868 . . . . 0.0 109.937 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.502 ' HD3' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -68.89 4.0 1.71 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.166 -0.959 . . . . 0.0 109.628 -179.575 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.502 ' HB3' ' O ' ' A' ' 40' ' ' ALA . . . -82.43 149.42 27.64 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.013 -1.054 . . . . 0.0 110.234 -179.572 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 p -151.34 69.61 8.16 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.358 -0.839 . . . . 0.0 108.778 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.444 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 50.1 Cg_exo -45.77 -38.99 18.25 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 C-N-CA 122.647 2.232 . . . . 0.0 114.272 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.444 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 88.6 Cg_endo -98.68 -94.33 0.0 OUTLIER 'Trans proline' 0 C--N 1.318 -1.047 0 C-N-CA 122.447 2.098 . . . . 0.0 112.732 -178.527 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.57 117.26 0.42 Allowed 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 -179.231 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.547 HD23 ' O ' ' A' ' 48' ' ' LEU . 1.1 tt -81.77 0.91 37.0 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 120.953 -1.092 . . . . 0.0 108.721 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 66.5 mt-10 -99.07 30.59 3.36 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 177.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -147.65 -53.72 0.21 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.65 -0.656 . . . . 0.0 110.496 -178.311 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -65.23 -161.03 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.071 -1.018 . . . . 0.0 109.388 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 28.1 t -73.95 120.99 84.08 Favored Pre-proline 0 N--CA 1.488 1.457 0 O-C-N 120.804 -1.185 . . . . 0.0 109.352 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -83.32 -22.92 3.72 Favored 'Trans proline' 0 N--CA 1.494 1.507 0 C-N-CA 122.201 1.934 . . . . 0.0 111.899 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.8 t0 64.63 -137.72 0.26 Allowed 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.691 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 0.2 OUTLIER -161.83 -38.92 0.0 OUTLIER Pre-proline 0 N--CA 1.495 1.806 0 O-C-N 120.339 -1.476 . . . . 0.0 112.158 -179.383 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.691 ' CD ' ' H ' ' A' ' 55' ' ' SER . 67.0 Cg_exo -49.21 70.32 0.01 OUTLIER 'Trans proline' 0 N--CA 1.503 2.085 0 C-N-CA 122.7 2.267 . . . . 0.0 114.374 -178.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.571 ' N ' ' O ' ' A' ' 55' ' ' SER . 91.4 mt-10 39.47 32.22 0.08 Allowed 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.678 -0.639 . . . . 0.0 109.308 179.528 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.47 ' SD ' ' C ' ' A' ' 57' ' ' GLU . 0.9 OUTLIER 64.73 -8.7 0.21 Allowed 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 -178.46 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.572 ' N ' ' O ' ' A' ' 56' ' ' PRO . 0.6 OUTLIER -48.26 -45.56 34.65 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-O 121.916 0.865 . . . . 0.0 108.93 178.962 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.12 -28.9 27.93 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -179.457 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -74.3 -54.37 7.8 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 177.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.38 -29.06 68.69 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.494 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.624 ' NE2' HD11 ' A' ' 67' ' ' ILE . 2.1 t60 -62.68 -36.75 83.93 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 178.417 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -63.8 -28.23 72.34 Favored Glycine 0 N--CA 1.487 2.085 0 N-CA-C 107.794 -2.122 . . . . 0.0 107.794 178.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.428 ' O ' HG23 ' A' ' 69' ' ' VAL . 26.8 m-85 -81.86 -41.03 21.58 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 177.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -73.14 -45.99 53.55 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.624 HD11 ' NE2' ' A' ' 63' ' ' HIS . 19.7 mm -56.69 -48.57 80.59 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.414 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.704 ' C ' HD13 ' A' ' 68' ' ' LEU . 2.3 tm? -58.01 -45.04 87.52 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 179.419 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.54 HG12 ' HE ' ' A' ' 34' ' ' ARG . 26.3 t -60.94 -11.4 4.15 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 179.031 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -76.16 -42.05 25.03 Favored Glycine 0 N--CA 1.487 2.065 0 N-CA-C 109.347 -1.501 . . . . 0.0 109.347 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.504 ' NE2' ' O ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -67.61 -29.69 69.09 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 178.63 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.57 HG23 HD22 ' A' ' 30' ' ' LEU . 46.8 mt -75.91 -32.9 24.28 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.454 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 176.579 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -59.35 -54.39 47.3 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 121.593 0.711 . . . . 0.0 109.423 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -63.97 -28.81 70.07 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.292 -0.88 . . . . 0.0 109.29 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.65 -32.97 66.27 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 120.807 -1.183 . . . . 0.0 108.355 179.297 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.77 -32.95 63.9 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 178.371 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.9 tptt -66.39 -45.51 79.76 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 mp -58.3 -31.72 67.78 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.5 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -64.91 -51.33 62.48 Favored 'General case' 0 C--N 1.3 -1.545 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 177.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -73.33 -11.95 60.67 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.475 -0.766 . . . . 0.0 111.16 -179.055 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -93.79 -11.04 32.18 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 120.719 -1.238 . . . . 0.0 109.556 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.93 11.3 53.55 Favored Glycine 0 N--CA 1.498 2.769 0 N-CA-C 110.654 -0.978 . . . . 0.0 110.654 179.075 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 39.7 mmtt -94.65 82.13 3.92 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.952 -1.322 . . . . 0.0 108.842 179.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 43.5 t -77.38 -51.22 18.84 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.676 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 -179.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.0 mtmp? -54.15 -39.61 66.67 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.065 -1.022 . . . . 0.0 108.542 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -69.75 -40.97 75.82 Favored 'General case' 0 N--CA 1.486 1.33 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 178.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.66 -51.32 57.48 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 119.528 -0.869 . . . . 0.0 109.114 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.547 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -60.08 -46.37 89.81 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 179.383 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -55.11 -34.29 63.57 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 120.957 -1.089 . . . . 0.0 108.109 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.402 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -65.97 -28.71 69.1 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 107.216 -1.402 . . . . 0.0 107.216 178.118 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.547 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -50.52 -48.67 57.0 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 178.895 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.492 ' OE1' ' N ' ' A' ' 92' ' ' GLU . 14.1 mp0 -67.15 -22.1 65.79 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.292 -0.88 . . . . 0.0 109.34 178.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.402 ' N ' ' O ' ' A' ' 90' ' ' ALA . 1.6 tm0? -71.04 -35.27 71.91 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 105.508 -2.034 . . . . 0.0 105.508 177.164 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.509 HD22 HD21 ' A' ' 14' ' ' LEU . 7.2 mp -70.94 -39.92 72.35 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 178.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' LYS . . . . . 0.677 ' HZ3' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -45.54 -40.45 8.67 Favored 'General case' 0 N--CA 1.498 1.973 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 178.766 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 53.4 m -72.72 -31.32 64.89 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.707 -0.621 . . . . 0.0 109.987 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.467 ' N ' ' O ' ' A' ' 94' ' ' LEU . 1.2 m -56.85 -43.63 81.36 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 49.8 mt -54.79 -46.36 74.68 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.498 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 51.7 ttt180 -62.28 -55.0 32.65 Favored 'General case' 0 C--N 1.308 -1.21 0 O-C-N 121.184 -0.947 . . . . 0.0 110.229 -179.627 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.54 -28.08 69.07 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.79 -1.194 . . . . 0.0 108.698 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.458 ' CD1' ' C ' ' A' ' 101' ' ' TYR . 3.4 t80 -70.86 -30.49 66.9 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 178.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.51 ' O ' ' N ' ' A' ' 106' ' ' GLY . 0.4 OUTLIER -64.34 -32.0 73.43 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 119.013 -1.075 . . . . 0.0 108.536 179.416 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -63.99 -26.0 68.38 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 105.105 -2.183 . . . . 0.0 105.105 177.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.0 -32.46 24.94 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.123 -0.944 . . . . 0.0 108.663 178.012 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.54 ' C ' ' CD1' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -95.11 0.82 54.66 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.108 -0.995 . . . . 0.0 109.173 -179.266 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.51 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.494 2.509 0 CA-C-O 117.927 -1.485 . . . . 0.0 109.742 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.594 0 CA-C-O 121.523 0.677 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -83.09 -12.67 56.86 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.348 -0.845 . . . . 0.0 109.177 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 70.2 mt -87.57 -52.5 5.31 Favored 'General case' 0 C--N 1.296 -1.743 0 O-C-N 121.656 -0.653 . . . . 0.0 109.392 -178.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -62.98 -23.72 67.57 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 179.193 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.52 -51.87 18.11 Favored 'General case' 0 C--N 1.297 -1.709 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.768 ' ND2' ' HB2' ' A' ' 40' ' ' ALA . 0.1 OUTLIER -50.61 -40.9 54.08 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 -179.872 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 7.0 m95 -51.94 -52.46 50.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.198 -0.939 . . . . 0.0 108.865 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -55.98 -28.58 57.73 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 120.719 -1.238 . . . . 0.0 108.919 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 10.4 m -69.52 -64.67 0.83 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.168 -0.958 . . . . 0.0 109.986 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.6 pp -57.02 -30.8 64.51 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.65 -1.282 . . . . 0.0 107.922 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -71.28 -55.32 8.28 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.912 -1.118 . . . . 0.0 108.349 178.144 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -58.57 -14.15 7.43 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.501 -0.749 . . . . 0.0 109.551 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.496 ' O ' HG22 ' A' ' 16' ' ' VAL . 1.6 m-20 -73.12 -50.11 24.62 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 179.34 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.3 mt -56.86 -30.01 63.43 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.829 -0.544 . . . . 0.0 111.087 -178.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -69.11 -51.39 39.05 Favored 'General case' 0 C--N 1.3 -1.581 0 C-N-CA 118.539 -1.264 . . . . 0.0 109.727 -179.281 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.624 ' O ' ' N ' ' A' ' 20' ' ' ALA . 15.4 m -55.74 -20.92 9.22 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 C-N-CA 118.458 -1.297 . . . . 0.0 110.105 -179.35 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.445 ' O ' ' N ' ' A' ' 20' ' ' ALA . 11.5 mt -70.16 -73.51 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 O-C-N 120.442 -1.412 . . . . 0.0 108.947 179.085 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -46.94 -28.66 1.69 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.311 -0.868 . . . . 0.0 109.007 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.37 1.46 35.5 Favored 'General case' 0 N--CA 1.496 1.867 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.624 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -56.9 -44.11 82.02 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 107.453 -1.314 . . . . 0.0 107.453 179.473 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 67.76 -15.02 0.2 Allowed 'General case' 0 C--N 1.297 -1.678 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.949 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.488 ' N ' ' OD1' ' A' ' 22' ' ' ASN . 0.3 OUTLIER -148.21 142.79 26.51 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.653 -1.279 . . . . 0.0 110.051 178.576 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.86 -21.22 10.71 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.987 -0.446 . . . . 0.0 111.463 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.34 -52.13 55.94 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.857 -1.152 . . . . 0.0 109.601 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.501 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 5.4 mt-30 -69.76 -18.31 63.49 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.281 -0.887 . . . . 0.0 110.425 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.524 HG12 ' HB2' ' A' ' 79' ' ' ALA . 57.6 t -70.02 -48.95 59.87 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 O-C-N 120.925 -1.109 . . . . 0.0 108.388 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.463 ' O ' ' OG1' ' A' ' 31' ' ' THR . 7.0 mtpt -56.27 -55.12 37.27 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 178.812 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -50.78 -37.46 42.5 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-N 114.711 -1.132 . . . . 0.0 109.45 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.73 -68.71 0.39 Allowed 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.335 -0.853 . . . . 0.0 110.042 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 95.9 mt -60.28 -20.87 60.87 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.379 -0.826 . . . . 0.0 109.696 -179.263 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.463 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 7.8 m -62.42 -45.64 92.2 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.096 -1.002 . . . . 0.0 108.523 179.208 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 40.9 mtmt -72.81 -27.16 61.8 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.764 -0.585 . . . . 0.0 109.475 -179.149 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 29.5 mtp -63.98 -67.93 0.39 Allowed 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 178.268 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 15.8 ttt-85 -47.11 -26.4 1.09 Allowed 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.67 -57.9 3.61 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 120.009 -0.676 . . . . 0.0 109.344 178.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.25 -39.93 95.99 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.111 -0.993 . . . . 0.0 110.078 -179.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.92 -39.02 71.04 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.019 -1.051 . . . . 0.0 108.891 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 26.5 mt -66.01 -33.78 76.58 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.23 -0.919 . . . . 0.0 108.937 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -86.33 -41.94 14.12 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.096 -1.003 . . . . 0.0 109.549 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.768 ' HB2' ' ND2' ' A' ' 6' ' ' ASN . . . -58.84 -14.53 9.16 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.318 -0.864 . . . . 0.0 109.761 -179.674 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.45 ' C ' ' H ' ' A' ' 43' ' ' ALA . 2.2 tm0? -48.49 -51.57 26.57 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 120.963 -1.086 . . . . 0.0 109.692 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.465 ' HD3' ' H ' ' A' ' 42' ' ' LYS . 2.1 mppt? -71.0 14.24 0.16 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.345 -0.847 . . . . 0.0 109.706 -179.81 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.45 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -78.04 151.27 33.58 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.887 -1.133 . . . . 0.0 108.719 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -152.31 69.18 7.38 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.171 -0.956 . . . . 0.0 109.564 -179.392 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.442 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 33.3 Cg_exo -49.31 -40.05 43.54 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.586 2.191 . . . . 0.0 113.878 178.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.442 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 69.7 Cg_endo -95.98 -14.58 0.51 Allowed 'Trans proline' 0 N--CA 1.483 0.862 0 C-N-CA 122.467 2.111 . . . . 0.0 112.635 -178.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 43.3 mttm 71.83 101.69 0.07 Allowed 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.8 mp -84.33 22.98 1.15 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.122 -0.986 . . . . 0.0 108.791 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -107.04 26.41 10.17 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 107.416 -1.327 . . . . 0.0 107.416 178.144 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -144.26 -59.5 0.38 Allowed 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 -179.231 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -65.99 -162.96 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.585 0 O-C-N 121.325 -0.859 . . . . 0.0 108.888 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.3 t -75.11 145.12 80.14 Favored Pre-proline 0 N--CA 1.485 1.313 0 O-C-N 120.722 -1.236 . . . . 0.0 109.029 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.448 ' O ' ' CB ' ' A' ' 54' ' ' ASP . 43.4 Cg_endo -80.78 -14.57 11.19 Favored 'Trans proline' 0 N--CA 1.499 1.835 0 C-N-CA 122.719 2.28 . . . . 0.0 112.309 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.448 ' CB ' ' O ' ' A' ' 53' ' ' PRO . 10.3 t0 76.27 -143.99 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.825 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 40.4 t -162.36 -26.62 0.0 OUTLIER Pre-proline 0 N--CA 1.495 1.817 0 O-C-N 120.379 -1.451 . . . . 0.0 113.801 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.825 ' CD ' ' H ' ' A' ' 55' ' ' SER . 73.2 Cg_exo -56.43 40.91 0.04 OUTLIER 'Trans proline' 0 N--CA 1.503 2.043 0 C-N-CA 121.981 1.788 . . . . 0.0 113.021 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.648 ' N ' ' O ' ' A' ' 55' ' ' SER . 7.1 tp10 49.87 25.56 1.64 Allowed 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 -178.655 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.51 ' O ' ' N ' ' A' ' 61' ' ' PHE . 2.1 mtp 63.95 -5.08 0.32 Allowed 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 -177.732 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.566 ' H ' ' C ' ' A' ' 57' ' ' GLU . 0.5 OUTLIER -46.59 -50.37 17.52 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.346 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -54.03 -24.91 18.77 Favored 'General case' 0 C--N 1.297 -1.693 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.51 ' N ' ' O ' ' A' ' 58' ' ' MET . 3.8 t80 -77.25 -54.18 6.8 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 107.134 -1.432 . . . . 0.0 107.134 177.763 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.8 mtt-85 -62.54 -31.02 71.74 Favored 'General case' 0 N--CA 1.489 1.512 0 CA-C-O 121.328 0.585 . . . . 0.0 109.474 178.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.425 ' N ' ' O ' ' A' ' 59' ' ' LYS . 1.6 t60 -59.6 -40.89 88.99 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.67 -31.32 80.51 Favored Glycine 0 C--N 1.296 -1.649 0 N-CA-C 108.702 -1.759 . . . . 0.0 108.702 179.473 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -81.07 -41.46 22.55 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.055 -1.262 . . . . 0.0 108.062 178.421 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -71.26 -46.19 61.51 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 5.3 mm -55.78 -44.72 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 179.28 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 5.4 tp -58.04 -52.94 63.44 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.598 -0.689 . . . . 0.0 109.756 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 46.0 t -61.08 -15.76 12.9 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 O-C-N 121.281 -0.887 . . . . 0.0 110.692 -178.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -78.19 -43.79 12.72 Favored Glycine 0 N--CA 1.49 2.236 0 C-N-CA 119.25 -1.453 . . . . 0.0 110.382 -178.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.551 HE21 ' C ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -70.77 -30.8 67.38 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 120.681 -1.482 . . . . 0.0 107.429 179.47 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 27.9 mt -75.42 -30.11 21.94 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.558 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -59.87 -53.18 60.95 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 119.47 -0.892 . . . . 0.0 109.03 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.445 ' OD1' ' O ' ' A' ' 71' ' ' GLN . 0.4 OUTLIER -66.31 -32.53 73.99 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.071 -1.018 . . . . 0.0 109.297 179.909 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.44 -27.12 64.0 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 120.709 -1.245 . . . . 0.0 107.916 179.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.95 -34.15 67.75 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 105.797 -1.927 . . . . 0.0 105.797 177.628 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 9.2 tptt -69.73 -49.04 57.0 Favored 'General case' 0 C--N 1.305 -1.333 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.596 179.348 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 8.5 mp -55.1 -37.18 66.52 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.524 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -62.55 -50.29 71.9 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.313 -0.867 . . . . 0.0 108.902 178.46 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -73.23 -12.37 60.84 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.504 -0.747 . . . . 0.0 111.389 -178.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -94.16 -9.57 35.96 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 120.672 -1.268 . . . . 0.0 109.58 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.67 11.29 54.0 Favored Glycine 0 N--CA 1.497 2.751 0 O-C-N 121.131 -0.981 . . . . 0.0 110.662 178.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 5.7 mmtp -94.21 83.26 4.22 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.921 -1.341 . . . . 0.0 108.464 179.631 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 57.9 t -77.55 -54.0 13.46 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.773 0 O-C-N 121.786 -0.571 . . . . 0.0 109.653 -179.317 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.479 ' HD3' ' H ' ' A' ' 85' ' ' LYS . 0.6 OUTLIER -53.42 -39.7 64.56 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 120.954 -1.092 . . . . 0.0 108.604 179.329 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -67.25 -42.33 84.13 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 178.248 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.412 ' O ' ' HB3' ' A' ' 90' ' ' ALA . . . -67.05 -51.87 49.23 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 119.564 -0.854 . . . . 0.0 109.1 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.522 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -59.95 -48.29 82.32 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 179.585 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -55.87 -33.42 64.56 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.412 ' HB3' ' O ' ' A' ' 87' ' ' ALA . . . -67.04 -27.58 67.51 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 178.19 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.522 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -53.06 -50.78 63.64 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 179.059 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -63.42 -24.65 67.93 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 178.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -75.23 -36.16 61.35 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 177.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.431 ' CD1' ' OE1' ' A' ' 71' ' ' GLN . 4.1 mp -64.78 -49.15 71.86 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 178.646 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -50.32 -42.92 53.49 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 24.4 m -71.32 -35.27 71.17 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.165 -0.96 . . . . 0.0 109.125 179.005 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.2 m -60.79 -44.89 96.24 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 179.343 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 86.2 mt -51.26 -37.89 18.77 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.374 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.2 tpm_? -56.27 -54.49 44.69 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-O 121.907 0.86 . . . . 0.0 109.571 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.491 ' O ' ' N ' ' A' ' 103' ' ' GLN . . . -63.37 -53.89 45.43 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 120.434 -1.416 . . . . 0.0 108.184 179.222 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.491 ' O ' ' CG ' ' A' ' 104' ' ' LYS . 0.6 OUTLIER -53.33 -21.75 6.16 Favored 'General case' 0 C--N 1.297 -1.688 0 O-C-N 120.697 -1.252 . . . . 0.0 107.724 179.366 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.488 ' O ' ' N ' ' A' ' 106' ' ' GLY . 0.0 OUTLIER -65.85 -28.25 68.83 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 176.917 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.491 ' N ' ' O ' ' A' ' 100' ' ' ALA . 0.0 OUTLIER -61.83 -18.93 61.84 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 105.358 -2.09 . . . . 0.0 105.358 178.822 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.491 ' CG ' ' O ' ' A' ' 101' ' ' TYR . 0.0 OUTLIER -79.63 -28.12 40.93 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 177.476 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.485 ' O ' ' CG ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -101.96 3.5 39.04 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 107.756 -1.201 . . . . 0.0 107.756 178.544 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.488 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.491 2.351 0 N-CA-C 109.312 -1.515 . . . . 0.0 109.312 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -85.28 -20.5 29.94 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.403 -0.811 . . . . 0.0 108.964 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 48.9 mt -89.57 -49.12 6.85 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -62.64 -22.29 66.33 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 178.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -72.99 -49.54 28.4 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -50.13 -44.17 52.2 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.207 -0.933 . . . . 0.0 108.683 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 16.2 m95 -54.7 -49.21 71.27 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.187 -0.946 . . . . 0.0 109.367 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -55.41 -29.49 58.65 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 120.875 -1.14 . . . . 0.0 109.083 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 35.4 m -69.39 -65.46 0.71 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 119.289 -0.965 . . . . 0.0 109.789 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.1 pp -58.55 -28.86 65.88 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.776 -1.202 . . . . 0.0 108.566 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -71.74 -59.7 2.61 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.932 -1.105 . . . . 0.0 109.268 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -57.25 -13.77 3.58 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.45 -0.781 . . . . 0.0 109.378 -179.765 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -74.25 -54.27 8.04 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 13.4 mt -55.53 -27.55 49.48 Favored 'General case' 0 N--CA 1.49 1.548 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.574 -178.336 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 9.0 ttpp -70.16 -46.64 64.24 Favored 'General case' 0 C--N 1.298 -1.672 0 C-N-CA 118.919 -1.112 . . . . 0.0 108.569 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.523 ' O ' ' N ' ' A' ' 20' ' ' ALA . 71.9 t -55.84 -26.69 21.06 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.579 0 O-C-N 121.415 -0.803 . . . . 0.0 109.944 -179.301 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.526 ' O ' ' N ' ' A' ' 20' ' ' ALA . 7.1 mt -71.23 -71.25 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 O-C-N 121.053 -1.03 . . . . 0.0 110.468 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -46.75 -28.78 1.63 Allowed 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.931 -1.106 . . . . 0.0 108.789 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.43 ' O ' ' OD2' ' A' ' 21' ' ' ASP . 1.0 OUTLIER -99.96 -1.47 37.07 Favored 'General case' 0 N--CA 1.498 1.928 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 179.522 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.526 ' N ' ' O ' ' A' ' 17' ' ' ILE . . . -58.26 -59.93 4.55 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.893 -1.129 . . . . 0.0 108.299 178.713 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.43 ' OD2' ' O ' ' A' ' 19' ' ' LYS . 1.4 m-20 69.55 -7.62 0.85 Allowed 'General case' 0 C--N 1.295 -1.765 0 O-C-N 121.75 -0.594 . . . . 0.0 110.566 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.432 ' N ' ' OD1' ' A' ' 22' ' ' ASN . 0.6 OUTLIER -142.96 143.05 31.8 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 120.724 -1.235 . . . . 0.0 109.569 178.048 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.94 -27.78 46.08 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.714 -0.616 . . . . 0.0 111.101 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.2 -51.61 62.9 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.029 -1.044 . . . . 0.0 110.887 -178.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.421 ' OE1' ' O ' ' A' ' 20' ' ' ALA . 13.8 mt-30 -68.37 -24.07 64.75 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 120.955 -1.091 . . . . 0.0 110.884 -178.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.572 HG12 ' HB2' ' A' ' 79' ' ' ALA . 49.1 t -70.78 -47.74 61.58 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.036 0 O-C-N 120.693 -1.254 . . . . 0.0 108.99 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.7 mtpt -54.91 -55.11 34.11 Favored 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 106.376 -1.712 . . . . 0.0 106.376 179.048 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.474 ' N ' ' OD1' ' A' ' 28' ' ' ASP . 2.6 m-20 -52.14 -37.99 56.13 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-N 114.33 -1.305 . . . . 0.0 109.574 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.81 -64.09 0.95 Allowed 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.357 -0.839 . . . . 0.0 110.333 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.406 ' HB3' HD12 ' A' ' 76' ' ' LEU . 90.0 mt -60.15 -23.37 63.87 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.165 -0.959 . . . . 0.0 109.955 -179.204 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 48.1 m -61.86 -46.11 90.87 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.036 -1.04 . . . . 0.0 108.93 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.481 ' O ' ' HB3' ' A' ' 35' ' ' ALA . 50.5 mttm -72.26 -28.71 63.3 Favored 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.809 -0.557 . . . . 0.0 109.623 -179.353 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' MET . . . . . 0.416 ' C ' ' N ' ' A' ' 35' ' ' ALA . 48.6 mtp -65.36 -63.46 1.09 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.808 -1.183 . . . . 0.0 108.557 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.8 ttt-85 -50.06 -22.92 1.8 Allowed 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 32' ' ' LYS . . . -75.11 -58.7 3.12 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.643 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.414 ' O ' ' N ' ' A' ' 40' ' ' ALA . . . -62.89 -31.0 71.96 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.169 -0.957 . . . . 0.0 109.64 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.83 -44.12 90.85 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.165 -0.959 . . . . 0.0 108.82 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 17.2 mt -64.79 -32.24 73.83 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.366 -0.834 . . . . 0.0 109.227 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -84.69 -23.87 29.21 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.125 -0.984 . . . . 0.0 109.138 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.525 ' O ' ' HB3' ' A' ' 43' ' ' ALA . . . -61.8 -34.01 75.14 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.428 -0.795 . . . . 0.0 110.348 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.501 ' C ' ' H ' ' A' ' 43' ' ' ALA . 0.8 OUTLIER -40.33 -63.06 0.67 Allowed 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.33 -0.856 . . . . 0.0 110.077 -179.885 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 67.7 mmtt -57.62 1.05 0.04 OUTLIER 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.523 -0.736 . . . . 0.0 110.459 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' A' ' 40' ' ' ALA . . . -84.12 145.57 28.35 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.817 -1.177 . . . . 0.0 110.842 -179.151 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 m -159.37 90.22 1.96 Allowed Pre-proline 0 N--CA 1.49 1.544 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.417 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 23.3 Cg_exo -53.57 -43.68 55.63 Favored 'Trans proline' 0 N--CA 1.49 1.297 0 C-N-CA 121.601 1.534 . . . . 0.0 112.367 -179.105 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.417 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 96.6 Cg_endo -84.96 -90.6 0.0 OUTLIER 'Trans proline' 0 C--N 1.317 -1.087 0 C-N-CA 121.372 1.382 . . . . 0.0 110.574 178.424 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.7 pttt -176.6 122.23 0.15 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.076 -1.015 . . . . 0.0 109.829 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.452 ' C ' ' N ' ' A' ' 50' ' ' ASP . 0.7 OUTLIER -80.34 -174.71 4.73 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 178.575 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 50.74 18.83 0.53 Allowed 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.007 -1.058 . . . . 0.0 108.165 -179.147 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.452 ' N ' ' C ' ' A' ' 48' ' ' LEU . 33.4 m-20 -148.61 -55.0 0.19 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.733 -0.604 . . . . 0.0 110.054 -179.66 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.7 ptpp? -65.69 -162.59 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.537 0 O-C-N 120.974 -1.079 . . . . 0.0 109.289 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 3.7 m -79.36 115.82 55.93 Favored Pre-proline 0 N--CA 1.487 1.415 0 O-C-N 121.095 -1.003 . . . . 0.0 109.0 179.205 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.441 ' O ' ' CB ' ' A' ' 54' ' ' ASP . 31.1 Cg_endo -86.72 -17.22 3.38 Favored 'Trans proline' 0 N--CA 1.493 1.496 0 C-N-CA 122.356 2.038 . . . . 0.0 111.441 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.441 ' CB ' ' O ' ' A' ' 53' ' ' PRO . 6.2 t0 75.4 164.22 0.26 Allowed 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.264 -1.014 . . . . 0.0 108.264 -178.659 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.688 ' O ' ' N ' ' A' ' 57' ' ' GLU . 0.1 OUTLIER -80.28 -47.4 1.33 Allowed Pre-proline 0 N--CA 1.497 1.898 0 O-C-N 120.638 -1.289 . . . . 0.0 112.18 -178.405 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.6 ' O ' ' N ' ' A' ' 59' ' ' LYS . 30.2 Cg_exo -39.98 62.58 0.0 OUTLIER 'Trans proline' 0 N--CA 1.505 2.154 0 C-N-CA 123.523 2.816 . . . . 0.0 115.363 -178.356 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.688 ' N ' ' O ' ' A' ' 55' ' ' SER . 30.3 mt-10 36.63 29.08 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.038 0 CA-C-O 121.437 0.637 . . . . 0.0 109.477 179.273 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.534 ' N ' ' O ' ' A' ' 56' ' ' PRO . 0.1 OUTLIER 65.16 -8.07 0.26 Allowed 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -177.902 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.6 ' N ' ' O ' ' A' ' 56' ' ' PRO . 4.2 tmtm? -50.2 -40.79 48.26 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-O 121.704 0.764 . . . . 0.0 109.015 179.021 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -56.65 -27.31 58.27 Favored 'General case' 0 C--N 1.296 -1.724 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -179.268 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -73.17 -53.61 10.54 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 177.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -62.85 -32.47 73.71 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.661 179.081 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -61.7 -38.08 86.54 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.154 -0.966 . . . . 0.0 108.542 179.2 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.1 -30.67 78.42 Favored Glycine 0 N--CA 1.481 1.675 0 N-CA-C 108.381 -1.888 . . . . 0.0 108.381 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.496 ' CE2' ' NZ ' ' A' ' 104' ' ' LYS . 56.2 m-85 -84.01 -39.51 19.57 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.35 -1.088 . . . . 0.0 108.26 178.292 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -69.34 -46.4 67.14 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 178.678 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 5.6 mm -56.69 -38.87 59.99 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 179.187 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.72 -48.17 82.08 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.404 -0.81 . . . . 0.0 109.545 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 53.7 t -60.94 -17.33 15.55 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 O-C-N 121.65 -0.656 . . . . 0.0 109.632 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -78.55 -43.61 12.01 Favored Glycine 0 N--CA 1.487 2.087 0 C-N-CA 119.609 -1.281 . . . . 0.0 110.792 -178.59 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.462 ' C ' ' NE2' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -71.7 -30.74 65.99 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.557 -1.555 . . . . 0.0 107.501 179.713 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 12.0 mt -74.01 -31.35 29.98 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 177.002 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -62.83 -57.52 10.57 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.252 -0.905 . . . . 0.0 110.099 -179.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -62.69 -29.2 70.47 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.132 -0.98 . . . . 0.0 109.746 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.32 -29.29 61.54 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 120.645 -1.284 . . . . 0.0 108.355 179.218 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.406 HD12 ' HB3' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -56.49 -33.18 65.72 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 106.171 -1.789 . . . . 0.0 106.171 178.185 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.4 tptt -69.03 -42.37 76.45 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.422 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 8.1 mp -59.51 -37.62 78.79 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.37 -0.831 . . . . 0.0 108.85 -178.366 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.572 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -63.4 -51.33 66.24 Favored 'General case' 0 C--N 1.298 -1.642 0 O-C-N 121.272 -0.893 . . . . 0.0 109.23 178.79 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -72.6 -11.07 60.5 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.418 -0.802 . . . . 0.0 111.012 -178.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -95.04 -10.86 29.56 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 120.904 -1.122 . . . . 0.0 109.513 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.83 12.92 48.62 Favored Glycine 0 N--CA 1.496 2.651 0 N-CA-C 110.693 -0.963 . . . . 0.0 110.693 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp -95.22 77.43 3.46 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.971 -1.311 . . . . 0.0 108.43 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.418 HG22 HG21 ' A' ' 26' ' ' VAL . 71.2 t -75.63 -52.01 19.3 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.747 0 O-C-N 121.864 -0.523 . . . . 0.0 109.646 -179.344 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.455 ' HD2' ' H ' ' A' ' 85' ' ' LYS . 4.7 mptt -53.74 -37.15 63.08 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.091 -1.078 . . . . 0.0 108.091 179.25 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -70.24 -42.61 72.0 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 178.334 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.65 -53.74 37.24 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 119.627 -0.829 . . . . 0.0 109.18 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.566 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -59.69 -46.03 90.31 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 179.52 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -58.62 -39.22 79.83 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.117 -0.99 . . . . 0.0 108.403 179.114 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.528 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -64.73 -29.58 70.56 Favored 'General case' 0 N--CA 1.485 1.31 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 178.428 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.566 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -49.17 -47.43 45.85 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.983 -1.073 . . . . 0.0 108.16 178.719 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -62.37 -27.06 68.81 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 178.296 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.528 ' N ' ' O ' ' A' ' 90' ' ' ALA . 1.6 tm0? -72.64 -36.39 67.99 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 177.939 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.403 HD11 ' OE1' ' A' ' 71' ' ' GLN . 10.0 mp -65.57 -48.24 73.06 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.459 -1.312 . . . . 0.0 107.459 178.639 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 3.6 mtpt -52.81 -48.37 66.99 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.371 -0.83 . . . . 0.0 109.189 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 45.4 m -69.28 -34.27 74.49 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.163 -0.961 . . . . 0.0 109.674 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.4 m -58.52 -48.04 82.16 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 4.2 mm -50.32 -33.7 10.67 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.312 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.22 -42.05 76.62 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 179.217 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.41 -28.18 69.07 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.609 -0.682 . . . . 0.0 109.48 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -67.83 -35.66 78.99 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 179.535 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -61.6 -32.77 72.9 Favored 'General case' 0 C--N 1.303 -1.451 0 C-N-CA 119.052 -1.059 . . . . 0.0 108.358 179.584 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.405 ' OE1' ' N ' ' A' ' 104' ' ' LYS . 0.4 OUTLIER -64.04 -23.45 67.34 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 105.178 -2.156 . . . . 0.0 105.178 177.846 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.496 ' NZ ' ' CE2' ' A' ' 65' ' ' PHE . 0.0 OUTLIER -83.86 -33.8 24.76 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 177.577 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.538 ' C ' ' CD1' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -89.98 4.77 49.13 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 120.947 -1.096 . . . . 0.0 108.55 179.39 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.395 0 CA-C-O 117.94 -1.478 . . . . 0.0 109.519 179.714 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.463 0 CA-C-O 121.252 0.548 . . . . 0.0 109.552 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -85.93 -16.45 38.41 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.427 -0.796 . . . . 0.0 109.419 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 69.2 mt -88.36 -51.94 5.47 Favored 'General case' 0 C--N 1.295 -1.762 0 O-C-N 121.608 -0.682 . . . . 0.0 109.326 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -64.47 -25.11 67.86 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -73.41 -43.4 60.55 Favored 'General case' 0 C--N 1.296 -1.741 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.424 ' ND2' ' HB2' ' A' ' 40' ' ' ALA . 0.1 OUTLIER -57.82 -40.61 80.44 Favored 'General case' 0 C--N 1.307 -1.264 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -179.886 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 8.2 m95 -52.67 -53.01 53.33 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.165 -0.959 . . . . 0.0 108.702 -179.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 51.1 tt0 -59.38 -30.84 68.71 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 120.918 -1.114 . . . . 0.0 108.434 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.3 m -67.98 -54.28 19.77 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 119.451 -0.899 . . . . 0.0 108.79 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.4 mt -58.27 -37.27 74.64 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 178.565 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -69.34 -60.86 2.06 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.385 -0.822 . . . . 0.0 109.809 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -55.67 -14.72 2.37 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.347 -0.846 . . . . 0.0 109.349 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.53 ' O ' HG22 ' A' ' 16' ' ' VAL . 2.2 m-20 -74.6 -54.62 7.11 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 107.637 -1.245 . . . . 0.0 107.637 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.5 mt -55.92 -22.38 25.62 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.537 -0.727 . . . . 0.0 110.312 -178.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 11.7 tttp -70.21 -57.61 4.72 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.068 -1.02 . . . . 0.0 109.102 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.617 ' O ' ' N ' ' A' ' 20' ' ' ALA . 14.9 m -52.68 -22.76 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 C-N-CA 118.864 -1.135 . . . . 0.0 110.316 -178.449 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 9.4 mt -70.2 -74.87 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 120.441 -1.412 . . . . 0.0 109.926 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -47.67 -28.57 2.46 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.143 -0.973 . . . . 0.0 108.724 -179.518 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.13 4.33 36.87 Favored 'General case' 0 N--CA 1.495 1.809 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.617 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -57.65 -38.45 75.09 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 179.047 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 63.57 -17.6 0.06 Allowed 'General case' 0 N--CA 1.494 1.753 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.225 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.544 ' H ' ' C ' ' A' ' 20' ' ' ALA . 0.6 OUTLIER -146.6 144.23 29.4 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.749 -1.219 . . . . 0.0 109.787 179.773 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -56.06 -15.75 4.04 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.721 -0.612 . . . . 0.0 110.106 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.51 -55.54 13.13 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.215 -0.928 . . . . 0.0 109.568 -179.495 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -68.34 -19.04 64.63 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.557 -0.714 . . . . 0.0 110.609 -179.42 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.555 HG12 ' HB2' ' A' ' 79' ' ' ALA . 47.5 t -70.8 -46.71 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 O-C-N 120.936 -1.102 . . . . 0.0 108.589 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.428 ' O ' ' OG1' ' A' ' 31' ' ' THR . 14.0 mtpt -55.58 -56.74 16.78 Favored 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 178.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -51.8 -34.14 38.64 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-N 114.403 -1.271 . . . . 0.0 109.64 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.84 -69.66 0.33 Allowed 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.289 -0.882 . . . . 0.0 110.32 -179.052 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 30' ' ' LEU . 93.0 mt -57.1 -19.99 22.79 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.52 -0.738 . . . . 0.0 109.414 -178.926 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.428 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 39.4 m -64.17 -40.76 96.81 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 178.443 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 58.2 mttt -73.94 -32.07 63.33 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 36.8 mtp -66.67 -69.09 0.33 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 120.988 -1.07 . . . . 0.0 108.74 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.3 ttt-85 -45.9 -29.18 1.31 Allowed 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.32 -64.76 0.95 Allowed 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 120.049 -0.66 . . . . 0.0 109.843 179.439 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.66 -33.17 73.5 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.043 -1.036 . . . . 0.0 109.224 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.25 -38.07 82.36 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 179.33 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.5 mt -65.68 -26.32 67.73 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 179.298 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 61.0 t0 -84.66 -37.42 21.05 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.12 -0.987 . . . . 0.0 110.041 -179.674 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.563 ' O ' ' N ' ' A' ' 42' ' ' LYS . . . -58.46 -69.34 0.19 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.07 -1.019 . . . . 0.0 109.607 -179.81 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.607 ' C ' ' H ' ' A' ' 43' ' ' ALA . 0.2 OUTLIER 11.78 -78.42 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.606 0 CA-C-O 121.702 0.763 . . . . 0.0 111.354 -179.581 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.563 ' N ' ' O ' ' A' ' 40' ' ' ALA . 44.7 mmtt -56.26 13.0 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.926 -0.483 . . . . 0.0 110.682 179.498 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.607 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -75.42 148.38 39.18 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.432 -1.418 . . . . 0.0 110.236 -178.508 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -153.58 76.51 6.11 Favored Pre-proline 0 N--CA 1.492 1.648 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.421 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 46.9 Cg_exo -49.67 -39.79 46.89 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.537 2.158 . . . . 0.0 113.89 179.781 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.421 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 88.6 Cg_endo -93.1 -93.72 0.0 OUTLIER 'Trans proline' 0 C--N 1.32 -0.967 0 C-N-CA 121.848 1.699 . . . . 0.0 111.589 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.444 ' CB ' ' NZ ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -177.78 103.06 0.05 OUTLIER 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.157 -0.965 . . . . 0.0 110.227 179.899 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.414 ' C ' ' N ' ' A' ' 50' ' ' ASP . 0.5 OUTLIER -82.85 -175.05 5.61 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 107.019 -1.474 . . . . 0.0 107.019 178.17 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 51.35 20.38 0.95 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.796 -1.19 . . . . 0.0 108.36 -179.054 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.414 ' N ' ' C ' ' A' ' 48' ' ' LEU . 7.7 m-20 -143.16 -61.33 0.42 Allowed 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 7.9 ptpp? -66.64 -146.98 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 178.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 25.9 t -77.96 131.92 68.83 Favored Pre-proline 0 C--N 1.307 -1.273 0 O-C-N 120.65 -1.281 . . . . 0.0 108.279 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -80.99 -11.61 12.27 Favored 'Trans proline' 0 N--CA 1.496 1.656 0 C-N-CA 122.354 2.036 . . . . 0.0 111.468 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 69.02 -128.2 0.1 Allowed 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 -178.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.805 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 24.2 t -168.27 -28.45 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.714 0 C-N-CA 118.645 -1.222 . . . . 0.0 113.523 -179.42 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.805 ' CD ' ' H ' ' A' ' 55' ' ' SER . 73.4 Cg_exo -54.75 45.65 0.03 OUTLIER 'Trans proline' 0 N--CA 1.503 2.081 0 C-N-CA 122.277 1.985 . . . . 0.0 113.205 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.678 ' N ' ' O ' ' A' ' 55' ' ' SER . 38.6 mt-10 46.98 27.94 0.8 Allowed 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 -179.383 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 8.9 mtm 65.4 -8.25 0.28 Allowed 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 -177.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.601 ' H ' ' C ' ' A' ' 57' ' ' GLU . 1.0 OUTLIER -50.21 -46.65 54.69 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-O 121.716 0.769 . . . . 0.0 109.875 179.191 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.463 ' H ' ' HB2' ' A' ' 56' ' ' PRO . 8.0 t70 -52.31 -17.81 1.32 Allowed 'General case' 0 C--N 1.293 -1.875 0 O-C-N 121.089 -1.007 . . . . 0.0 109.331 -178.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -74.74 -68.07 0.58 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.166 -0.959 . . . . 0.0 109.265 178.46 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.464 ' H ' ' CD ' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -58.46 -27.11 64.09 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 -179.644 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.594 ' CE1' HD11 ' A' ' 67' ' ' ILE . 3.5 t60 -60.99 -45.61 94.11 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.874 -0.788 . . . . 0.0 108.874 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -60.54 -32.09 76.9 Favored Glycine 0 N--CA 1.484 1.889 0 C-N-CA 118.89 -1.624 . . . . 0.0 109.214 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.505 ' O ' HG23 ' A' ' 69' ' ' VAL . 88.5 m-85 -82.0 -41.98 19.98 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.106 -1.232 . . . . 0.0 108.258 178.378 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 51.9 t0 -69.5 -46.41 66.64 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 179.379 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.594 HD11 ' CE1' ' A' ' 63' ' ' HIS . 17.7 mm -54.59 -47.08 72.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 178.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.9 tp -60.53 -47.28 86.88 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.459 -0.776 . . . . 0.0 108.964 179.342 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 65' ' ' PHE . 55.3 t -62.45 -21.77 27.94 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 O-C-N 121.181 -0.949 . . . . 0.0 110.072 -179.57 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -77.19 -49.4 7.5 Favored Glycine 0 N--CA 1.49 2.286 0 C-N-CA 119.686 -1.245 . . . . 0.0 110.471 -178.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.522 ' NE2' ' O ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -67.32 -28.01 67.64 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 120.67 -1.488 . . . . 0.0 107.519 179.743 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 4.5 mt -74.58 -33.06 31.19 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.474 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 176.218 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -60.27 -53.79 53.49 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.527 -0.733 . . . . 0.0 109.708 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -64.14 -31.53 72.76 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.439 -0.788 . . . . 0.0 109.764 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.25 -31.56 67.69 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 120.434 -1.416 . . . . 0.0 107.801 179.407 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.59 -33.38 66.16 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 178.087 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 5.8 tptt -67.13 -43.52 82.2 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-O 121.724 0.773 . . . . 0.0 109.526 178.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.9 mp -59.78 -32.04 70.23 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.555 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -64.11 -55.22 23.56 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.587 -0.696 . . . . 0.0 109.372 178.766 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -73.37 -10.63 59.94 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.431 -0.793 . . . . 0.0 111.494 -178.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -92.41 -10.91 36.35 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 120.791 -1.193 . . . . 0.0 109.575 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.22 12.39 51.96 Favored Glycine 0 N--CA 1.496 2.681 0 N-CA-C 110.299 -1.12 . . . . 0.0 110.299 178.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 17.3 mmtp -93.86 82.56 4.28 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.064 -1.257 . . . . 0.0 108.001 179.246 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 19.4 t -76.69 -60.45 2.31 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.809 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.956 -178.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.411 ' H ' ' HD2' ' A' ' 85' ' ' LYS . 7.6 mptt -49.43 -38.0 27.67 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.03 -1.044 . . . . 0.0 109.084 179.85 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.602 ' H ' ' CD ' ' A' ' 86' ' ' GLU . 35.3 mp0 -68.02 -46.3 71.57 Favored 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 179.052 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.2 -45.51 80.55 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 119.194 -1.003 . . . . 0.0 108.971 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.535 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -61.94 -58.82 6.43 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 179.488 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -53.4 -37.68 62.72 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.056 -1.027 . . . . 0.0 108.805 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.581 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -63.32 -35.08 79.19 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 178.356 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.535 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -48.24 -41.97 29.09 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.744 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -65.43 -26.41 67.95 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 178.248 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.581 ' N ' ' O ' ' A' ' 90' ' ' ALA . 1.6 tm0? -73.45 -39.91 64.6 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 177.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.495 ' CD1' ' OE1' ' A' ' 71' ' ' GLN . 11.3 mp -62.81 -42.89 99.91 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 107.456 -1.312 . . . . 0.0 107.456 178.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 3.6 mtpt -54.89 -47.96 73.63 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 179.431 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 87.0 m -69.38 -32.25 71.15 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.244 -0.91 . . . . 0.0 109.515 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.9 m -60.83 -48.12 83.25 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.094 -1.004 . . . . 0.0 108.457 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 95.9 mt -51.23 -36.71 17.07 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -53.29 -43.55 67.6 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.403 ' O ' ' HG3' ' A' ' 103' ' ' GLN . . . -64.32 -37.03 86.06 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.351 -0.843 . . . . 0.0 109.048 179.14 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.458 ' CD1' ' C ' ' A' ' 101' ' ' TYR . 0.5 OUTLIER -65.95 -28.21 68.74 Favored 'General case' 0 C--N 1.297 -1.682 0 O-C-N 120.26 -1.525 . . . . 0.0 107.832 179.41 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.503 ' O ' ' N ' ' A' ' 106' ' ' GLY . 0.3 OUTLIER -66.6 -32.1 73.22 Favored 'General case' 0 C--N 1.298 -1.636 0 C-N-CA 119.152 -1.019 . . . . 0.0 110.084 -179.541 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.403 ' HG3' ' O ' ' A' ' 100' ' ' ALA . 0.0 OUTLIER -66.84 -20.94 66.03 Favored 'General case' 0 N--CA 1.485 1.325 0 N-CA-C 104.71 -2.329 . . . . 0.0 104.71 177.999 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.77 -36.37 31.96 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 177.289 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.551 ' C ' ' CD1' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -94.49 6.84 47.56 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.064 -1.023 . . . . 0.0 108.475 179.335 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.503 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.49 2.3 0 CA-C-O 117.943 -1.476 . . . . 0.0 109.612 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -86.15 -17.96 33.54 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.314 -0.866 . . . . 0.0 109.186 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 43.7 mt -89.08 -49.83 6.52 Favored 'General case' 0 C--N 1.295 -1.766 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -65.32 -23.78 67.1 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 179.112 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -74.39 -51.86 13.78 Favored 'General case' 0 C--N 1.298 -1.658 0 C-N-CA 119.796 -0.762 . . . . 0.0 108.969 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.725 HD22 ' HB2' ' A' ' 40' ' ' ALA . 0.2 OUTLIER -53.39 -37.6 62.62 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 -179.77 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.402 ' HZ2' ' HH ' ' A' ' 101' ' ' TYR . 11.9 m0 -53.41 -52.85 58.02 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.227 -0.921 . . . . 0.0 108.556 -179.678 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -56.46 -29.44 61.71 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.289 -0.882 . . . . 0.0 109.2 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 59.4 m -69.46 -63.76 1.01 Allowed 'General case' 0 N--CA 1.486 1.354 0 O-C-N 121.076 -1.015 . . . . 0.0 110.164 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.3 pp -59.05 -30.54 68.12 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 118.382 -1.327 . . . . 0.0 108.026 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -70.91 -58.16 3.87 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.94 -1.1 . . . . 0.0 108.931 178.272 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -58.96 -11.41 3.35 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.502 -0.749 . . . . 0.0 109.886 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -74.44 -53.24 9.93 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 107.594 -1.261 . . . . 0.0 107.594 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.16 -37.17 69.16 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.711 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.585 ' HZ2' ' HE3' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -67.72 -40.92 84.2 Favored 'General case' 0 C--N 1.296 -1.718 0 C-N-CA 118.51 -1.276 . . . . 0.0 108.74 -179.286 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.553 ' O ' ' N ' ' A' ' 20' ' ' ALA . 69.3 t -60.25 -23.93 29.14 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 O-C-N 120.98 -1.075 . . . . 0.0 109.52 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.466 ' O ' ' N ' ' A' ' 20' ' ' ALA . 12.6 mt -70.41 -70.77 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.875 0 O-C-N 121.021 -1.049 . . . . 0.0 109.93 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -48.25 -25.18 1.42 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.12 -0.987 . . . . 0.0 108.893 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.585 ' HE3' ' HZ2' ' A' ' 15' ' ' LYS . 0.0 OUTLIER -103.38 -1.14 29.1 Favored 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 179.228 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.553 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -57.78 -38.13 74.92 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 107.686 -1.227 . . . . 0.0 107.686 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 58.13 -8.73 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.264 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.522 ' H ' ' C ' ' A' ' 20' ' ' ALA . 0.6 OUTLIER -147.11 144.2 28.86 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 120.574 -1.329 . . . . 0.0 109.745 178.636 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.07 -22.23 37.65 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.861 -0.524 . . . . 0.0 111.016 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.8 -54.96 19.96 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.138 -0.976 . . . . 0.0 110.351 -179.128 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.419 ' HB2' ' HB1' ' A' ' 20' ' ' ALA . 4.2 mt-30 -67.35 -16.57 64.33 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.147 -0.971 . . . . 0.0 110.614 -179.035 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.476 HG12 ' HB2' ' A' ' 79' ' ' ALA . 48.9 t -71.11 -48.38 55.56 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.019 0 O-C-N 120.916 -1.115 . . . . 0.0 108.39 179.659 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.8 mppt? -55.59 -50.94 68.76 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 179.068 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.437 ' N ' ' OD1' ' A' ' 28' ' ' ASP . 6.2 m-20 -54.67 -39.58 68.22 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-N 114.782 -1.099 . . . . 0.0 109.654 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.77 -62.08 1.54 Allowed 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.31 -0.868 . . . . 0.0 110.284 -179.257 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.474 HD23 ' SD ' ' A' ' 33' ' ' MET . 85.3 mt -62.95 -24.88 68.09 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.11 -0.994 . . . . 0.0 110.514 -179.037 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 31.6 m -60.86 -45.72 93.42 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.895 -1.128 . . . . 0.0 108.714 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 16.3 mmtm -71.44 -28.99 64.36 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-O 121.305 0.574 . . . . 0.0 109.517 -179.181 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' MET . . . . . 0.474 ' SD ' HD23 ' A' ' 30' ' ' LEU . 62.9 mtp -64.62 -67.66 0.42 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.153 -0.967 . . . . 0.0 108.812 178.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.473 ' O ' ' CD2' ' A' ' 38' ' ' LEU . 12.3 ttt-85 -48.72 -23.38 1.03 Allowed 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -179.323 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.403 ' N ' ' C ' ' A' ' 33' ' ' MET . . . -77.76 -58.27 3.36 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.756 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.95 -28.56 67.57 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.83 -1.169 . . . . 0.0 110.223 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -57.87 -58.77 6.92 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.98 -1.075 . . . . 0.0 108.609 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.473 ' CD2' ' O ' ' A' ' 34' ' ' ARG . 0.6 OUTLIER -62.34 -18.33 61.17 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.432 -0.793 . . . . 0.0 109.253 179.48 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -84.14 -39.15 19.8 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.773 -1.204 . . . . 0.0 108.248 178.652 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.725 ' HB2' HD22 ' A' ' 6' ' ' ASN . . . -61.47 -19.72 62.34 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.463 -0.773 . . . . 0.0 109.705 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.513 ' O ' ' N ' ' A' ' 43' ' ' ALA . 1.6 tm0? -46.43 -56.82 5.34 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.454 ' HG2' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -63.22 74.6 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.753 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.538 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.513 ' N ' ' O ' ' A' ' 41' ' ' GLN . . . -160.61 149.81 17.12 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.485 -1.384 . . . . 0.0 110.292 -179.223 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -154.91 74.35 5.66 Favored Pre-proline 0 N--CA 1.494 1.729 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.436 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 50.3 Cg_exo -46.8 -38.59 23.14 Favored 'Trans proline' 0 C--N 1.306 -1.688 0 C-N-CA 122.552 2.168 . . . . 0.0 114.315 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.436 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 73.0 Cg_endo -96.9 -92.01 0.0 OUTLIER 'Trans proline' 0 C--N 1.317 -1.111 0 C-N-CA 122.442 2.095 . . . . 0.0 112.149 -179.25 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 10.1 pttp -175.64 102.4 0.07 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.218 -0.927 . . . . 0.0 109.731 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.43 -177.34 6.46 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 178.705 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 52.07 22.37 1.85 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.751 -1.218 . . . . 0.0 108.291 -178.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -145.6 -56.8 0.31 Allowed 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -68.0 -163.79 0.04 OUTLIER 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.22 -0.925 . . . . 0.0 108.782 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.3 t -76.55 117.32 63.76 Favored Pre-proline 0 N--CA 1.486 1.363 0 O-C-N 120.998 -1.064 . . . . 0.0 108.948 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.585 ' C ' ' H ' ' A' ' 55' ' ' SER . 41.6 Cg_endo -83.25 -9.89 10.28 Favored 'Trans proline' 0 N--CA 1.496 1.645 0 C-N-CA 122.325 2.016 . . . . 0.0 111.494 -179.68 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.554 ' O ' ' CB ' ' A' ' 55' ' ' SER . 6.7 t0 63.14 -24.37 0.06 Allowed 'General case' 0 N--CA 1.491 1.577 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.595 -178.892 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.769 ' O ' ' N ' ' A' ' 57' ' ' GLU . 4.5 t 102.47 -26.44 0.0 OUTLIER Pre-proline 0 N--CA 1.52 3.029 0 N-CA-C 115.557 1.688 . . . . 0.0 115.557 177.787 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.55 ' O ' ' N ' ' A' ' 59' ' ' LYS . 85.7 Cg_exo -45.98 36.86 0.01 OUTLIER 'Trans proline' 0 N--CA 1.511 2.529 0 C-N-CA 122.677 2.251 . . . . 0.0 114.943 179.262 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.769 ' N ' ' O ' ' A' ' 55' ' ' SER . 25.3 tt0 50.41 23.4 1.25 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 120.426 -1.421 . . . . 0.0 107.189 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.503 ' SD ' ' O ' ' A' ' 57' ' ' GLU . 0.8 OUTLIER 66.41 -3.9 0.78 Allowed 'General case' 0 C--N 1.307 -1.282 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 -178.281 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.55 ' N ' ' O ' ' A' ' 56' ' ' PRO . 0.1 OUTLIER -52.93 -42.45 65.42 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 121.953 0.883 . . . . 0.0 109.396 179.514 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -55.39 -17.95 5.86 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 108.498 -0.926 . . . . 0.0 108.498 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.443 ' CD1' ' NZ ' ' A' ' 104' ' ' LYS . 30.8 t80 -75.11 -63.93 1.16 Allowed 'General case' 0 N--CA 1.492 1.627 0 CA-C-O 122.061 0.934 . . . . 0.0 109.44 178.688 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.544 ' O ' ' N ' ' A' ' 66' ' ' ASP . 0.0 OUTLIER -63.02 -31.88 73.11 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 -179.655 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.412 ' NE2' HD11 ' A' ' 67' ' ' ILE . 4.8 t60 -54.84 -38.9 68.01 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -65.63 -34.7 89.72 Favored Glycine 0 C--N 1.293 -1.848 0 N-CA-C 108.137 -1.985 . . . . 0.0 108.137 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -82.98 -32.97 26.75 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.304 -1.115 . . . . 0.0 108.517 178.187 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.544 ' N ' ' O ' ' A' ' 62' ' ' ARG . 14.6 t0 -72.25 -44.89 62.19 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 177.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.412 HD11 ' NE2' ' A' ' 63' ' ' HIS . 5.5 mm -63.13 -35.86 73.52 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.524 0 O-C-N 121.287 -0.883 . . . . 0.0 109.094 178.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.8 tp -54.18 -61.34 2.37 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 122.153 0.978 . . . . 0.0 108.96 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.439 HG22 ' O ' ' A' ' 66' ' ' ASP . 31.0 m -57.87 -13.32 2.45 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.835 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.548 -178.498 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -78.19 -54.82 4.26 Favored Glycine 0 N--CA 1.494 2.506 0 C-N-CA 119.806 -1.188 . . . . 0.0 111.172 -179.155 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.446 ' NE2' ' O ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -67.08 -29.12 68.79 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.316 -1.697 . . . . 0.0 107.9 -179.837 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 14.4 mt -71.05 -31.43 44.92 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 177.454 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -58.14 -52.22 66.45 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 119.205 -0.998 . . . . 0.0 109.347 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -64.4 -31.98 73.42 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.361 -0.837 . . . . 0.0 109.471 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.12 -30.22 63.47 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 120.698 -1.251 . . . . 0.0 108.389 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.81 -33.81 64.78 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 178.292 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.4 tptt -68.65 -46.54 68.89 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.33 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 8.1 mp -58.0 -33.41 68.9 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 -178.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.476 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -64.08 -50.07 69.82 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.35 -0.844 . . . . 0.0 108.862 178.183 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -74.2 -13.58 60.82 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.591 -0.693 . . . . 0.0 111.447 -178.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 82.5 mt-10 -93.09 -10.43 36.05 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.602 -1.311 . . . . 0.0 110.128 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 95.57 15.62 42.79 Favored Glycine 0 N--CA 1.496 2.641 0 N-CA-C 110.264 -1.134 . . . . 0.0 110.264 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.1 mmtt -96.44 75.66 2.89 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.205 -1.173 . . . . 0.0 108.312 179.154 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 22.0 t -73.29 -59.32 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.778 -0.576 . . . . 0.0 109.638 -179.187 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.522 ' HD2' ' H ' ' A' ' 85' ' ' LYS . 0.0 OUTLIER -48.41 -35.99 13.85 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.216 -0.927 . . . . 0.0 108.517 179.378 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.604 ' H ' ' CD ' ' A' ' 86' ' ' GLU . 27.2 mp0 -71.65 -47.84 51.68 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 178.432 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.34 -42.74 98.95 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.545 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.1 OUTLIER -60.75 -61.42 2.6 Favored 'General case' 0 C--N 1.296 -1.726 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 178.654 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -49.0 -37.59 20.81 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.154 -0.966 . . . . 0.0 109.07 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.547 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -63.08 -36.56 84.0 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 178.246 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.545 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -45.96 -46.97 16.58 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.456 ' OE1' ' O ' ' A' ' 88' ' ' GLN . 2.3 mp0 -62.76 -27.18 69.11 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.14 -0.975 . . . . 0.0 108.444 178.601 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.547 ' N ' ' O ' ' A' ' 90' ' ' ALA . 1.7 tm0? -72.69 -41.22 65.54 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 177.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.416 ' N ' HD12 ' A' ' 94' ' ' LEU . 9.5 mp -63.44 -43.09 98.42 Favored 'General case' 0 C--N 1.305 -1.354 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 3.9 mtpt -56.27 -40.9 74.98 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.29 -0.881 . . . . 0.0 108.813 178.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 13.5 m -67.47 -31.75 72.12 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.15 -0.969 . . . . 0.0 108.868 179.372 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.24 -42.61 98.92 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 178.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.2 mt -53.81 -32.92 22.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.9 tpt180 -58.64 -45.4 89.38 Favored 'General case' 0 C--N 1.302 -1.496 0 C-N-CA 119.023 -1.071 . . . . 0.0 108.414 179.585 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.64 -24.96 67.75 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.461 -0.774 . . . . 0.0 109.18 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.408 ' O ' ' N ' ' A' ' 105' ' ' TYR . 6.2 t80 -74.72 -32.11 62.04 Favored 'General case' 0 C--N 1.297 -1.711 0 O-C-N 120.557 -1.34 . . . . 0.0 108.028 179.287 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.407 ' O ' ' N ' ' A' ' 106' ' ' GLY . 1.0 OUTLIER -65.5 -40.94 93.62 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 120.991 -1.068 . . . . 0.0 110.72 -179.096 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.87 -22.26 66.96 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 105.514 -2.032 . . . . 0.0 105.514 179.136 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.443 ' NZ ' ' CD1' ' A' ' 61' ' ' PHE . 0.0 OUTLIER -81.82 -33.31 30.82 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 176.631 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.568 ' C ' ' CD1' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -90.61 3.77 53.18 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.117 -0.989 . . . . 0.0 108.59 179.7 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.491 2.342 0 CA-C-O 117.955 -1.469 . . . . 0.0 109.537 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.586 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -86.03 -19.43 30.32 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.313 -0.867 . . . . 0.0 109.278 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 15.1 mt -87.38 -51.2 6.08 Favored 'General case' 0 C--N 1.296 -1.73 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 -179.581 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -64.36 -22.72 67.05 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -72.73 -44.78 61.24 Favored 'General case' 0 C--N 1.298 -1.657 0 C-N-CA 119.568 -0.853 . . . . 0.0 108.742 -179.617 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.493 HD22 ' HB2' ' A' ' 40' ' ' ALA . 0.1 OUTLIER -54.83 -44.11 73.61 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 -179.856 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 11.6 m95 -53.13 -48.08 68.18 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.556 -0.715 . . . . 0.0 109.524 -179.434 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -56.32 -33.0 65.17 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 120.805 -1.185 . . . . 0.0 108.163 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.3 m -68.19 -52.12 37.95 Favored 'General case' 0 C--N 1.306 -1.301 0 C-N-CA 119.185 -1.006 . . . . 0.0 108.371 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 25.9 mt -58.96 -38.84 80.0 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 178.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -68.33 -52.78 29.64 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.576 -0.849 . . . . 0.0 108.902 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -61.53 -15.39 37.88 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.599 -0.688 . . . . 0.0 109.628 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -74.94 -51.82 12.77 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 179.533 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.2 mt -57.61 -33.01 67.77 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-O 120.995 0.426 . . . . 0.0 111.425 -178.268 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -67.8 -47.62 68.58 Favored 'General case' 0 C--N 1.296 -1.754 0 O-C-N 121.066 -1.022 . . . . 0.0 108.654 -179.33 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.523 ' O ' ' N ' ' A' ' 20' ' ' ALA . 55.6 t -55.88 -25.49 19.01 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 C-N-CA 119.304 -0.958 . . . . 0.0 109.755 -179.1 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.487 ' O ' ' N ' ' A' ' 20' ' ' ALA . 7.2 mt -71.28 -72.48 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.181 0 O-C-N 120.936 -1.103 . . . . 0.0 110.213 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -46.8 -27.4 1.2 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.893 -1.129 . . . . 0.0 109.201 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -101.02 -4.07 28.16 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.474 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.523 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -57.49 -54.56 45.43 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 178.525 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 66.11 -0.92 1.27 Allowed 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.007 179.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.452 ' N ' ' OD1' ' A' ' 22' ' ' ASN . 0.7 OUTLIER -144.63 142.48 30.16 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.587 -1.321 . . . . 0.0 109.19 177.55 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -56.0 -19.38 12.37 Favored 'General case' 0 C--N 1.295 -1.792 0 O-C-N 121.599 -0.688 . . . . 0.0 110.794 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -71.41 -58.89 3.1 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.176 -0.953 . . . . 0.0 111.055 -179.095 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.515 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 5.0 mt-30 -64.3 -17.58 63.78 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.319 -0.863 . . . . 0.0 111.281 -177.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.518 HG12 ' HB2' ' A' ' 79' ' ' ALA . 55.4 t -70.7 -48.06 60.27 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 120.895 -1.128 . . . . 0.0 108.479 179.707 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.437 ' O ' ' OG1' ' A' ' 31' ' ' THR . 4.1 mtpt -56.27 -51.44 68.15 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 179.267 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.473 ' N ' ' OD1' ' A' ' 28' ' ' ASP . 2.8 m-20 -52.56 -38.03 59.03 Favored 'General case' 0 C--N 1.296 -1.741 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.754 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.52 -64.36 0.88 Allowed 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 119.663 -0.815 . . . . 0.0 110.009 -179.277 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.459 HD23 ' SD ' ' A' ' 33' ' ' MET . 18.1 mt -61.13 -24.45 66.27 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.295 -0.878 . . . . 0.0 110.126 -178.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.437 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 53.3 m -59.7 -41.11 90.01 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 178.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.0 mtpm? -72.87 -32.08 65.16 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.359 -179.721 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' MET . . . . . 0.459 ' SD ' HD23 ' A' ' 30' ' ' LEU . 46.8 mtp -67.16 -68.09 0.4 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.01 -1.056 . . . . 0.0 108.956 178.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 12.9 ttt-85 -45.73 -26.44 0.64 Allowed 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -179.659 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.409 ' N ' ' C ' ' A' ' 33' ' ' MET . . . -74.79 -66.18 0.78 Allowed 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 178.389 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.91 -27.55 68.93 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.145 -0.972 . . . . 0.0 109.819 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.03 -42.15 84.73 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.01 -1.056 . . . . 0.0 108.401 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 25.6 mt -65.57 -30.18 70.88 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.112 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -82.53 -35.72 27.01 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.175 -0.953 . . . . 0.0 109.04 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.493 ' HB2' HD22 ' A' ' 6' ' ' ASN . . . -53.73 -26.16 21.98 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 179.277 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -52.14 -46.1 65.26 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.669 -0.644 . . . . 0.0 109.764 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.455 ' HD3' ' H ' ' A' ' 42' ' ' LYS . 4.6 mptt -68.17 3.99 1.43 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.164 -0.96 . . . . 0.0 110.09 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -80.99 144.41 31.83 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.839 -1.163 . . . . 0.0 109.337 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.7 m -154.19 67.9 5.82 Favored Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.147 -0.971 . . . . 0.0 109.932 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.419 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 22.9 Cg_exo -56.64 -42.71 62.25 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 C-N-CA 122.305 2.003 . . . . 0.0 113.527 179.043 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.419 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 65.4 Cg_endo -83.43 -14.18 8.21 Favored 'Trans proline' 0 N--CA 1.494 1.534 0 C-N-CA 121.985 1.79 . . . . 0.0 112.23 -179.231 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 24.0 mtpt 74.2 109.84 0.07 Allowed 'General case' 0 N--CA 1.498 1.955 0 CA-C-O 121.581 0.705 . . . . 0.0 109.539 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.518 ' C ' ' H ' ' A' ' 50' ' ' ASP . 1.5 tt -87.05 -48.06 8.4 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.589 -0.694 . . . . 0.0 109.791 -179.144 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -68.34 40.53 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.082 -1.011 . . . . 0.0 109.381 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.518 ' H ' ' C ' ' A' ' 48' ' ' LEU . 5.6 t0 -146.55 -70.09 0.25 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.251 -0.906 . . . . 0.0 109.598 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.403 ' O ' ' O ' ' A' ' 50' ' ' ASP . 21.9 pttp -64.28 -141.16 0.0 OUTLIER 'General case' 0 C--N 1.298 -1.664 0 O-C-N 121.351 -0.843 . . . . 0.0 108.958 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 38.5 t -74.22 133.51 78.02 Favored Pre-proline 0 N--CA 1.485 1.314 0 O-C-N 120.594 -1.317 . . . . 0.0 109.378 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.41 ' O ' ' CB ' ' A' ' 54' ' ' ASP . 31.4 Cg_endo -83.47 -16.82 6.69 Favored 'Trans proline' 0 N--CA 1.499 1.836 0 C-N-CA 122.489 2.126 . . . . 0.0 112.627 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.41 ' CB ' ' O ' ' A' ' 53' ' ' PRO . 1.0 OUTLIER 77.47 -133.85 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.611 -0.681 . . . . 0.0 109.768 -179.053 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.784 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 12.6 p -167.97 -30.02 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.581 0 O-C-N 120.745 -1.222 . . . . 0.0 113.454 -179.269 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.784 ' CD ' ' H ' ' A' ' 55' ' ' SER . 73.2 Cg_exo -55.63 41.74 0.03 OUTLIER 'Trans proline' 0 N--CA 1.503 2.065 0 C-N-CA 122.243 1.962 . . . . 0.0 113.435 -179.421 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.626 ' N ' ' O ' ' A' ' 55' ' ' SER . 13.2 tt0 50.32 23.63 1.28 Allowed 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 -179.212 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.418 ' N ' ' C ' ' A' ' 56' ' ' PRO . 1.1 mpt? 67.94 -5.78 0.8 Allowed 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 -178.187 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.522 ' N ' ' O ' ' A' ' 56' ' ' PRO . 0.2 OUTLIER -47.75 -51.95 20.4 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-O 121.735 0.779 . . . . 0.0 108.963 178.902 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -52.41 -25.48 10.07 Favored 'General case' 0 C--N 1.3 -1.579 0 C-N-CA 120.497 -0.481 . . . . 0.0 109.842 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -75.81 -57.1 4.08 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 178.526 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -61.98 -33.83 75.03 Favored 'General case' 0 C--N 1.302 -1.479 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.683 179.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.401 ' O ' ' N ' ' A' ' 67' ' ' ILE . 1.3 t60 -61.34 -38.97 88.85 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.242 -0.911 . . . . 0.0 108.925 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.58 -32.04 82.89 Favored Glycine 0 N--CA 1.484 1.891 0 N-CA-C 108.874 -1.69 . . . . 0.0 108.874 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.553 ' O ' HG23 ' A' ' 69' ' ' VAL . 52.7 m-85 -81.34 -41.64 21.74 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.185 -1.185 . . . . 0.0 107.995 178.36 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -69.96 -45.38 67.54 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 179.117 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.401 ' N ' ' O ' ' A' ' 63' ' ' HIS . 4.6 mm -55.1 -49.86 68.38 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 178.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.462 HD13 HG21 ' A' ' 97' ' ' THR . 14.0 tp -59.03 -41.95 89.03 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.553 HG23 ' O ' ' A' ' 65' ' ' PHE . 41.7 t -60.89 -18.96 18.55 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 178.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -79.6 -46.49 7.9 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 110.567 -1.013 . . . . 0.0 110.567 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.533 ' NE2' ' O ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -67.73 -31.26 71.07 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 120.426 -1.632 . . . . 0.0 106.943 179.506 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 14.3 mt -72.84 -32.47 40.36 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.493 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 176.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -63.18 -52.04 63.93 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.454 -0.778 . . . . 0.0 110.013 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.52 -28.53 69.71 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.166 -0.959 . . . . 0.0 109.756 -179.048 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.57 -35.28 67.91 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 120.529 -1.357 . . . . 0.0 108.038 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.1 -33.04 64.72 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 178.349 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 6.8 tptt -67.48 -46.14 73.82 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 178.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 mp -58.48 -33.6 69.97 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.518 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -63.92 -50.59 68.08 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.026 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -74.43 -12.61 60.55 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.639 -0.663 . . . . 0.0 111.395 -178.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -93.76 -10.63 33.57 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 120.622 -1.299 . . . . 0.0 110.536 -178.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 99.31 11.14 46.11 Favored Glycine 0 N--CA 1.498 2.772 0 C-N-CA 119.92 -1.133 . . . . 0.0 110.368 179.521 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.4 mmtp -95.91 85.06 3.98 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.094 -1.239 . . . . 0.0 108.282 179.056 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 30.9 t -77.22 -59.4 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.225 -178.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.468 ' HD2' ' H ' ' A' ' 85' ' ' LYS . 7.8 mptt -54.49 -37.08 64.86 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 120.771 -1.206 . . . . 0.0 109.221 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -66.93 -42.71 84.85 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 178.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.11 -49.09 68.72 Favored 'General case' 0 C--N 1.306 -1.316 0 C-N-CA 119.404 -0.918 . . . . 0.0 108.805 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.43 ' O ' ' OE1' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -61.55 -48.49 80.75 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 179.442 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -54.52 -33.11 59.38 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 120.978 -1.076 . . . . 0.0 108.419 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.514 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -66.39 -32.92 74.6 Favored 'General case' 0 C--N 1.306 -1.286 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 178.55 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -48.19 -50.32 29.54 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.43 ' OE1' ' O ' ' A' ' 88' ' ' GLN . 19.7 mp0 -60.57 -27.96 68.1 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 178.167 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.514 ' N ' ' O ' ' A' ' 90' ' ' ALA . 1.7 tm0? -74.22 -40.24 62.57 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 106.896 -1.52 . . . . 0.0 106.896 178.404 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.457 ' CD1' ' OE1' ' A' ' 71' ' ' GLN . 8.7 mp -64.07 -42.19 97.06 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 179.264 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 6.2 mtpt -57.94 -44.48 86.96 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.885 -1.135 . . . . 0.0 108.256 178.531 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 23.9 m -66.96 -27.79 67.75 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.154 -0.967 . . . . 0.0 109.214 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.462 HG21 HD13 ' A' ' 68' ' ' LEU . 0.9 OUTLIER -62.21 -40.55 96.48 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 178.435 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 69.4 mt -49.83 -39.73 15.33 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.45 -43.95 80.02 Favored 'General case' 0 C--N 1.302 -1.466 0 C-N-CA 118.31 -1.356 . . . . 0.0 108.046 179.213 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.632 ' O ' ' NE2' ' A' ' 103' ' ' GLN . . . -65.83 -27.44 68.25 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.841 0.829 . . . . 0.0 109.305 179.316 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.44 ' O ' ' N ' ' A' ' 105' ' ' TYR . 12.4 t80 -71.71 -27.89 63.32 Favored 'General case' 0 C--N 1.294 -1.821 0 O-C-N 120.384 -1.448 . . . . 0.0 107.794 179.515 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -67.39 -41.84 84.33 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.109 -0.994 . . . . 0.0 110.229 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.632 ' NE2' ' O ' ' A' ' 100' ' ' ALA . 0.7 OUTLIER -62.09 -21.74 65.23 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 105.403 -2.073 . . . . 0.0 105.403 178.663 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.48 -34.95 23.27 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 177.247 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.558 ' C ' ' CD1' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -88.54 8.24 29.15 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.921 -1.112 . . . . 0.0 109.018 -179.617 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.317 0 CA-C-O 117.958 -1.468 . . . . 0.0 109.485 179.868 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 -86.16 -16.08 39.0 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.304 -0.872 . . . . 0.0 109.37 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 17.3 mt -89.07 -49.2 6.9 Favored 'General case' 0 C--N 1.295 -1.777 0 CA-C-O 121.631 0.729 . . . . 0.0 109.083 -178.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -66.86 -23.83 66.07 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 179.03 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -76.2 -49.91 15.92 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.851 -179.208 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.641 HD22 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -52.03 -42.81 63.36 Favored 'General case' 0 C--N 1.307 -1.245 0 O-C-N 121.252 -0.905 . . . . 0.0 108.695 -179.091 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.641 ' N ' HD22 ' A' ' 6' ' ' ASN . 11.0 m95 -57.61 -51.13 70.74 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.1 -1.0 . . . . 0.0 109.245 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -58.61 -30.16 67.03 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.131 -0.981 . . . . 0.0 108.726 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 46.5 m -67.96 -54.51 18.07 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 119.257 -0.977 . . . . 0.0 108.601 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.8 mt -59.05 -37.76 77.8 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 106.966 -1.494 . . . . 0.0 106.966 178.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -68.3 -55.07 13.38 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 119.725 -0.79 . . . . 0.0 109.104 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -59.05 -16.4 18.57 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.562 -0.711 . . . . 0.0 109.626 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -74.53 -53.55 9.23 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 179.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.9 mt -58.07 -30.69 66.41 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 122.011 -0.431 . . . . 0.0 111.278 -178.198 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.9 ttpp -69.15 -43.11 74.96 Favored 'General case' 0 C--N 1.295 -1.794 0 C-N-CA 118.622 -1.231 . . . . 0.0 108.963 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.532 ' O ' ' N ' ' A' ' 20' ' ' ALA . 53.7 t -57.93 -26.35 28.25 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.61 0 O-C-N 121.11 -0.994 . . . . 0.0 109.52 -179.498 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.489 ' O ' ' N ' ' A' ' 20' ' ' ALA . 9.6 mt -71.66 -72.25 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.084 -1.01 . . . . 0.0 110.499 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -47.12 -27.46 1.41 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.017 -1.052 . . . . 0.0 109.139 -179.395 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.74 2.47 30.33 Favored 'General case' 0 N--CA 1.5 2.061 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 178.853 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.608 ' C ' ' H ' ' A' ' 22' ' ' ASN . . . -56.66 -40.44 75.5 Favored 'General case' 0 N--CA 1.491 1.579 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 178.809 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 57.25 -13.28 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.988 -0.445 . . . . 0.0 110.84 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.608 ' H ' ' C ' ' A' ' 20' ' ' ALA . 0.4 OUTLIER -146.83 145.57 29.92 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 120.656 -1.278 . . . . 0.0 108.814 178.834 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -53.98 -35.44 61.83 Favored 'General case' 0 C--N 1.296 -1.747 0 O-C-N 121.901 -0.5 . . . . 0.0 111.761 -179.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.77 -49.36 76.84 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 120.987 -1.07 . . . . 0.0 110.671 -178.163 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.547 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 18.9 mt-30 -67.3 -17.68 64.87 Favored 'General case' 0 C--N 1.3 -1.551 0 O-C-N 121.038 -1.039 . . . . 0.0 110.271 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.449 HG12 ' HB2' ' A' ' 79' ' ' ALA . 47.2 t -73.05 -51.05 28.05 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.078 -1.014 . . . . 0.0 108.587 179.432 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.427 ' O ' ' OG1' ' A' ' 31' ' ' THR . 3.2 mppt? -54.21 -44.65 71.84 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -53.89 -38.79 65.16 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.046 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.77 -65.03 0.79 Allowed 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.483 -0.761 . . . . 0.0 110.452 -179.458 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 26.3 mt -61.7 -27.86 69.0 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.144 -0.972 . . . . 0.0 110.392 -178.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.427 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 33.7 m -62.25 -40.38 95.99 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 178.557 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 12.2 mmmt -72.39 -30.36 64.59 Favored 'General case' 0 C--N 1.296 -1.719 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.386 -179.346 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' MET . . . . . 0.409 ' O ' ' C ' ' A' ' 34' ' ' ARG . 48.7 mtt -63.71 -67.55 0.42 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.024 -1.048 . . . . 0.0 108.797 178.731 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.721 HH21 ' CB ' ' A' ' 73' ' ' ASP . 0.3 OUTLIER -44.01 -29.89 0.65 Allowed 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 -179.243 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.24 -59.1 2.89 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 178.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.77 -34.81 78.73 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.119 -0.988 . . . . 0.0 109.451 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.55 -38.46 71.93 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.194 -0.941 . . . . 0.0 108.697 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 11.9 mt -67.8 -29.0 68.07 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -85.11 -38.78 18.69 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.077 -1.015 . . . . 0.0 109.336 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.413 ' O ' ' CB ' ' A' ' 43' ' ' ALA . . . -56.5 -23.13 37.4 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.159 -0.963 . . . . 0.0 108.719 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.49 ' C ' ' H ' ' A' ' 43' ' ' ALA . 0.5 OUTLIER -52.19 -51.55 57.42 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.264 -0.898 . . . . 0.0 108.94 179.315 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -67.04 10.11 0.16 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.406 -0.809 . . . . 0.0 109.444 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.49 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -79.37 128.71 33.67 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.878 -1.139 . . . . 0.0 108.772 179.682 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.665 HG23 ' O ' ' A' ' 44' ' ' THR . 12.2 t -154.56 61.93 3.4 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.335 -0.853 . . . . 0.0 109.637 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.453 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 86.4 Cg_exo -43.06 -37.31 6.36 Favored 'Trans proline' 0 C--N 1.304 -1.788 0 C-N-CA 122.716 2.277 . . . . 0.0 114.284 179.049 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.453 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 23.1 Cg_endo -93.75 -16.28 0.72 Allowed 'Trans proline' 0 N--CA 1.483 0.86 0 C-N-CA 122.566 2.177 . . . . 0.0 111.847 -179.198 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 21.3 mttm 80.06 98.29 0.06 Allowed 'General case' 0 N--CA 1.5 2.027 0 CA-C-O 121.25 0.547 . . . . 0.0 109.659 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.511 HD23 ' O ' ' A' ' 48' ' ' LEU . 1.0 OUTLIER -84.28 9.19 13.61 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.371 -0.831 . . . . 0.0 109.323 -179.89 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -99.61 27.82 5.08 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -148.87 -50.33 0.15 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.385 -0.822 . . . . 0.0 110.324 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -65.56 -160.55 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.181 -0.95 . . . . 0.0 109.377 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 20.8 t -73.13 129.99 85.4 Favored Pre-proline 0 N--CA 1.485 1.312 0 O-C-N 120.908 -1.12 . . . . 0.0 109.184 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -82.67 -9.11 11.19 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 122.64 2.227 . . . . 0.0 111.437 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 72.59 -114.48 0.05 Allowed 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 -178.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.737 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 1.4 t -167.87 -32.45 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.719 0 O-C-N 120.2 -1.563 . . . . 0.0 113.288 -179.498 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.737 ' CD ' ' H ' ' A' ' 55' ' ' SER . 68.1 Cg_exo -56.44 40.98 0.04 OUTLIER 'Trans proline' 0 N--CA 1.502 2.024 0 C-N-CA 122.068 1.845 . . . . 0.0 112.774 -179.739 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.645 ' N ' ' O ' ' A' ' 55' ' ' SER . 41.1 tt0 50.79 23.18 1.32 Allowed 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 106.999 -1.482 . . . . 0.0 106.999 -178.883 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.476 ' SD ' ' O ' ' A' ' 57' ' ' GLU . 0.3 OUTLIER 66.38 -3.51 0.83 Allowed 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 -178.272 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.558 ' N ' ' O ' ' A' ' 56' ' ' PRO . 0.9 OUTLIER -48.43 -48.38 37.41 Favored 'General case' 0 N--CA 1.487 1.404 0 CA-C-O 121.851 0.834 . . . . 0.0 109.424 178.984 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -51.13 -26.6 6.88 Favored 'General case' 0 C--N 1.295 -1.792 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 -179.015 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -77.93 -57.1 3.98 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 120.842 -1.161 . . . . 0.0 107.924 177.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.6 mtt-85 -58.44 -30.6 67.04 Favored 'General case' 0 N--CA 1.488 1.435 0 CA-C-O 121.366 0.603 . . . . 0.0 109.483 179.513 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.614 ' NE2' HD11 ' A' ' 67' ' ' ILE . 1.8 t60 -63.65 -39.74 95.1 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.276 -0.89 . . . . 0.0 109.041 179.474 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -61.51 -31.92 79.32 Favored Glycine 0 N--CA 1.486 2.009 0 C-N-CA 118.737 -1.697 . . . . 0.0 109.132 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -81.8 -40.08 23.08 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.054 -1.262 . . . . 0.0 108.291 178.304 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -70.73 -48.62 53.55 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 178.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.614 HD11 ' NE2' ' A' ' 63' ' ' HIS . 20.5 mm -56.49 -39.06 59.42 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 15.8 tp -56.99 -44.3 82.58 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.4 HG13 ' HG2' ' A' ' 34' ' ' ARG . 20.3 t -63.01 -17.22 18.99 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.45 0 O-C-N 120.918 -1.114 . . . . 0.0 109.095 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -76.24 -40.91 27.75 Favored Glycine 0 N--CA 1.487 2.079 0 C-N-CA 119.859 -1.162 . . . . 0.0 111.011 -178.485 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.592 HE21 ' C ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -78.38 -32.67 49.02 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.998 -1.295 . . . . 0.0 107.841 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 7.0 mt -74.19 -30.45 26.98 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.679 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 177.029 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.721 ' CB ' HH21 ' A' ' 34' ' ' ARG . 0.0 OUTLIER -61.1 -52.57 64.36 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 119.679 -0.808 . . . . 0.0 109.528 -179.658 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -62.27 -32.11 72.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.032 -1.042 . . . . 0.0 108.978 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.46 -34.55 65.44 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 120.87 -1.144 . . . . 0.0 108.252 179.148 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.71 -30.34 55.64 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 106.943 -1.503 . . . . 0.0 106.943 178.638 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.6 tptt -70.85 -48.94 51.23 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-O 121.657 0.742 . . . . 0.0 109.66 178.515 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.445 HD23 ' HB3' ' A' ' 86' ' ' GLU . 8.1 mp -56.93 -34.66 68.19 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 -179.428 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.449 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -64.62 -49.7 70.02 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -73.08 -14.31 61.37 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.634 -0.666 . . . . 0.0 111.314 -179.055 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -94.55 -10.1 33.18 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.801 -1.187 . . . . 0.0 110.312 -178.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 97.38 12.6 47.84 Favored Glycine 0 N--CA 1.499 2.877 0 C-N-CA 120.237 -0.982 . . . . 0.0 110.77 178.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 14.3 mmtp -94.94 83.84 4.04 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.009 -1.289 . . . . 0.0 108.687 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 26.1 t -77.34 -56.45 7.87 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 O-C-N 121.79 -0.569 . . . . 0.0 110.009 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.496 ' HD2' ' H ' ' A' ' 85' ' ' LYS . 8.6 mptt -49.64 -39.42 35.94 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.221 -0.924 . . . . 0.0 108.648 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.547 ' OE1' ' N ' ' A' ' 86' ' ' GLU . 47.7 mp0 -70.18 -44.55 68.52 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 121.402 -0.811 . . . . 0.0 109.007 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.13 -38.91 86.38 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 119.359 -0.936 . . . . 0.0 109.338 -179.704 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.425 ' O ' ' N ' ' A' ' 91' ' ' ALA . 3.6 tt0 -61.39 -62.77 1.59 Allowed 'General case' 0 C--N 1.294 -1.825 0 CA-C-O 121.632 0.729 . . . . 0.0 109.607 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -49.76 -34.95 20.68 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.097 -1.002 . . . . 0.0 109.583 -179.317 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.531 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -62.03 -35.13 77.67 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 178.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.425 ' N ' ' O ' ' A' ' 88' ' ' GLN . . . -50.22 -43.43 52.78 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.027 -1.046 . . . . 0.0 108.204 178.664 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -62.8 -23.91 67.48 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 178.4 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.531 ' N ' ' O ' ' A' ' 90' ' ' ALA . 1.6 tm0? -73.8 -37.92 64.77 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 106.441 -1.688 . . . . 0.0 106.441 177.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.435 ' N ' HD12 ' A' ' 94' ' ' LEU . 10.9 mp -68.29 -45.46 72.98 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -50.26 -38.99 43.63 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 107.85 -1.166 . . . . 0.0 107.85 179.281 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 34.7 m -72.79 -32.07 65.31 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.425 -0.797 . . . . 0.0 109.238 177.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.9 m -58.65 -46.97 85.99 Favored 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 4.3 mm -49.15 -40.91 13.76 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 179.305 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 10.1 ttt180 -64.5 -55.36 21.22 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 119.22 -0.992 . . . . 0.0 109.294 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.404 ' O ' ' OE1' ' A' ' 103' ' ' GLN . . . -63.4 -19.25 64.52 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.181 -0.949 . . . . 0.0 109.021 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.422 ' CD1' ' C ' ' A' ' 101' ' ' TYR . 9.1 t80 -74.56 -31.11 61.98 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 178.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.4 ' OD1' ' C ' ' A' ' 102' ' ' ASN . 0.2 OUTLIER -66.67 -42.36 86.7 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.998 -1.064 . . . . 0.0 110.096 -179.908 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.517 ' OE1' ' N ' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -63.2 -15.76 57.99 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 116.808 -1.957 . . . . 0.0 105.778 179.443 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.517 ' N ' ' OE1' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -82.27 -34.19 28.84 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 106.759 -1.571 . . . . 0.0 106.759 175.572 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.527 ' O ' ' CG ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -91.76 6.36 46.28 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 179.338 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.32 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 179.63 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.551 0 CA-C-O 121.276 0.56 . . . . 0.0 109.495 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -86.57 -26.01 24.71 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.224 -0.922 . . . . 0.0 109.185 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.7 pp -88.53 -32.14 18.33 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 107.175 -1.417 . . . . 0.0 107.175 179.237 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -67.94 -25.1 65.29 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 105.579 -2.008 . . . . 0.0 105.579 177.037 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -72.95 -36.52 67.18 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.771 HD22 ' HB2' ' A' ' 40' ' ' ALA . 0.1 OUTLIER -56.95 -41.28 78.0 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 179.452 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 16.9 m95 -57.88 -46.91 84.16 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.079 -1.013 . . . . 0.0 108.841 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -63.2 -28.89 70.35 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 120.884 -1.135 . . . . 0.0 108.548 179.238 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 89.0 m -68.55 -62.86 1.2 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.464 -0.773 . . . . 0.0 109.733 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.2 pp -57.25 -31.3 65.41 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 118.451 -1.3 . . . . 0.0 108.181 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -70.03 -62.59 1.33 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.072 -1.018 . . . . 0.0 109.651 178.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -58.11 -11.89 2.97 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.368 -0.832 . . . . 0.0 109.79 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.462 ' O ' HG22 ' A' ' 16' ' ' VAL . 2.1 m-20 -72.65 -53.23 12.36 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 179.063 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.2 mt -56.75 -24.85 52.92 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.667 -178.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -68.67 -54.99 12.92 Favored 'General case' 0 C--N 1.301 -1.52 0 C-N-CA 118.414 -1.314 . . . . 0.0 109.166 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.636 ' O ' ' N ' ' A' ' 20' ' ' ALA . 12.5 m -55.01 -20.96 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 120.731 -1.23 . . . . 0.0 110.448 -179.048 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.498 ' O ' ' N ' ' A' ' 20' ' ' ALA . 10.6 mt -71.53 -72.88 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 O-C-N 120.373 -1.454 . . . . 0.0 109.622 179.416 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -47.71 -27.37 1.93 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.837 -1.164 . . . . 0.0 108.749 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.4 -0.19 32.94 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.636 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -57.99 -49.0 78.34 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 179.405 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 67.88 -12.33 0.31 Allowed 'General case' 0 C--N 1.296 -1.742 0 O-C-N 121.772 -0.58 . . . . 0.0 109.926 179.336 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.495 ' N ' ' OD1' ' A' ' 22' ' ' ASN . 0.5 OUTLIER -144.84 143.8 30.8 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.946 -1.096 . . . . 0.0 109.554 178.925 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.21 -24.91 57.7 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 121.882 -0.511 . . . . 0.0 111.193 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.46 -51.61 64.92 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.073 -1.017 . . . . 0.0 109.965 -179.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.509 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 9.4 mt-30 -68.46 -17.55 64.22 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.285 -0.885 . . . . 0.0 110.548 -179.475 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.442 HG12 ' HB2' ' A' ' 79' ' ' ALA . 48.9 t -71.74 -50.23 40.2 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 O-C-N 120.962 -1.087 . . . . 0.0 108.661 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.455 ' O ' ' OG1' ' A' ' 31' ' ' THR . 5.1 mppt? -54.5 -53.22 57.27 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 106.954 -1.498 . . . . 0.0 106.954 179.164 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -52.36 -38.87 59.86 Favored 'General case' 0 C--N 1.296 -1.738 0 CA-C-N 114.717 -1.129 . . . . 0.0 109.453 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.58 -67.75 0.46 Allowed 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.468 -0.77 . . . . 0.0 110.433 -179.098 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.493 ' HB3' HD12 ' A' ' 76' ' ' LEU . 33.9 mt -59.16 -25.77 64.2 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.345 -0.847 . . . . 0.0 109.913 -178.735 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.455 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 20.8 m -61.39 -38.98 89.01 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 179.124 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 33.1 mttm -74.17 -31.06 62.54 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' MET . . . . . 0.442 ' SD ' HD23 ' A' ' 30' ' ' LEU . 41.2 mtp -66.65 -65.38 0.69 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.993 -1.067 . . . . 0.0 108.173 178.205 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.445 HH11 ' HD3' ' A' ' 34' ' ' ARG . 18.2 ttt-85 -47.68 -25.56 1.24 Allowed 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.0 -60.12 2.41 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 119.843 -0.743 . . . . 0.0 109.025 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.78 -33.21 75.15 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.018 -1.051 . . . . 0.0 109.826 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.48 -39.73 73.72 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.087 -1.008 . . . . 0.0 108.795 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.5 mt -65.96 -32.11 73.41 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.405 -0.809 . . . . 0.0 108.878 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -86.22 -36.61 19.33 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.224 -0.922 . . . . 0.0 109.986 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.771 ' HB2' HD22 ' A' ' 6' ' ' ASN . . . -60.02 -22.24 62.36 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.151 -0.968 . . . . 0.0 110.461 -179.075 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.579 ' C ' ' H ' ' A' ' 43' ' ' ALA . 5.0 tm0? -48.84 -66.54 0.38 Allowed 'General case' 0 C--N 1.3 -1.556 0 O-C-N 120.879 -1.138 . . . . 0.0 109.335 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.455 ' HD2' ' H ' ' A' ' 42' ' ' LYS . 2.8 mptp? -53.96 5.04 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.625 -0.672 . . . . 0.0 110.71 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.579 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -78.48 134.47 37.32 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.607 -1.308 . . . . 0.0 109.515 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -152.18 72.1 7.74 Favored Pre-proline 0 N--CA 1.492 1.656 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.44 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 52.0 Cg_exo -46.81 -39.12 23.91 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.521 2.147 . . . . 0.0 113.905 -179.305 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.44 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 89.5 Cg_endo -97.63 -95.75 0.0 OUTLIER 'Trans proline' 0 C--N 1.319 -1.02 0 C-N-CA 122.426 2.084 . . . . 0.0 111.852 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 4.0 pttt -175.6 116.57 0.15 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.283 -0.886 . . . . 0.0 110.005 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.54 ' CD2' ' H ' ' A' ' 49' ' ' GLU . 0.4 OUTLIER -83.86 -172.66 4.28 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 178.116 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.54 ' H ' ' CD2' ' A' ' 48' ' ' LEU . 59.8 mt-10 49.27 23.3 0.79 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.76 -1.212 . . . . 0.0 108.814 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.403 ' N ' ' C ' ' A' ' 48' ' ' LEU . 4.3 m-20 -140.49 -70.5 0.38 Allowed 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.421 ' HG3' ' N ' ' A' ' 52' ' ' SER . 17.5 pttp -66.96 -121.69 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 178.607 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.421 ' N ' ' HG3' ' A' ' 51' ' ' LYS . 9.1 t -81.89 114.1 47.91 Favored Pre-proline 0 N--CA 1.488 1.446 0 O-C-N 120.539 -1.351 . . . . 0.0 109.581 179.134 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -90.19 -16.24 1.8 Allowed 'Trans proline' 0 N--CA 1.491 1.372 0 C-N-CA 122.452 2.101 . . . . 0.0 112.023 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 65.05 -131.6 0.27 Allowed 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 -178.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.756 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 7.5 t -170.06 -33.84 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 120.859 -1.151 . . . . 0.0 112.363 179.632 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.756 ' CD ' ' H ' ' A' ' 55' ' ' SER . 95.0 Cg_exo -51.52 59.35 0.02 OUTLIER 'Trans proline' 0 N--CA 1.505 2.178 0 C-N-CA 122.608 2.205 . . . . 0.0 114.116 -178.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.634 ' N ' ' O ' ' A' ' 55' ' ' SER . 93.5 mt-10 42.42 29.51 0.16 Allowed 'General case' 0 N--CA 1.493 1.725 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.473 ' SD ' ' C ' ' A' ' 57' ' ' GLU . 1.3 mpt? 65.27 -8.17 0.27 Allowed 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 -178.107 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.61 ' H ' ' C ' ' A' ' 57' ' ' GLU . 2.4 tmtm? -48.1 -43.27 30.77 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-O 121.804 0.811 . . . . 0.0 109.169 179.296 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -56.29 -27.08 54.23 Favored 'General case' 0 C--N 1.294 -1.834 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 -179.226 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -73.94 -53.14 10.78 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.5 mtt85 -61.79 -33.0 73.33 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.392 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.427 ' O ' ' N ' ' A' ' 67' ' ' ILE . 0.7 OUTLIER -63.29 -35.88 81.84 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.226 -0.921 . . . . 0.0 108.704 179.594 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.34 -31.82 80.11 Favored Glycine 0 N--CA 1.485 1.915 0 N-CA-C 108.326 -1.91 . . . . 0.0 108.326 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.466 ' HZ ' ' HZ1' ' A' ' 104' ' ' LYS . 65.4 m-85 -81.67 -38.01 26.56 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 178.011 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -72.14 -47.4 51.33 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.427 ' N ' ' O ' ' A' ' 63' ' ' HIS . 4.8 mm -56.2 -48.88 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 179.037 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 14.8 tp -57.41 -44.93 84.99 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 65' ' ' PHE . 32.1 t -65.92 -19.93 26.49 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.366 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 178.473 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -77.75 -48.39 7.92 Favored Glycine 0 N--CA 1.488 2.145 0 C-N-CA 120.1 -1.047 . . . . 0.0 110.549 -178.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.58 HE21 ' C ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -71.37 -29.79 65.38 Favored 'General case' 0 C--N 1.305 -1.341 0 O-C-N 120.823 -1.398 . . . . 0.0 107.583 179.725 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 8.1 mt -75.16 -33.64 29.27 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.507 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 176.158 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -62.74 -58.69 6.59 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.256 -0.902 . . . . 0.0 109.332 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.72 -26.81 67.45 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.64 -31.13 63.35 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 107.821 -1.178 . . . . 0.0 107.821 178.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.493 HD12 ' HB3' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -57.07 -33.55 67.38 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 106.236 -1.764 . . . . 0.0 106.236 178.155 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.8 tptt -68.16 -48.17 66.06 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.517 179.07 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.5 mp -57.69 -34.95 69.97 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.442 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -64.21 -50.4 68.2 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 178.212 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -73.44 -12.0 60.65 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.47 -0.769 . . . . 0.0 111.352 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -95.12 -12.81 25.8 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.663 -1.273 . . . . 0.0 110.23 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 99.28 11.85 43.96 Favored Glycine 0 N--CA 1.495 2.607 0 C-N-CA 120.206 -0.997 . . . . 0.0 110.688 179.299 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.3 mmtp -93.65 78.68 4.28 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 120.887 -1.361 . . . . 0.0 108.135 179.203 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 26.3 t -75.91 -50.67 22.37 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.679 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.72 -179.042 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.455 ' HD2' ' H ' ' A' ' 85' ' ' LYS . 6.9 mptt -53.0 -38.7 62.53 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 120.936 -1.102 . . . . 0.0 108.18 179.119 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.541 ' CD ' ' N ' ' A' ' 86' ' ' GLU . 4.7 mp0 -69.08 -42.95 75.52 Favored 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 178.715 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.5 -51.97 44.72 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 119.532 -0.867 . . . . 0.0 109.707 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.5 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -60.44 -49.45 77.51 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 -179.893 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -55.0 -37.29 66.39 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.853 -1.155 . . . . 0.0 108.402 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.518 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -65.68 -31.91 73.18 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 178.313 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.5 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -49.87 -43.24 49.09 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 178.858 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -65.43 -27.51 68.57 Favored 'General case' 0 C--N 1.306 -1.285 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 178.128 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.518 ' N ' ' O ' ' A' ' 90' ' ' ALA . 1.6 tm0? -73.42 -41.25 63.5 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 106.605 -1.628 . . . . 0.0 106.605 177.805 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.449 HD11 ' OE1' ' A' ' 71' ' ' GLN . 7.4 mp -67.56 -37.05 82.1 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 108.315 -0.995 . . . . 0.0 108.315 179.038 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 2.4 mtpt -53.89 -39.42 65.75 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 120.049 -1.657 . . . . 0.0 106.685 177.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.3 m -71.05 -26.01 62.89 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.373 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.431 ' O ' ' N ' ' A' ' 101' ' ' TYR . 1.2 m -60.84 -46.33 91.0 Favored 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 179.321 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 81.4 mt -51.33 -43.01 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 179.564 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -62.95 -56.76 14.33 Favored 'General case' 0 C--N 1.307 -1.269 0 C-N-CA 119.633 -0.827 . . . . 0.0 109.816 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.432 ' O ' ' HG3' ' A' ' 103' ' ' GLN . . . -63.68 -21.68 66.51 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.858 -1.151 . . . . 0.0 108.828 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.629 ' CE2' ' NZ ' ' A' ' 104' ' ' LYS . 11.2 t80 -75.89 -27.46 57.72 Favored 'General case' 0 C--N 1.291 -1.938 0 O-C-N 120.351 -1.468 . . . . 0.0 107.328 178.823 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.406 ' O ' ' N ' ' A' ' 106' ' ' GLY . 0.2 OUTLIER -67.06 -36.25 81.63 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 119.588 -0.845 . . . . 0.0 109.944 -179.762 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.432 ' HG3' ' O ' ' A' ' 100' ' ' ALA . 0.0 OUTLIER -65.32 -23.68 67.07 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 105.158 -2.164 . . . . 0.0 105.158 178.814 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.629 ' NZ ' ' CE2' ' A' ' 101' ' ' TYR . 0.0 OUTLIER -80.95 -30.86 35.13 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 176.601 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.549 ' C ' ' CD1' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -94.84 7.74 44.96 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.186 -0.947 . . . . 0.0 108.782 179.994 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.406 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.492 2.413 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.575 0 CA-C-O 121.354 0.597 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -86.22 -20.92 27.8 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.275 -0.891 . . . . 0.0 109.296 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 60.9 mt -89.26 -48.27 7.48 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -63.64 -23.71 67.49 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 178.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -72.97 -47.37 45.97 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.524 HD22 ' HB2' ' A' ' 40' ' ' ALA . 0.1 OUTLIER -53.99 -38.85 65.51 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 -179.814 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 8.2 m95 -55.89 -55.58 30.87 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.146 -0.971 . . . . 0.0 109.621 -179.397 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -52.47 -29.8 26.62 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 120.586 -1.321 . . . . 0.0 109.689 -179.053 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 53.5 m -68.94 -65.38 0.71 Allowed 'General case' 0 N--CA 1.487 1.421 0 O-C-N 120.837 -1.165 . . . . 0.0 109.599 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.6 pp -57.99 -30.29 65.94 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 118.66 -1.216 . . . . 0.0 108.454 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -71.62 -59.94 2.49 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.862 -1.149 . . . . 0.0 109.209 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.5 t0 -57.38 -13.09 3.01 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.291 -0.881 . . . . 0.0 109.632 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.456 ' O ' HG22 ' A' ' 16' ' ' VAL . 2.1 m-20 -72.73 -52.37 15.41 Favored 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 107.166 -1.42 . . . . 0.0 107.166 179.214 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.6 mt -56.16 -25.9 48.33 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-O 121.058 0.456 . . . . 0.0 110.779 -179.004 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 25.3 ttmt -68.68 -56.16 9.08 Favored 'General case' 0 C--N 1.3 -1.55 0 C-N-CA 118.669 -1.212 . . . . 0.0 109.215 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.643 ' O ' ' N ' ' A' ' 20' ' ' ALA . 14.3 m -54.28 -20.42 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 C-N-CA 118.771 -1.172 . . . . 0.0 110.578 -178.701 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 9.3 mt -71.28 -72.08 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 O-C-N 120.339 -1.476 . . . . 0.0 109.093 179.212 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -48.47 -27.4 2.65 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.871 -1.143 . . . . 0.0 108.639 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -101.61 0.2 35.9 Favored 'General case' 0 N--CA 1.495 1.825 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.643 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -59.93 -43.56 94.87 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 179.82 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 59.46 -9.08 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.036 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.522 ' H ' ' C ' ' A' ' 20' ' ' ALA . 0.6 OUTLIER -146.32 143.29 29.03 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 120.604 -1.31 . . . . 0.0 109.653 178.609 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.78 -29.71 54.89 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.679 -0.638 . . . . 0.0 111.423 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.67 -50.85 70.82 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.958 -1.089 . . . . 0.0 110.107 -178.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.499 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 6.3 mt-30 -68.7 -19.11 64.36 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.137 -0.977 . . . . 0.0 110.395 -179.582 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.484 HG12 ' HB2' ' A' ' 79' ' ' ALA . 43.0 t -71.95 -50.59 36.67 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 120.945 -1.097 . . . . 0.0 108.709 179.639 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.432 ' O ' ' OG1' ' A' ' 31' ' ' THR . 5.1 mtpt -54.79 -55.3 31.57 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 179.359 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -50.31 -38.36 41.19 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.85 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.56 -62.89 1.2 Allowed 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.243 -0.911 . . . . 0.0 110.05 -179.278 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 71.7 mt -61.46 -20.47 63.16 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.378 -0.826 . . . . 0.0 110.25 -179.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.432 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 56.7 m -61.21 -47.48 85.9 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 178.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.492 ' CB ' ' NZ ' ' A' ' 32' ' ' LYS . 0.4 OUTLIER -70.93 -25.81 62.91 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 121.807 -0.558 . . . . 0.0 109.793 -179.028 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' MET . . . . . 0.448 ' C ' ' N ' ' A' ' 35' ' ' ALA . 28.2 mtp -67.35 -66.94 0.5 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.784 -1.197 . . . . 0.0 108.905 178.586 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 22.0 ttt-85 -48.37 -21.58 0.55 Allowed 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.448 ' N ' ' C ' ' A' ' 33' ' ' MET . . . -75.06 -63.02 1.35 Allowed 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 178.201 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.25 -28.52 69.78 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.163 -0.961 . . . . 0.0 109.565 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.79 -41.83 87.6 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.071 -1.018 . . . . 0.0 108.648 179.645 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 22.7 mt -65.91 -28.62 69.08 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -85.94 -35.63 20.35 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.26 -0.9 . . . . 0.0 109.821 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.524 ' HB2' HD22 ' A' ' 6' ' ' ASN . . . -55.64 -29.83 59.93 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.028 -1.045 . . . . 0.0 108.974 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.478 ' NE2' ' C ' ' A' ' 41' ' ' GLN . 1.0 OUTLIER -48.06 -53.02 17.78 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-O 122.112 0.958 . . . . 0.0 108.546 178.824 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.434 ' HG2' ' H ' ' A' ' 42' ' ' LYS . 1.6 mmmm -65.35 6.92 0.24 Allowed 'General case' 0 C--N 1.297 -1.688 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.762 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.463 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -81.66 145.56 30.5 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.827 -1.17 . . . . 0.0 110.127 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.6 p -152.05 67.91 7.19 Favored Pre-proline 0 N--CA 1.492 1.661 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.443 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 73.3 Cg_exo -42.87 -38.7 7.05 Favored 'Trans proline' 0 C--N 1.304 -1.795 0 C-N-CA 122.457 2.105 . . . . 0.0 113.376 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.443 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 94.3 Cg_endo -103.07 -98.04 0.0 OUTLIER 'Trans proline' 0 C--N 1.32 -0.935 0 C-N-CA 122.647 2.232 . . . . 0.0 111.983 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.2 102.78 0.08 Allowed 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 -179.348 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.441 HD23 ' O ' ' A' ' 48' ' ' LEU . 1.2 tt -82.05 34.61 0.41 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.796 -1.19 . . . . 0.0 109.733 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.437 ' O ' ' OD1' ' A' ' 50' ' ' ASP . 7.4 pt-20 -133.84 22.67 3.9 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 178.28 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.437 ' OD1' ' O ' ' A' ' 49' ' ' GLU . 0.4 OUTLIER -151.75 -44.76 0.11 Allowed 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -179.161 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.475 ' HG3' ' N ' ' A' ' 52' ' ' SER . 10.3 ptmm? -66.89 -152.78 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.55 -0.719 . . . . 0.0 109.543 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.475 ' N ' ' HG3' ' A' ' 51' ' ' LYS . 7.5 t -77.03 118.73 73.87 Favored Pre-proline 0 N--CA 1.485 1.315 0 O-C-N 120.787 -1.195 . . . . 0.0 109.173 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -83.54 -15.36 7.44 Favored 'Trans proline' 0 N--CA 1.493 1.477 0 C-N-CA 122.327 2.018 . . . . 0.0 111.761 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 47.9 t0 60.47 -132.84 0.79 Allowed 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 -179.077 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.813 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 11.7 t -165.6 -26.97 0.0 OUTLIER Pre-proline 0 N--CA 1.495 1.79 0 O-C-N 120.328 -1.483 . . . . 0.0 113.898 -179.273 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.813 ' CD ' ' H ' ' A' ' 55' ' ' SER . 62.7 Cg_exo -56.51 47.29 0.04 OUTLIER 'Trans proline' 0 N--CA 1.504 2.106 0 C-N-CA 122.204 1.936 . . . . 0.0 113.346 -179.605 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.61 ' N ' ' O ' ' A' ' 55' ' ' SER . 0.6 OUTLIER 48.64 27.5 1.52 Allowed 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 -179.005 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.498 ' SD ' ' OE2' ' A' ' 57' ' ' GLU . 1.6 mpp? 64.04 -4.75 0.35 Allowed 'General case' 0 C--N 1.308 -1.202 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -178.213 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.545 ' N ' ' O ' ' A' ' 56' ' ' PRO . 0.1 OUTLIER -48.2 -44.76 33.06 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.947 0.88 . . . . 0.0 108.668 179.009 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.412 ' H ' ' HB2' ' A' ' 56' ' ' PRO . 2.7 t70 -56.41 -25.92 51.62 Favored 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.488 ' N ' ' O ' ' A' ' 58' ' ' MET . 15.6 t80 -76.18 -54.08 7.34 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 177.71 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.4 mtt85 -59.55 -30.35 68.56 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 179.142 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.703 ' CE1' HD11 ' A' ' 67' ' ' ILE . 2.4 t60 -61.98 -40.97 97.44 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -62.16 -33.57 86.3 Favored Glycine 0 N--CA 1.484 1.863 0 N-CA-C 109.091 -1.604 . . . . 0.0 109.091 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -81.79 -37.9 26.42 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.012 -1.287 . . . . 0.0 108.264 178.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -71.99 -47.44 52.0 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 178.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.703 HD11 ' CE1' ' A' ' 63' ' ' HIS . 15.8 mm -54.55 -45.09 71.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 12.8 tp -57.81 -44.49 86.42 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 42.6 t -60.7 -15.15 10.75 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 O-C-N 121.076 -1.015 . . . . 0.0 109.265 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -79.64 -47.66 7.15 Favored Glycine 0 N--CA 1.49 2.265 0 C-N-CA 119.786 -1.197 . . . . 0.0 110.682 -179.095 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.55 HE21 ' C ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -69.6 -29.84 67.46 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.699 -1.471 . . . . 0.0 107.532 179.894 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 4.7 mt -73.46 -34.34 42.46 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 176.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -63.28 -56.11 19.22 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.445 -0.784 . . . . 0.0 109.694 -179.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -62.2 -29.09 70.14 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.225 -0.922 . . . . 0.0 109.354 -179.437 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.31 -29.59 62.8 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 120.642 -1.286 . . . . 0.0 108.229 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.69 -33.84 66.84 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 106.211 -1.774 . . . . 0.0 106.211 178.161 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.1 tptt -68.4 -46.79 69.03 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.301 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.8 mp -57.4 -35.1 69.6 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.484 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -63.74 -50.1 70.41 Favored 'General case' 0 C--N 1.297 -1.705 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 178.172 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -74.87 -13.07 60.51 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.494 -0.753 . . . . 0.0 111.616 -178.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -93.84 -9.23 38.04 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 120.606 -1.309 . . . . 0.0 110.205 -179.119 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 97.35 12.65 47.78 Favored Glycine 0 N--CA 1.499 2.854 0 O-C-N 121.032 -1.042 . . . . 0.0 110.592 178.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.4 mmtp -95.08 81.24 3.66 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.044 -1.268 . . . . 0.0 108.127 179.235 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 53.1 t -76.51 -61.83 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.414 -178.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.3 mtmm -49.81 -34.95 21.13 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.03 -1.044 . . . . 0.0 108.427 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.611 ' H ' ' CD ' ' A' ' 86' ' ' GLU . 29.8 mp0 -68.27 -45.8 72.17 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 178.216 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.13 -46.52 73.86 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 119.463 -0.895 . . . . 0.0 108.871 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.474 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -59.71 -51.88 67.9 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 179.456 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.24 -33.85 71.5 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 120.902 -1.124 . . . . 0.0 108.338 179.049 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -66.35 -26.95 67.52 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 178.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -56.64 -47.45 79.7 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 178.624 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -64.72 -22.79 67.06 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 178.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -72.93 -39.59 66.14 Favored 'General case' 0 N--CA 1.485 1.275 0 N-CA-C 106.18 -1.785 . . . . 0.0 106.18 177.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.433 ' CD1' ' OE1' ' A' ' 71' ' ' GLN . 3.9 mp -63.46 -50.63 68.96 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 178.787 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 4.5 mtpp -50.33 -42.53 52.97 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 178.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 5.3 m -70.88 -40.95 71.95 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.34 -0.85 . . . . 0.0 109.034 179.048 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -61.15 -40.43 93.84 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 72.9 mt -54.94 -33.15 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -59.32 -50.82 72.52 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 119.656 -0.818 . . . . 0.0 109.564 -179.025 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.66 -34.91 78.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.824 -1.172 . . . . 0.0 108.619 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.489 ' CD1' ' C ' ' A' ' 101' ' ' TYR . 1.1 t80 -68.09 -26.11 65.66 Favored 'General case' 0 C--N 1.293 -1.871 0 O-C-N 120.579 -1.326 . . . . 0.0 107.829 179.131 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.52 ' O ' ' N ' ' A' ' 106' ' ' GLY . 0.1 OUTLIER -65.92 -34.91 79.21 Favored 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 119.162 -1.015 . . . . 0.0 110.057 -179.442 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.68 -21.83 66.58 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 104.759 -2.311 . . . . 0.0 104.759 178.662 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.5 -33.9 41.74 Favored 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 176.849 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.549 ' C ' ' CD1' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -94.1 3.14 55.72 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.122 -0.986 . . . . 0.0 108.442 179.016 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.52 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.491 2.36 0 CA-C-O 118.049 -1.417 . . . . 0.0 109.625 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 . . . . . 0 N--CA 1.493 1.722 0 CA-C-O 121.649 0.737 . . . . 0.0 109.088 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 44.4 mt -88.93 -50.08 6.41 Favored 'General case' 0 C--N 1.295 -1.771 0 CA-C-O 121.556 0.694 . . . . 0.0 109.172 -179.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.796 ' CD ' ' CB ' ' A' ' 4' ' ' GLU . . . -65.75 -26.34 67.68 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 178.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -76.87 -45.14 29.35 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.701 -179.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.575 HD22 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -52.33 -46.8 66.21 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 -179.19 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.575 ' N ' HD22 ' A' ' 6' ' ' ASN . 10.8 m95 -51.73 -57.76 8.33 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 179.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -58.5 -29.54 66.33 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 178.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.0 m -69.03 -55.41 10.91 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 119.328 -0.949 . . . . 0.0 108.986 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.8 mt -53.68 -40.82 66.27 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 106.845 -1.539 . . . . 0.0 106.845 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -68.21 -60.94 2.09 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 120.058 -0.657 . . . . 0.0 109.678 178.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -58.59 -13.6 6.14 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.394 -0.816 . . . . 0.0 110.153 -179.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.411 ' ND2' ' HG2' ' A' ' 33' ' ' MET . 4.8 m-20 -75.72 -54.69 6.55 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 179.331 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.4 mt -56.37 -28.58 59.59 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.296 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.2 ttpt -71.97 -42.71 66.22 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 120.802 -1.186 . . . . 0.0 108.942 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.573 ' O ' ' N ' ' A' ' 20' ' ' ALA . 72.5 t -59.33 -24.56 28.21 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.538 0 C-N-CA 119.323 -0.951 . . . . 0.0 109.256 -179.41 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.456 ' O ' ' N ' ' A' ' 20' ' ' ALA . 10.4 mt -70.94 -72.19 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.171 -0.956 . . . . 0.0 109.669 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -46.55 -28.3 1.38 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.249 -0.907 . . . . 0.0 109.139 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.69 1.98 32.55 Favored 'General case' 0 N--CA 1.504 2.234 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 179.082 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.573 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -57.08 -47.5 80.86 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.897 -1.127 . . . . 0.0 108.011 179.273 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.484 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 0.5 OUTLIER 67.13 -13.51 0.2 Allowed 'General case' 0 C--N 1.297 -1.711 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.728 179.659 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.649 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -146.17 146.41 30.82 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 120.842 -1.161 . . . . 0.0 110.029 179.043 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -58.62 -24.11 60.36 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.863 -0.523 . . . . 0.0 110.966 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.3 -51.29 64.21 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.0 -1.063 . . . . 0.0 110.017 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.519 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 7.0 mt-30 -69.33 -18.31 63.8 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.194 -0.941 . . . . 0.0 110.473 -179.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.552 HG12 ' HB2' ' A' ' 79' ' ' ALA . 61.6 t -71.17 -49.04 51.32 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 120.887 -1.133 . . . . 0.0 108.337 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.491 ' HG2' HD22 ' A' ' 80' ' ' ASN . 8.4 mtpt -56.53 -55.26 35.99 Favored 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 106.754 -1.573 . . . . 0.0 106.754 179.024 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -51.13 -40.12 57.78 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 114.675 -1.148 . . . . 0.0 109.244 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.02 -63.33 1.08 Allowed 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.387 -0.821 . . . . 0.0 109.402 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.484 HD23 ' SD ' ' A' ' 33' ' ' MET . 86.7 mt -62.95 -24.54 67.93 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.249 -0.907 . . . . 0.0 109.68 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.474 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 53.6 m -61.19 -39.68 91.09 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.942 -1.099 . . . . 0.0 108.344 179.284 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 39.3 mtpt -74.0 -30.68 62.59 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' MET . . . . . 0.484 ' SD ' HD23 ' A' ' 30' ' ' LEU . 34.5 mtp -66.23 -73.15 0.14 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.106 -0.996 . . . . 0.0 109.293 178.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.693 HH21 ' CB ' ' A' ' 73' ' ' ASP . 0.0 OUTLIER -46.04 -26.47 0.74 Allowed 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -179.168 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.402 ' N ' ' C ' ' A' ' 33' ' ' MET . . . -73.42 -63.36 1.21 Allowed 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 119.896 -0.722 . . . . 0.0 109.36 179.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.43 -28.0 69.5 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.073 -1.017 . . . . 0.0 109.426 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.35 -45.51 93.21 Favored 'General case' 0 N--CA 1.487 1.421 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 14.8 mt -65.77 -24.25 66.9 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 179.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -83.15 -47.86 11.16 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 179.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.44 ' O ' ' HB2' ' A' ' 43' ' ' ALA . . . -60.0 -9.78 3.48 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.389 -0.819 . . . . 0.0 109.465 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.478 ' C ' ' NE2' ' A' ' 41' ' ' GLN . 1.3 tm0? -50.76 -57.1 9.17 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 120.683 -1.26 . . . . 0.0 108.017 179.233 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.423 ' HD3' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -74.32 32.2 0.09 Allowed 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.785 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.458 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -77.3 137.91 39.06 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.969 -1.082 . . . . 0.0 109.992 -179.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.63 ' N ' ' CD ' ' A' ' 45' ' ' PRO . 12.4 t -156.91 40.05 0.1 Allowed Pre-proline 0 N--CA 1.489 1.509 0 O-C-N 121.529 -0.732 . . . . 0.0 110.188 179.059 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.63 ' CD ' ' N ' ' A' ' 44' ' ' THR . 6.0 Cg_exo -45.28 -36.01 12.08 Favored 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 122.484 2.123 . . . . 0.0 113.923 178.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.48 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 46.7 Cg_endo -95.06 -12.93 0.79 Allowed 'Trans proline' 0 C--N 1.321 -0.872 0 C-N-CA 122.497 2.131 . . . . 0.0 111.333 -178.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.497 ' O ' ' NZ ' ' A' ' 51' ' ' LYS . 10.7 mtpt 82.89 105.93 0.06 Allowed 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.494 HD21 ' CZ ' ' A' ' 61' ' ' PHE . 1.1 mt -79.59 4.38 16.09 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.361 -0.837 . . . . 0.0 108.971 -179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -98.55 18.79 15.86 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -147.0 42.59 1.13 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.801 -0.562 . . . . 0.0 110.067 -179.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.497 ' NZ ' ' O ' ' A' ' 47' ' ' LYS . 9.9 ptpp? -171.3 -143.07 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 108.636 -0.875 . . . . 0.0 108.636 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 28.5 t -76.74 116.28 55.38 Favored Pre-proline 0 N--CA 1.485 1.295 0 O-C-N 120.658 -1.276 . . . . 0.0 109.431 179.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -85.76 -12.35 6.34 Favored 'Trans proline' 0 N--CA 1.492 1.402 0 C-N-CA 122.359 2.039 . . . . 0.0 111.471 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.427 ' OD1' ' N ' ' A' ' 54' ' ' ASP . 1.2 m-20 65.89 -126.73 0.29 Allowed 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 -178.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.704 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 0.7 OUTLIER -170.43 -37.44 0.0 OUTLIER Pre-proline 0 N--CA 1.488 1.442 0 O-C-N 120.614 -1.304 . . . . 0.0 111.972 -179.904 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.704 ' CD ' ' H ' ' A' ' 55' ' ' SER . 86.8 Cg_exo -54.02 48.56 0.03 OUTLIER 'Trans proline' 0 N--CA 1.504 2.118 0 C-N-CA 122.756 2.304 . . . . 0.0 113.606 -179.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.652 ' N ' ' O ' ' A' ' 55' ' ' SER . 1.2 mp0 45.58 29.71 0.67 Allowed 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 -179.15 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.447 ' O ' ' N ' ' A' ' 61' ' ' PHE . 7.6 mtm 63.73 -6.59 0.23 Allowed 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -178.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.567 ' H ' ' C ' ' A' ' 57' ' ' GLU . 0.0 OUTLIER -48.37 -39.23 21.57 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 122.065 0.936 . . . . 0.0 108.921 178.929 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.42 -21.32 64.01 Favored 'General case' 0 C--N 1.289 -2.05 0 O-C-N 121.365 -0.834 . . . . 0.0 108.868 -179.318 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.494 ' CZ ' HD21 ' A' ' 48' ' ' LEU . 3.0 t80 -74.94 -54.35 7.37 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.296 -0.877 . . . . 0.0 109.632 179.031 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.452 ' CD ' ' H ' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -65.4 -33.82 76.85 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.994 -1.066 . . . . 0.0 108.791 179.838 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.427 ' O ' ' N ' ' A' ' 67' ' ' ILE . 1.9 t60 -58.15 -38.91 77.52 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.83 -31.84 82.26 Favored Glycine 0 N--CA 1.483 1.823 0 N-CA-C 108.309 -1.917 . . . . 0.0 108.309 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 -82.39 -39.27 22.94 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.316 -1.108 . . . . 0.0 108.145 178.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -70.45 -47.04 62.58 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 178.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.427 ' N ' ' O ' ' A' ' 63' ' ' HIS . 4.7 mm -55.38 -42.57 67.77 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.357 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 178.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 11.7 tp -57.39 -46.23 83.67 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 179.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.449 HG13 ' CG ' ' A' ' 34' ' ' ARG . 37.7 t -59.99 -12.91 4.59 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.472 0 O-C-N 121.098 -1.001 . . . . 0.0 108.659 179.176 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -77.4 -44.03 14.26 Favored Glycine 0 N--CA 1.487 2.067 0 C-N-CA 119.812 -1.185 . . . . 0.0 110.597 -179.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.448 ' C ' ' CD ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -76.48 -37.81 56.26 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.889 -1.359 . . . . 0.0 107.555 179.528 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 51.9 mt -68.05 -29.48 44.83 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 N-CA-C 107.015 -1.476 . . . . 0.0 107.015 177.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.693 ' CB ' HH21 ' A' ' 34' ' ' ARG . 0.0 OUTLIER -63.17 -51.65 65.56 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.441 -0.787 . . . . 0.0 109.527 179.777 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -64.18 -32.01 73.43 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.106 -0.996 . . . . 0.0 109.787 -179.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.1 -37.76 64.05 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 120.741 -1.224 . . . . 0.0 108.814 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.95 -27.98 47.77 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 178.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.2 tptt -69.66 -47.23 64.05 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-O 121.667 0.746 . . . . 0.0 109.198 178.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.1 mp -58.69 -32.03 68.77 Favored 'General case' 0 C--N 1.306 -1.294 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.552 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -65.46 -52.83 50.24 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.491 HD22 ' HG2' ' A' ' 27' ' ' LYS . 2.0 t-20 . . . . . 0 N--CA 1.488 1.426 0 O-C-N 121.54 -0.725 . . . . 0.0 . -178.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.214 -0.78 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 98.27 15.22 36.18 Favored Glycine 0 N--CA 1.499 2.896 0 O-C-N 121.189 -0.944 . . . . 0.0 110.796 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 33.9 mmtt -98.57 84.21 3.13 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.071 -1.252 . . . . 0.0 108.675 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 53.6 t -75.33 -63.9 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 -179.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.527 ' HD3' ' H ' ' A' ' 85' ' ' LYS . 0.8 OUTLIER -47.88 -37.31 13.81 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.499 -0.75 . . . . 0.0 109.065 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -68.37 -44.18 75.75 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 178.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.52 -47.01 68.08 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.948 0.88 . . . . 0.0 109.046 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.528 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -56.26 -54.14 48.9 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 179.734 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -56.19 -41.58 75.75 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.069 -1.02 . . . . 0.0 108.906 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.576 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -61.25 -35.85 78.37 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 178.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -47.53 -43.69 25.1 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.059 -1.026 . . . . 0.0 108.717 179.123 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -63.1 -26.82 69.0 Favored 'General case' 0 N--CA 1.485 1.313 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 178.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.694 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -72.48 -38.99 68.05 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 106.492 -1.67 . . . . 0.0 106.492 177.615 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.464 HD12 ' N ' ' A' ' 94' ' ' LEU . 11.1 mp -65.74 -40.48 92.16 Favored 'General case' 0 C--N 1.307 -1.264 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 3.9 mtpt -55.06 -38.24 67.77 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 178.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 6.8 m -69.3 -30.74 68.88 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.477 -0.765 . . . . 0.0 108.945 178.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -60.96 -41.92 97.29 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 18.8 mt -51.6 -38.97 22.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -51.2 61.69 Favored 'General case' 0 C--N 1.302 -1.489 0 C-N-CA 119.152 -1.019 . . . . 0.0 109.057 179.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.35 -21.71 66.71 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.034 -1.042 . . . . 0.0 109.067 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.535 ' OH ' ' CE1' ' A' ' 105' ' ' TYR . 10.5 t80 -72.92 -32.89 65.61 Favored 'General case' 0 C--N 1.298 -1.674 0 N-CA-C 107.327 -1.361 . . . . 0.0 107.327 179.168 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.533 ' ND2' ' O ' ' A' ' 102' ' ' ASN . 0.3 OUTLIER -64.1 -30.48 71.55 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 178.327 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.633 ' NE2' ' N ' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -65.43 -27.21 68.37 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 104.95 -2.241 . . . . 0.0 104.95 177.931 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.633 ' N ' ' NE2' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -79.34 -47.25 16.12 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 105.414 -2.069 . . . . 0.0 105.414 176.489 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.535 ' CE1' ' OH ' ' A' ' 101' ' ' TYR . 0.6 OUTLIER -86.2 30.86 0.66 Allowed 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 177.191 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.495 2.578 0 CA-C-O 117.964 -1.465 . . . . 0.0 109.517 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.489 0.662 . . . . 0.0 109.673 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 25.5 mt -88.5 -49.53 6.85 Favored 'General case' 0 C--N 1.296 -1.724 0 O-C-N 121.489 -0.757 . . . . 0.0 109.085 -179.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -62.83 -23.48 67.3 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 106.56 -1.644 . . . . 0.0 106.56 178.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.73 -53.22 9.64 Favored 'General case' 0 C--N 1.299 -1.622 0 C-N-CA 119.778 -0.769 . . . . 0.0 109.295 -179.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.597 HD22 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -53.71 -44.15 69.6 Favored 'General case' 0 N--CA 1.485 1.324 0 O-C-N 121.243 -0.911 . . . . 0.0 108.673 -179.306 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.597 ' N ' HD22 ' A' ' 6' ' ' ASN . 7.6 m95 -50.06 -54.43 20.35 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.103 -0.998 . . . . 0.0 109.241 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -53.7 -25.57 18.95 Favored 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.237 -0.914 . . . . 0.0 109.308 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.2 m -68.37 -65.06 0.75 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.073 -1.017 . . . . 0.0 110.059 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.652 ' H ' HD23 ' A' ' 10' ' ' LEU . 0.1 OUTLIER -60.27 -31.25 70.05 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 118.436 -1.305 . . . . 0.0 107.546 179.763 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -69.29 -55.19 11.21 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.982 -1.074 . . . . 0.0 108.487 178.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.428 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 42.7 t0 -61.01 -14.81 25.68 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.457 -0.777 . . . . 0.0 110.092 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.411 ' ND2' ' HG2' ' A' ' 33' ' ' MET . 3.9 m-20 -72.85 -47.62 44.61 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 178.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.677 HD13 ' HZ3' ' A' ' 95' ' ' LYS . 3.8 mt -57.07 -33.19 67.01 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.738 -178.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 6.4 ttpp -68.32 -42.86 78.74 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 118.862 -1.135 . . . . 0.0 108.563 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.556 ' O ' ' N ' ' A' ' 20' ' ' ALA . 57.3 t -57.87 -24.47 23.27 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 O-C-N 121.304 -0.873 . . . . 0.0 109.379 -179.502 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.489 ' O ' ' N ' ' A' ' 20' ' ' ALA . 12.1 mt -71.31 -72.99 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 121.165 -0.96 . . . . 0.0 110.318 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -46.72 -27.63 1.25 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.941 -1.099 . . . . 0.0 108.985 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -102.52 0.97 34.4 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 179.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.556 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -58.23 -39.36 78.86 Favored 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 178.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.5 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 9.3 m-20 59.13 -11.0 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.059 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.62 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -147.86 143.28 27.32 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.549 -1.345 . . . . 0.0 110.11 178.949 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.51 -20.58 32.35 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.779 -0.576 . . . . 0.0 111.488 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.08 -50.55 61.32 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.718 -1.239 . . . . 0.0 109.72 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.426 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 4.2 mt-30 -70.22 -19.46 63.15 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.336 -0.853 . . . . 0.0 110.597 -179.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.5 HG12 ' HB2' ' A' ' 79' ' ' ALA . 48.7 t -70.26 -47.27 67.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 120.883 -1.136 . . . . 0.0 108.606 -179.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.467 ' HG2' HD22 ' A' ' 80' ' ' ASN . 8.2 mtpt -55.5 -55.66 29.3 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 106.407 -1.701 . . . . 0.0 106.407 178.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -52.99 -34.08 54.51 Favored 'General case' 0 C--N 1.298 -1.664 0 CA-C-N 114.447 -1.251 . . . . 0.0 109.758 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.61 -65.83 0.65 Allowed 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.26 -0.9 . . . . 0.0 109.54 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.736 HD23 ' SD ' ' A' ' 33' ' ' MET . 53.9 mt -61.9 -18.65 60.96 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.318 -0.864 . . . . 0.0 109.972 -179.467 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.4 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 42.8 m -62.65 -51.31 67.74 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.055 -1.028 . . . . 0.0 109.259 179.453 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -69.74 -24.73 63.58 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.663 -0.648 . . . . 0.0 109.307 -179.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' MET . . . . . 0.736 ' SD ' HD23 ' A' ' 30' ' ' LEU . 69.1 mtp -66.43 -61.82 1.79 Allowed 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 178.389 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.54 ' HE ' HG12 ' A' ' 69' ' ' VAL . 0.1 OUTLIER -47.67 -27.94 2.16 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 179.622 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.86 -66.18 0.82 Allowed 'General case' 0 N--CA 1.488 1.452 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.93 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.71 -30.33 71.34 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.898 -1.126 . . . . 0.0 110.033 -179.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.45 -43.19 93.22 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.052 -1.03 . . . . 0.0 108.502 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 28.3 mt -66.33 -22.12 66.27 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.321 -0.862 . . . . 0.0 108.758 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -83.47 -45.09 14.02 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.216 -0.927 . . . . 0.0 109.739 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.502 ' O ' ' HB3' ' A' ' 43' ' ' ALA . . . -55.2 -22.54 18.02 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.154 -0.966 . . . . 0.0 108.987 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -48.28 -51.34 26.24 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.312 -0.868 . . . . 0.0 109.937 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.502 ' HD3' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -68.89 4.0 1.71 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.166 -0.959 . . . . 0.0 109.628 -179.575 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.502 ' HB3' ' O ' ' A' ' 40' ' ' ALA . . . -82.43 149.42 27.64 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.013 -1.054 . . . . 0.0 110.234 -179.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 p -151.34 69.61 8.16 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.358 -0.839 . . . . 0.0 108.778 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.444 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 50.1 Cg_exo -45.77 -38.99 18.25 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 C-N-CA 122.647 2.232 . . . . 0.0 114.272 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.444 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 88.6 Cg_endo -98.68 -94.33 0.0 OUTLIER 'Trans proline' 0 C--N 1.318 -1.047 0 C-N-CA 122.447 2.098 . . . . 0.0 112.732 -178.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.57 117.26 0.42 Allowed 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 -179.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.547 ' O ' HD23 ' A' ' 48' ' ' LEU . 1.1 tt -81.77 0.91 37.0 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 120.953 -1.092 . . . . 0.0 108.721 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 66.5 mt-10 -99.07 30.59 3.36 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 177.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -147.65 -53.72 0.21 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.65 -0.656 . . . . 0.0 110.496 -178.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -65.23 -161.03 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.071 -1.018 . . . . 0.0 109.388 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 28.1 t -73.95 120.99 84.08 Favored Pre-proline 0 N--CA 1.488 1.457 0 O-C-N 120.804 -1.185 . . . . 0.0 109.352 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -83.32 -22.92 3.72 Favored 'Trans proline' 0 N--CA 1.494 1.507 0 C-N-CA 122.201 1.934 . . . . 0.0 111.899 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.8 t0 64.63 -137.72 0.26 Allowed 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.691 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 0.2 OUTLIER -161.83 -38.92 0.0 OUTLIER Pre-proline 0 N--CA 1.495 1.806 0 O-C-N 120.339 -1.476 . . . . 0.0 112.158 -179.383 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.691 ' CD ' ' H ' ' A' ' 55' ' ' SER . 67.0 Cg_exo -49.21 70.32 0.01 OUTLIER 'Trans proline' 0 N--CA 1.503 2.085 0 C-N-CA 122.7 2.267 . . . . 0.0 114.374 -178.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.571 ' N ' ' O ' ' A' ' 55' ' ' SER . 91.4 mt-10 39.47 32.22 0.08 Allowed 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.678 -0.639 . . . . 0.0 109.308 179.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.47 ' SD ' ' C ' ' A' ' 57' ' ' GLU . 0.9 OUTLIER 64.73 -8.7 0.21 Allowed 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 -178.46 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.572 ' N ' ' O ' ' A' ' 56' ' ' PRO . 0.6 OUTLIER -48.26 -45.56 34.65 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-O 121.916 0.865 . . . . 0.0 108.93 178.962 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.12 -28.9 27.93 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -179.457 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -74.3 -54.37 7.8 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 177.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.38 -29.06 68.69 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.494 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.624 ' NE2' HD11 ' A' ' 67' ' ' ILE . 2.1 t60 -62.68 -36.75 83.93 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 178.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -63.8 -28.23 72.34 Favored Glycine 0 N--CA 1.487 2.085 0 N-CA-C 107.794 -2.122 . . . . 0.0 107.794 178.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.428 ' O ' HG23 ' A' ' 69' ' ' VAL . 26.8 m-85 -81.86 -41.03 21.58 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 177.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -73.14 -45.99 53.55 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.624 HD11 ' NE2' ' A' ' 63' ' ' HIS . 19.7 mm -56.69 -48.57 80.59 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.414 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.704 HD13 ' C ' ' A' ' 68' ' ' LEU . 2.3 tm? -58.01 -45.04 87.52 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 179.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.54 HG12 ' HE ' ' A' ' 34' ' ' ARG . 26.3 t -60.94 -11.4 4.15 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 179.031 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -76.16 -42.05 25.03 Favored Glycine 0 N--CA 1.487 2.065 0 N-CA-C 109.347 -1.501 . . . . 0.0 109.347 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.504 ' O ' ' NE2' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -67.61 -29.69 69.09 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 178.63 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.57 HG23 HD22 ' A' ' 30' ' ' LEU . 46.8 mt -75.91 -32.9 24.28 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.454 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 176.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -59.35 -54.39 47.3 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 121.593 0.711 . . . . 0.0 109.423 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -63.97 -28.81 70.07 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.292 -0.88 . . . . 0.0 109.29 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.65 -32.97 66.27 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 120.807 -1.183 . . . . 0.0 108.355 179.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.77 -32.95 63.9 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 178.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.9 tptt -66.39 -45.51 79.76 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 mp -58.3 -31.72 67.78 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.5 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -64.91 -51.33 62.48 Favored 'General case' 0 C--N 1.3 -1.545 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 177.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.467 HD22 ' HG2' ' A' ' 27' ' ' LYS . 1.9 t-20 -73.33 -11.95 60.67 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.475 -0.766 . . . . 0.0 111.16 -179.055 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -93.79 -11.04 32.18 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 120.719 -1.238 . . . . 0.0 109.556 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.93 11.3 53.55 Favored Glycine 0 N--CA 1.498 2.769 0 N-CA-C 110.654 -0.978 . . . . 0.0 110.654 179.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 39.7 mmtt -94.65 82.13 3.92 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.952 -1.322 . . . . 0.0 108.842 179.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 43.5 t -77.38 -51.22 18.84 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.676 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 -179.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.0 mtmp? -54.15 -39.61 66.67 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.065 -1.022 . . . . 0.0 108.542 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -69.75 -40.97 75.82 Favored 'General case' 0 N--CA 1.486 1.33 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 178.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.66 -51.32 57.48 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 119.528 -0.869 . . . . 0.0 109.114 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.547 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -60.08 -46.37 89.81 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 179.383 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -55.11 -34.29 63.57 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 120.957 -1.089 . . . . 0.0 108.109 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.402 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -65.97 -28.71 69.1 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 107.216 -1.402 . . . . 0.0 107.216 178.118 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.547 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -50.52 -48.67 57.0 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 178.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.492 ' OE1' ' N ' ' A' ' 92' ' ' GLU . 14.1 mp0 -67.15 -22.1 65.79 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.292 -0.88 . . . . 0.0 109.34 178.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.703 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -71.04 -35.27 71.91 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 105.508 -2.034 . . . . 0.0 105.508 177.164 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.509 HD22 HD21 ' A' ' 14' ' ' LEU . 7.2 mp -70.94 -39.92 72.35 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 178.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' LYS . . . . . 0.677 ' HZ3' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -45.54 -40.45 8.67 Favored 'General case' 0 N--CA 1.498 1.973 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 178.766 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 53.4 m -72.72 -31.32 64.89 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.707 -0.621 . . . . 0.0 109.987 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.467 ' N ' ' O ' ' A' ' 94' ' ' LEU . 1.2 m -56.85 -43.63 81.36 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 49.8 mt -54.79 -46.36 74.68 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.498 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 51.7 ttt180 -62.28 -55.0 32.65 Favored 'General case' 0 C--N 1.308 -1.21 0 O-C-N 121.184 -0.947 . . . . 0.0 110.229 -179.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.54 -28.08 69.07 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.79 -1.194 . . . . 0.0 108.698 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.458 ' CD1' ' C ' ' A' ' 101' ' ' TYR . 3.4 t80 -70.86 -30.49 66.9 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 178.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.54 ' ND2' ' O ' ' A' ' 102' ' ' ASN . 0.1 OUTLIER -64.34 -32.0 73.43 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 119.013 -1.075 . . . . 0.0 108.536 179.416 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.511 ' NE2' ' N ' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -63.99 -26.0 68.38 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 105.105 -2.183 . . . . 0.0 105.105 177.854 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.511 ' N ' ' NE2' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -84.0 -32.46 24.94 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.123 -0.944 . . . . 0.0 108.663 178.012 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.54 ' CD1' ' C ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -95.11 0.82 54.66 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.108 -0.995 . . . . 0.0 109.173 -179.266 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.51 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.494 2.509 0 CA-C-O 117.927 -1.485 . . . . 0.0 109.742 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 . . . . . 0 N--CA 1.489 1.52 0 CA-C-O 121.743 0.782 . . . . 0.0 109.177 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 70.2 mt -87.57 -52.5 5.31 Favored 'General case' 0 C--N 1.296 -1.743 0 O-C-N 121.656 -0.653 . . . . 0.0 109.392 -178.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -62.98 -23.72 67.57 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 179.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.52 -51.87 18.11 Favored 'General case' 0 C--N 1.297 -1.709 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.635 ' OD1' ' HB2' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -50.61 -40.9 54.08 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 -179.872 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.545 ' N ' HD22 ' A' ' 6' ' ' ASN . 7.0 m95 -51.94 -52.46 50.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.198 -0.939 . . . . 0.0 108.865 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -55.98 -28.58 57.73 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 120.719 -1.238 . . . . 0.0 108.919 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 10.4 m -69.52 -64.67 0.83 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.168 -0.958 . . . . 0.0 109.986 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.6 pp -57.02 -30.8 64.51 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.65 -1.282 . . . . 0.0 107.922 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.28 -55.32 8.28 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.912 -1.118 . . . . 0.0 108.349 178.144 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -58.57 -14.15 7.43 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.501 -0.749 . . . . 0.0 109.551 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.496 ' O ' HG22 ' A' ' 16' ' ' VAL . 1.6 m-20 -73.12 -50.11 24.62 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 179.34 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.3 mt -56.86 -30.01 63.43 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.829 -0.544 . . . . 0.0 111.087 -178.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -69.11 -51.39 39.05 Favored 'General case' 0 C--N 1.3 -1.581 0 C-N-CA 118.539 -1.264 . . . . 0.0 109.727 -179.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.624 ' O ' ' N ' ' A' ' 20' ' ' ALA . 15.4 m -55.74 -20.92 9.22 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 C-N-CA 118.458 -1.297 . . . . 0.0 110.105 -179.35 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.445 ' O ' ' N ' ' A' ' 20' ' ' ALA . 11.5 mt -70.16 -73.51 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 O-C-N 120.442 -1.412 . . . . 0.0 108.947 179.085 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -46.94 -28.66 1.69 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.311 -0.868 . . . . 0.0 109.007 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.37 1.46 35.5 Favored 'General case' 0 N--CA 1.496 1.867 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.624 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -56.9 -44.11 82.02 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 107.453 -1.314 . . . . 0.0 107.453 179.473 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.48 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 0.4 OUTLIER 67.76 -15.02 0.2 Allowed 'General case' 0 C--N 1.297 -1.678 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.949 179.437 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.647 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -148.21 142.79 26.51 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.653 -1.279 . . . . 0.0 110.051 178.576 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.86 -21.22 10.71 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.987 -0.446 . . . . 0.0 111.463 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.34 -52.13 55.94 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.857 -1.152 . . . . 0.0 109.601 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.501 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 5.4 mt-30 -69.76 -18.31 63.49 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.281 -0.887 . . . . 0.0 110.425 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.524 HG12 ' HB2' ' A' ' 79' ' ' ALA . 57.6 t -70.02 -48.95 59.87 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 O-C-N 120.925 -1.109 . . . . 0.0 108.388 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.474 ' HG2' HD22 ' A' ' 80' ' ' ASN . 7.0 mtpt -56.27 -55.12 37.27 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 178.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -50.78 -37.46 42.5 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-N 114.711 -1.132 . . . . 0.0 109.45 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.73 -68.71 0.39 Allowed 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.335 -0.853 . . . . 0.0 110.042 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 95.9 mt -60.28 -20.87 60.87 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.379 -0.826 . . . . 0.0 109.696 -179.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.463 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 7.8 m -62.42 -45.64 92.2 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.096 -1.002 . . . . 0.0 108.523 179.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 40.9 mtmt -72.81 -27.16 61.8 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.764 -0.585 . . . . 0.0 109.475 -179.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 29.5 mtp -63.98 -67.93 0.39 Allowed 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 178.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 15.8 ttt-85 -47.11 -26.4 1.09 Allowed 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.67 -57.9 3.61 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 120.009 -0.676 . . . . 0.0 109.344 178.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.25 -39.93 95.99 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.111 -0.993 . . . . 0.0 110.078 -179.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.92 -39.02 71.04 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.019 -1.051 . . . . 0.0 108.891 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 26.5 mt -66.01 -33.78 76.58 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.23 -0.919 . . . . 0.0 108.937 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -86.33 -41.94 14.12 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.096 -1.003 . . . . 0.0 109.549 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.635 ' HB2' ' OD1' ' A' ' 6' ' ' ASN . . . -58.84 -14.53 9.16 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.318 -0.864 . . . . 0.0 109.761 -179.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.45 ' C ' ' H ' ' A' ' 43' ' ' ALA . 2.2 tm0? -48.49 -51.57 26.57 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 120.963 -1.086 . . . . 0.0 109.692 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.465 ' HD3' ' H ' ' A' ' 42' ' ' LYS . 2.1 mppt? -71.0 14.24 0.16 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.345 -0.847 . . . . 0.0 109.706 -179.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.45 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -78.04 151.27 33.58 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.887 -1.133 . . . . 0.0 108.719 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -152.31 69.18 7.38 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.171 -0.956 . . . . 0.0 109.564 -179.392 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.442 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 33.3 Cg_exo -49.31 -40.05 43.54 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.586 2.191 . . . . 0.0 113.878 178.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.442 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 69.7 Cg_endo -95.98 -14.58 0.51 Allowed 'Trans proline' 0 N--CA 1.483 0.862 0 C-N-CA 122.467 2.111 . . . . 0.0 112.635 -178.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 43.3 mttm 71.83 101.69 0.07 Allowed 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.8 mp -84.33 22.98 1.15 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.122 -0.986 . . . . 0.0 108.791 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -107.04 26.41 10.17 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 107.416 -1.327 . . . . 0.0 107.416 178.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -144.26 -59.5 0.38 Allowed 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 -179.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -65.99 -162.96 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.585 0 O-C-N 121.325 -0.859 . . . . 0.0 108.888 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.3 t -75.11 145.12 80.14 Favored Pre-proline 0 N--CA 1.485 1.313 0 O-C-N 120.722 -1.236 . . . . 0.0 109.029 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.448 ' O ' ' CB ' ' A' ' 54' ' ' ASP . 43.4 Cg_endo -80.78 -14.57 11.19 Favored 'Trans proline' 0 N--CA 1.499 1.835 0 C-N-CA 122.719 2.28 . . . . 0.0 112.309 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.448 ' CB ' ' O ' ' A' ' 53' ' ' PRO . 10.3 t0 76.27 -143.99 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.825 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 40.4 t -162.36 -26.62 0.0 OUTLIER Pre-proline 0 N--CA 1.495 1.817 0 O-C-N 120.379 -1.451 . . . . 0.0 113.801 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.825 ' CD ' ' H ' ' A' ' 55' ' ' SER . 73.2 Cg_exo -56.43 40.91 0.04 OUTLIER 'Trans proline' 0 N--CA 1.503 2.043 0 C-N-CA 121.981 1.788 . . . . 0.0 113.021 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.648 ' N ' ' O ' ' A' ' 55' ' ' SER . 7.1 tp10 49.87 25.56 1.64 Allowed 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 -178.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.51 ' O ' ' N ' ' A' ' 61' ' ' PHE . 2.1 mtp 63.95 -5.08 0.32 Allowed 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 -177.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.566 ' H ' ' C ' ' A' ' 57' ' ' GLU . 0.5 OUTLIER -46.59 -50.37 17.52 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.346 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -54.03 -24.91 18.77 Favored 'General case' 0 C--N 1.297 -1.693 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.51 ' N ' ' O ' ' A' ' 58' ' ' MET . 3.8 t80 -77.25 -54.18 6.8 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 107.134 -1.432 . . . . 0.0 107.134 177.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.8 mtt-85 -62.54 -31.02 71.74 Favored 'General case' 0 N--CA 1.489 1.512 0 CA-C-O 121.328 0.585 . . . . 0.0 109.474 178.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.425 ' N ' ' O ' ' A' ' 59' ' ' LYS . 1.6 t60 -59.6 -40.89 88.99 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.67 -31.32 80.51 Favored Glycine 0 C--N 1.296 -1.649 0 N-CA-C 108.702 -1.759 . . . . 0.0 108.702 179.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -81.07 -41.46 22.55 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.055 -1.262 . . . . 0.0 108.062 178.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -71.26 -46.19 61.51 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 5.3 mm -55.78 -44.72 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 179.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 5.4 tp -58.04 -52.94 63.44 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.598 -0.689 . . . . 0.0 109.756 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 46.0 t -61.08 -15.76 12.9 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 O-C-N 121.281 -0.887 . . . . 0.0 110.692 -178.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -78.19 -43.79 12.72 Favored Glycine 0 N--CA 1.49 2.236 0 C-N-CA 119.25 -1.453 . . . . 0.0 110.382 -178.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.551 ' C ' HE21 ' A' ' 71' ' ' GLN . 0.0 OUTLIER -70.77 -30.8 67.38 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 120.681 -1.482 . . . . 0.0 107.429 179.47 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 27.9 mt -75.42 -30.11 21.94 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.558 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -59.87 -53.18 60.95 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 119.47 -0.892 . . . . 0.0 109.03 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.445 ' OD1' ' O ' ' A' ' 71' ' ' GLN . 0.4 OUTLIER -66.31 -32.53 73.99 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.071 -1.018 . . . . 0.0 109.297 179.909 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.44 -27.12 64.0 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 120.709 -1.245 . . . . 0.0 107.916 179.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.95 -34.15 67.75 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 105.797 -1.927 . . . . 0.0 105.797 177.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 9.2 tptt -69.73 -49.04 57.0 Favored 'General case' 0 C--N 1.305 -1.333 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.596 179.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 8.5 mp -55.1 -37.18 66.52 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.524 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -62.55 -50.29 71.9 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.313 -0.867 . . . . 0.0 108.902 178.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.474 HD22 ' HG2' ' A' ' 27' ' ' LYS . 1.9 t-20 -73.23 -12.37 60.84 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.504 -0.747 . . . . 0.0 111.389 -178.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -94.16 -9.57 35.96 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 120.672 -1.268 . . . . 0.0 109.58 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.67 11.29 54.0 Favored Glycine 0 N--CA 1.497 2.751 0 O-C-N 121.131 -0.981 . . . . 0.0 110.662 178.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 5.7 mmtp -94.21 83.26 4.22 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.921 -1.341 . . . . 0.0 108.464 179.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 57.9 t -77.55 -54.0 13.46 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.773 0 O-C-N 121.786 -0.571 . . . . 0.0 109.653 -179.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.479 ' HD3' ' H ' ' A' ' 85' ' ' LYS . 0.6 OUTLIER -53.42 -39.7 64.56 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 120.954 -1.092 . . . . 0.0 108.604 179.329 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -67.25 -42.33 84.13 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 178.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.412 ' O ' ' HB3' ' A' ' 90' ' ' ALA . . . -67.05 -51.87 49.23 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 119.564 -0.854 . . . . 0.0 109.1 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.522 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -59.95 -48.29 82.32 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 179.585 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -55.87 -33.42 64.56 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.412 ' HB3' ' O ' ' A' ' 87' ' ' ALA . . . -67.04 -27.58 67.51 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 178.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.522 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -53.06 -50.78 63.64 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 179.059 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -63.42 -24.65 67.93 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 178.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.683 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -75.23 -36.16 61.35 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 177.859 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.431 ' CD1' ' OE1' ' A' ' 71' ' ' GLN . 4.1 mp -64.78 -49.15 71.86 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 178.646 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -50.32 -42.92 53.49 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 24.4 m -71.32 -35.27 71.17 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.165 -0.96 . . . . 0.0 109.125 179.005 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.2 m -60.79 -44.89 96.24 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 179.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 86.2 mt -51.26 -37.89 18.77 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.374 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.2 tpm_? -56.27 -54.49 44.69 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-O 121.907 0.86 . . . . 0.0 109.571 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.491 ' O ' ' N ' ' A' ' 103' ' ' GLN . . . -63.37 -53.89 45.43 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 120.434 -1.416 . . . . 0.0 108.184 179.222 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.491 ' O ' ' CG ' ' A' ' 104' ' ' LYS . 0.6 OUTLIER -53.33 -21.75 6.16 Favored 'General case' 0 C--N 1.297 -1.688 0 O-C-N 120.697 -1.252 . . . . 0.0 107.724 179.366 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.543 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -65.85 -28.25 68.83 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 176.917 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.499 HE21 ' N ' ' A' ' 104' ' ' LYS . 1.4 pp0? -61.83 -18.93 61.84 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 105.358 -2.09 . . . . 0.0 105.358 178.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.499 ' N ' HE21 ' A' ' 103' ' ' GLN . 0.0 OUTLIER -79.63 -28.12 40.93 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 177.476 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.485 ' O ' ' CG ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -101.96 3.5 39.04 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 107.756 -1.201 . . . . 0.0 107.756 178.544 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.488 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.491 2.351 0 N-CA-C 109.312 -1.515 . . . . 0.0 109.312 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 . . . . . 0 N--CA 1.492 1.673 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 48.9 mt -89.57 -49.12 6.85 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -62.64 -22.29 66.33 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 178.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -72.99 -49.54 28.4 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.641 HD22 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -50.13 -44.17 52.2 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.207 -0.933 . . . . 0.0 108.683 -179.73 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.641 ' N ' HD22 ' A' ' 6' ' ' ASN . 16.2 m95 -54.7 -49.21 71.27 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.187 -0.946 . . . . 0.0 109.367 -179.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -55.41 -29.49 58.65 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 120.875 -1.14 . . . . 0.0 109.083 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 35.4 m -69.39 -65.46 0.71 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 119.289 -0.965 . . . . 0.0 109.789 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.1 pp -58.55 -28.86 65.88 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.776 -1.202 . . . . 0.0 108.566 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -71.74 -59.7 2.61 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.932 -1.105 . . . . 0.0 109.268 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -57.25 -13.77 3.58 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.45 -0.781 . . . . 0.0 109.378 -179.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -74.25 -54.27 8.04 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 13.4 mt -55.53 -27.55 49.48 Favored 'General case' 0 N--CA 1.49 1.548 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.574 -178.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 9.0 ttpp -70.16 -46.64 64.24 Favored 'General case' 0 C--N 1.298 -1.672 0 C-N-CA 118.919 -1.112 . . . . 0.0 108.569 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.523 ' O ' ' N ' ' A' ' 20' ' ' ALA . 71.9 t -55.84 -26.69 21.06 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.579 0 O-C-N 121.415 -0.803 . . . . 0.0 109.944 -179.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.526 ' O ' ' N ' ' A' ' 20' ' ' ALA . 7.1 mt -71.23 -71.25 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 O-C-N 121.053 -1.03 . . . . 0.0 110.468 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -46.75 -28.78 1.63 Allowed 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.931 -1.106 . . . . 0.0 108.789 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.43 ' O ' ' OD2' ' A' ' 21' ' ' ASP . 1.0 OUTLIER -99.96 -1.47 37.07 Favored 'General case' 0 N--CA 1.498 1.928 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 179.522 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.57 ' O ' ' NE2' ' A' ' 25' ' ' GLN . . . -58.26 -59.93 4.55 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.893 -1.129 . . . . 0.0 108.299 178.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.43 ' OD2' ' O ' ' A' ' 19' ' ' LYS . 1.4 m-20 69.55 -7.62 0.85 Allowed 'General case' 0 C--N 1.295 -1.765 0 O-C-N 121.75 -0.594 . . . . 0.0 110.566 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.57 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -142.96 143.05 31.8 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 120.724 -1.235 . . . . 0.0 109.569 178.048 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.94 -27.78 46.08 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.714 -0.616 . . . . 0.0 111.101 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.2 -51.61 62.9 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.029 -1.044 . . . . 0.0 110.887 -178.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.57 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 9.4 mt-30 -68.37 -24.07 64.75 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 120.955 -1.091 . . . . 0.0 110.884 -178.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.572 HG12 ' HB2' ' A' ' 79' ' ' ALA . 49.1 t -70.78 -47.74 61.58 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.036 0 O-C-N 120.693 -1.254 . . . . 0.0 108.99 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.458 ' HG2' HD22 ' A' ' 80' ' ' ASN . 12.7 mtpt -54.91 -55.11 34.11 Favored 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 106.376 -1.712 . . . . 0.0 106.376 179.048 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.474 ' N ' ' OD1' ' A' ' 28' ' ' ASP . 2.6 m-20 -52.14 -37.99 56.13 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-N 114.33 -1.305 . . . . 0.0 109.574 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.81 -64.09 0.95 Allowed 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.357 -0.839 . . . . 0.0 110.333 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.406 ' HB3' HD12 ' A' ' 76' ' ' LEU . 90.0 mt -60.15 -23.37 63.87 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.165 -0.959 . . . . 0.0 109.955 -179.204 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 48.1 m -61.86 -46.11 90.87 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.036 -1.04 . . . . 0.0 108.93 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.481 ' O ' ' HB3' ' A' ' 35' ' ' ALA . 50.5 mttm -72.26 -28.71 63.3 Favored 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.809 -0.557 . . . . 0.0 109.623 -179.353 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' MET . . . . . 0.416 ' C ' ' N ' ' A' ' 35' ' ' ALA . 48.6 mtp -65.36 -63.46 1.09 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.808 -1.183 . . . . 0.0 108.557 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.8 ttt-85 -50.06 -22.92 1.8 Allowed 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 32' ' ' LYS . . . -75.11 -58.7 3.12 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.414 ' O ' ' N ' ' A' ' 40' ' ' ALA . . . -62.89 -31.0 71.96 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.169 -0.957 . . . . 0.0 109.64 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.83 -44.12 90.85 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.165 -0.959 . . . . 0.0 108.82 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 17.2 mt -64.79 -32.24 73.83 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.366 -0.834 . . . . 0.0 109.227 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -84.69 -23.87 29.21 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.125 -0.984 . . . . 0.0 109.138 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.525 ' O ' ' HB3' ' A' ' 43' ' ' ALA . . . -61.8 -34.01 75.14 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.428 -0.795 . . . . 0.0 110.348 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.501 ' C ' ' H ' ' A' ' 43' ' ' ALA . 0.8 OUTLIER -40.33 -63.06 0.67 Allowed 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.33 -0.856 . . . . 0.0 110.077 -179.885 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 67.7 mmtt -57.62 1.05 0.04 OUTLIER 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.523 -0.736 . . . . 0.0 110.459 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' A' ' 40' ' ' ALA . . . -84.12 145.57 28.35 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.817 -1.177 . . . . 0.0 110.842 -179.151 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 m -159.37 90.22 1.96 Allowed Pre-proline 0 N--CA 1.49 1.544 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.417 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 23.3 Cg_exo -53.57 -43.68 55.63 Favored 'Trans proline' 0 N--CA 1.49 1.297 0 C-N-CA 121.601 1.534 . . . . 0.0 112.367 -179.105 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.417 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 96.6 Cg_endo -84.96 -90.6 0.0 OUTLIER 'Trans proline' 0 C--N 1.317 -1.087 0 C-N-CA 121.372 1.382 . . . . 0.0 110.574 178.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.7 pttt -176.6 122.23 0.15 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.076 -1.015 . . . . 0.0 109.829 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.452 ' C ' ' N ' ' A' ' 50' ' ' ASP . 0.7 OUTLIER -80.34 -174.71 4.73 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 178.575 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 50.74 18.83 0.53 Allowed 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.007 -1.058 . . . . 0.0 108.165 -179.147 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.452 ' N ' ' C ' ' A' ' 48' ' ' LEU . 33.4 m-20 -148.61 -55.0 0.19 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.733 -0.604 . . . . 0.0 110.054 -179.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.7 ptpp? -65.69 -162.59 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.537 0 O-C-N 120.974 -1.079 . . . . 0.0 109.289 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 3.7 m -79.36 115.82 55.93 Favored Pre-proline 0 N--CA 1.487 1.415 0 O-C-N 121.095 -1.003 . . . . 0.0 109.0 179.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.441 ' O ' ' CB ' ' A' ' 54' ' ' ASP . 31.1 Cg_endo -86.72 -17.22 3.38 Favored 'Trans proline' 0 N--CA 1.493 1.496 0 C-N-CA 122.356 2.038 . . . . 0.0 111.441 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.441 ' CB ' ' O ' ' A' ' 53' ' ' PRO . 6.2 t0 75.4 164.22 0.26 Allowed 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.264 -1.014 . . . . 0.0 108.264 -178.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.688 ' O ' ' N ' ' A' ' 57' ' ' GLU . 0.1 OUTLIER -80.28 -47.4 1.33 Allowed Pre-proline 0 N--CA 1.497 1.898 0 O-C-N 120.638 -1.289 . . . . 0.0 112.18 -178.405 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.6 ' O ' ' N ' ' A' ' 59' ' ' LYS . 30.2 Cg_exo -39.98 62.58 0.0 OUTLIER 'Trans proline' 0 N--CA 1.505 2.154 0 C-N-CA 123.523 2.816 . . . . 0.0 115.363 -178.356 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.688 ' N ' ' O ' ' A' ' 55' ' ' SER . 30.3 mt-10 36.63 29.08 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.038 0 CA-C-O 121.437 0.637 . . . . 0.0 109.477 179.273 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.534 ' N ' ' O ' ' A' ' 56' ' ' PRO . 0.1 OUTLIER 65.16 -8.07 0.26 Allowed 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -177.902 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.6 ' N ' ' O ' ' A' ' 56' ' ' PRO . 4.2 tmtm? -50.2 -40.79 48.26 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-O 121.704 0.764 . . . . 0.0 109.015 179.021 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -56.65 -27.31 58.27 Favored 'General case' 0 C--N 1.296 -1.724 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -179.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -73.17 -53.61 10.54 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 177.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -62.85 -32.47 73.71 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.661 179.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -61.7 -38.08 86.54 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.154 -0.966 . . . . 0.0 108.542 179.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.1 -30.67 78.42 Favored Glycine 0 N--CA 1.481 1.675 0 N-CA-C 108.381 -1.888 . . . . 0.0 108.381 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.496 ' CE2' ' NZ ' ' A' ' 104' ' ' LYS . 56.2 m-85 -84.01 -39.51 19.57 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.35 -1.088 . . . . 0.0 108.26 178.292 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -69.34 -46.4 67.14 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 178.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 5.6 mm -56.69 -38.87 59.99 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 179.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.72 -48.17 82.08 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.404 -0.81 . . . . 0.0 109.545 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 53.7 t -60.94 -17.33 15.55 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 O-C-N 121.65 -0.656 . . . . 0.0 109.632 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -78.55 -43.61 12.01 Favored Glycine 0 N--CA 1.487 2.087 0 C-N-CA 119.609 -1.281 . . . . 0.0 110.792 -178.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.462 ' NE2' ' C ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -71.7 -30.74 65.99 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.557 -1.555 . . . . 0.0 107.501 179.713 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 12.0 mt -74.01 -31.35 29.98 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 177.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -62.83 -57.52 10.57 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.252 -0.905 . . . . 0.0 110.099 -179.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -62.69 -29.2 70.47 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.132 -0.98 . . . . 0.0 109.746 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.32 -29.29 61.54 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 120.645 -1.284 . . . . 0.0 108.355 179.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.406 HD12 ' HB3' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -56.49 -33.18 65.72 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 106.171 -1.789 . . . . 0.0 106.171 178.185 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.4 tptt -69.03 -42.37 76.45 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.422 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 8.1 mp -59.51 -37.62 78.79 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.37 -0.831 . . . . 0.0 108.85 -178.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.572 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -63.4 -51.33 66.24 Favored 'General case' 0 C--N 1.298 -1.642 0 O-C-N 121.272 -0.893 . . . . 0.0 109.23 178.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.458 HD22 ' HG2' ' A' ' 27' ' ' LYS . 1.8 t-20 -72.6 -11.07 60.5 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.418 -0.802 . . . . 0.0 111.012 -178.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -95.04 -10.86 29.56 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 120.904 -1.122 . . . . 0.0 109.513 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.83 12.92 48.62 Favored Glycine 0 N--CA 1.496 2.651 0 N-CA-C 110.693 -0.963 . . . . 0.0 110.693 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp -95.22 77.43 3.46 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.971 -1.311 . . . . 0.0 108.43 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.418 HG22 HG21 ' A' ' 26' ' ' VAL . 71.2 t -75.63 -52.01 19.3 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.747 0 O-C-N 121.864 -0.523 . . . . 0.0 109.646 -179.344 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.455 ' H ' ' HD2' ' A' ' 85' ' ' LYS . 4.7 mptt -53.74 -37.15 63.08 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.091 -1.078 . . . . 0.0 108.091 179.25 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -70.24 -42.61 72.0 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 178.334 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.65 -53.74 37.24 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 119.627 -0.829 . . . . 0.0 109.18 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.566 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -59.69 -46.03 90.31 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 179.52 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -58.62 -39.22 79.83 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.117 -0.99 . . . . 0.0 108.403 179.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.528 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -64.73 -29.58 70.56 Favored 'General case' 0 N--CA 1.485 1.31 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 178.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.566 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -49.17 -47.43 45.85 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.983 -1.073 . . . . 0.0 108.16 178.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -62.37 -27.06 68.81 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 178.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.669 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -72.64 -36.39 67.99 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 177.939 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.403 HD11 ' OE1' ' A' ' 71' ' ' GLN . 10.0 mp -65.57 -48.24 73.06 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.459 -1.312 . . . . 0.0 107.459 178.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 3.6 mtpt -52.81 -48.37 66.99 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.371 -0.83 . . . . 0.0 109.189 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 45.4 m -69.28 -34.27 74.49 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.163 -0.961 . . . . 0.0 109.674 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.4 m -58.52 -48.04 82.16 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 4.2 mm -50.32 -33.7 10.67 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.312 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.22 -42.05 76.62 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 179.217 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.41 -28.18 69.07 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.609 -0.682 . . . . 0.0 109.48 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -67.83 -35.66 78.99 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 179.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.544 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -61.6 -32.77 72.9 Favored 'General case' 0 C--N 1.303 -1.451 0 C-N-CA 119.052 -1.059 . . . . 0.0 108.358 179.584 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.552 ' NE2' ' N ' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -64.04 -23.45 67.34 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 105.178 -2.156 . . . . 0.0 105.178 177.846 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.552 ' N ' ' NE2' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -83.86 -33.8 24.76 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 177.577 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.538 ' CD1' ' C ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -89.98 4.77 49.13 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 120.947 -1.096 . . . . 0.0 108.55 179.39 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.395 0 CA-C-O 117.94 -1.478 . . . . 0.0 109.519 179.714 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 121.546 0.689 . . . . 0.0 109.419 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 69.2 mt -88.36 -51.94 5.47 Favored 'General case' 0 C--N 1.295 -1.762 0 O-C-N 121.608 -0.682 . . . . 0.0 109.326 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -64.47 -25.11 67.86 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -73.41 -43.4 60.55 Favored 'General case' 0 C--N 1.296 -1.741 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.584 HD22 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -57.82 -40.61 80.44 Favored 'General case' 0 C--N 1.307 -1.264 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -179.886 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.584 ' N ' HD22 ' A' ' 6' ' ' ASN . 8.2 m95 -52.67 -53.01 53.33 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.165 -0.959 . . . . 0.0 108.702 -179.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 51.1 tt0 -59.38 -30.84 68.71 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 120.918 -1.114 . . . . 0.0 108.434 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.3 m -67.98 -54.28 19.77 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 119.451 -0.899 . . . . 0.0 108.79 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.4 mt -58.27 -37.27 74.64 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 178.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -69.34 -60.86 2.06 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.385 -0.822 . . . . 0.0 109.809 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -55.67 -14.72 2.37 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.347 -0.846 . . . . 0.0 109.349 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.53 ' O ' HG22 ' A' ' 16' ' ' VAL . 2.2 m-20 -74.6 -54.62 7.11 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 107.637 -1.245 . . . . 0.0 107.637 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.5 mt -55.92 -22.38 25.62 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.537 -0.727 . . . . 0.0 110.312 -178.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 11.7 tttp -70.21 -57.61 4.72 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.068 -1.02 . . . . 0.0 109.102 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.617 ' O ' ' N ' ' A' ' 20' ' ' ALA . 14.9 m -52.68 -22.76 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 C-N-CA 118.864 -1.135 . . . . 0.0 110.316 -178.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 9.4 mt -70.2 -74.87 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 120.441 -1.412 . . . . 0.0 109.926 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -47.67 -28.57 2.46 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.143 -0.973 . . . . 0.0 108.724 -179.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.13 4.33 36.87 Favored 'General case' 0 N--CA 1.495 1.809 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.617 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -57.65 -38.45 75.09 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 179.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.529 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 0.6 OUTLIER 63.57 -17.6 0.06 Allowed 'General case' 0 N--CA 1.494 1.753 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.225 179.744 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.63 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -146.6 144.23 29.4 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.749 -1.219 . . . . 0.0 109.787 179.773 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -56.06 -15.75 4.04 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.721 -0.612 . . . . 0.0 110.106 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.51 -55.54 13.13 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.215 -0.928 . . . . 0.0 109.568 -179.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -68.34 -19.04 64.63 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.557 -0.714 . . . . 0.0 110.609 -179.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.555 HG12 ' HB2' ' A' ' 79' ' ' ALA . 47.5 t -70.8 -46.71 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 O-C-N 120.936 -1.102 . . . . 0.0 108.589 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.43 ' HG2' HD22 ' A' ' 80' ' ' ASN . 14.0 mtpt -55.58 -56.74 16.78 Favored 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 178.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -51.8 -34.14 38.64 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-N 114.403 -1.271 . . . . 0.0 109.64 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.84 -69.66 0.33 Allowed 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.289 -0.882 . . . . 0.0 110.32 -179.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 30' ' ' LEU . 93.0 mt -57.1 -19.99 22.79 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.52 -0.738 . . . . 0.0 109.414 -178.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.428 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 39.4 m -64.17 -40.76 96.81 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 178.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 58.2 mttt -73.94 -32.07 63.33 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 36.8 mtp -66.67 -69.09 0.33 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 120.988 -1.07 . . . . 0.0 108.74 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.3 ttt-85 -45.9 -29.18 1.31 Allowed 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.32 -64.76 0.95 Allowed 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 120.049 -0.66 . . . . 0.0 109.843 179.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.66 -33.17 73.5 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.043 -1.036 . . . . 0.0 109.224 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.25 -38.07 82.36 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 179.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.5 mt -65.68 -26.32 67.73 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 179.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 61.0 t0 -84.66 -37.42 21.05 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.12 -0.987 . . . . 0.0 110.041 -179.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.563 ' O ' ' N ' ' A' ' 42' ' ' LYS . . . -58.46 -69.34 0.19 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.07 -1.019 . . . . 0.0 109.607 -179.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.626 HE22 ' NH2' ' A' ' 62' ' ' ARG . 0.0 OUTLIER 11.78 -78.42 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.606 0 CA-C-O 121.702 0.763 . . . . 0.0 111.354 -179.581 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.563 ' N ' ' O ' ' A' ' 40' ' ' ALA . 44.7 mmtt -56.26 13.0 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.926 -0.483 . . . . 0.0 110.682 179.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.607 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -75.42 148.38 39.18 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.432 -1.418 . . . . 0.0 110.236 -178.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -153.58 76.51 6.11 Favored Pre-proline 0 N--CA 1.492 1.648 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.421 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 46.9 Cg_exo -49.67 -39.79 46.89 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.537 2.158 . . . . 0.0 113.89 179.781 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.421 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 88.6 Cg_endo -93.1 -93.72 0.0 OUTLIER 'Trans proline' 0 C--N 1.32 -0.967 0 C-N-CA 121.848 1.699 . . . . 0.0 111.589 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.444 ' NZ ' ' CB ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -177.78 103.06 0.05 OUTLIER 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.157 -0.965 . . . . 0.0 110.227 179.899 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.414 ' C ' ' N ' ' A' ' 50' ' ' ASP . 0.5 OUTLIER -82.85 -175.05 5.61 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 107.019 -1.474 . . . . 0.0 107.019 178.17 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 51.35 20.38 0.95 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.796 -1.19 . . . . 0.0 108.36 -179.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.414 ' N ' ' C ' ' A' ' 48' ' ' LEU . 7.7 m-20 -143.16 -61.33 0.42 Allowed 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 7.9 ptpp? -66.64 -146.98 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 178.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 25.9 t -77.96 131.92 68.83 Favored Pre-proline 0 C--N 1.307 -1.273 0 O-C-N 120.65 -1.281 . . . . 0.0 108.279 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -80.99 -11.61 12.27 Favored 'Trans proline' 0 N--CA 1.496 1.656 0 C-N-CA 122.354 2.036 . . . . 0.0 111.468 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 69.02 -128.2 0.1 Allowed 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 -178.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.805 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 24.2 t -168.27 -28.45 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.714 0 C-N-CA 118.645 -1.222 . . . . 0.0 113.523 -179.42 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.805 ' CD ' ' H ' ' A' ' 55' ' ' SER . 73.4 Cg_exo -54.75 45.65 0.03 OUTLIER 'Trans proline' 0 N--CA 1.503 2.081 0 C-N-CA 122.277 1.985 . . . . 0.0 113.205 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.678 ' N ' ' O ' ' A' ' 55' ' ' SER . 38.6 mt-10 46.98 27.94 0.8 Allowed 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 -179.383 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 8.9 mtm 65.4 -8.25 0.28 Allowed 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 -177.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.601 ' H ' ' C ' ' A' ' 57' ' ' GLU . 1.0 OUTLIER -50.21 -46.65 54.69 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-O 121.716 0.769 . . . . 0.0 109.875 179.191 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.463 ' H ' ' HB2' ' A' ' 56' ' ' PRO . 8.0 t70 -52.31 -17.81 1.32 Allowed 'General case' 0 C--N 1.293 -1.875 0 O-C-N 121.089 -1.007 . . . . 0.0 109.331 -178.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -74.74 -68.07 0.58 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.166 -0.959 . . . . 0.0 109.265 178.46 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.626 ' NH2' HE22 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -58.46 -27.11 64.09 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 -179.644 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.594 ' CE1' HD11 ' A' ' 67' ' ' ILE . 3.5 t60 -60.99 -45.61 94.11 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.874 -0.788 . . . . 0.0 108.874 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -60.54 -32.09 76.9 Favored Glycine 0 N--CA 1.484 1.889 0 C-N-CA 118.89 -1.624 . . . . 0.0 109.214 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.505 ' O ' HG23 ' A' ' 69' ' ' VAL . 88.5 m-85 -82.0 -41.98 19.98 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.106 -1.232 . . . . 0.0 108.258 178.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 51.9 t0 -69.5 -46.41 66.64 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 179.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.594 HD11 ' CE1' ' A' ' 63' ' ' HIS . 17.7 mm -54.59 -47.08 72.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 178.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.9 tp -60.53 -47.28 86.88 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.459 -0.776 . . . . 0.0 108.964 179.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 65' ' ' PHE . 55.3 t -62.45 -21.77 27.94 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 O-C-N 121.181 -0.949 . . . . 0.0 110.072 -179.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -77.19 -49.4 7.5 Favored Glycine 0 N--CA 1.49 2.286 0 C-N-CA 119.686 -1.245 . . . . 0.0 110.471 -178.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.522 ' O ' ' NE2' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -67.32 -28.01 67.64 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 120.67 -1.488 . . . . 0.0 107.519 179.743 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 4.5 mt -74.58 -33.06 31.19 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.474 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 176.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -60.27 -53.79 53.49 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.527 -0.733 . . . . 0.0 109.708 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -64.14 -31.53 72.76 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.439 -0.788 . . . . 0.0 109.764 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.25 -31.56 67.69 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 120.434 -1.416 . . . . 0.0 107.801 179.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.59 -33.38 66.16 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 178.087 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 5.8 tptt -67.13 -43.52 82.2 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-O 121.724 0.773 . . . . 0.0 109.526 178.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.9 mp -59.78 -32.04 70.23 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.555 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -64.11 -55.22 23.56 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.587 -0.696 . . . . 0.0 109.372 178.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.43 HD22 ' HG2' ' A' ' 27' ' ' LYS . 2.7 t-20 -73.37 -10.63 59.94 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.431 -0.793 . . . . 0.0 111.494 -178.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -92.41 -10.91 36.35 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 120.791 -1.193 . . . . 0.0 109.575 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.22 12.39 51.96 Favored Glycine 0 N--CA 1.496 2.681 0 N-CA-C 110.299 -1.12 . . . . 0.0 110.299 178.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 17.3 mmtp -93.86 82.56 4.28 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.064 -1.257 . . . . 0.0 108.001 179.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 19.4 t -76.69 -60.45 2.31 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.809 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.956 -178.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.411 ' H ' ' HD2' ' A' ' 85' ' ' LYS . 7.6 mptt -49.43 -38.0 27.67 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.03 -1.044 . . . . 0.0 109.084 179.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.602 ' H ' ' CD ' ' A' ' 86' ' ' GLU . 35.3 mp0 -68.02 -46.3 71.57 Favored 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 179.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.2 -45.51 80.55 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 119.194 -1.003 . . . . 0.0 108.971 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.535 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -61.94 -58.82 6.43 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 179.488 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -53.4 -37.68 62.72 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.056 -1.027 . . . . 0.0 108.805 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.581 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -63.32 -35.08 79.19 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 178.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.535 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -48.24 -41.97 29.09 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -65.43 -26.41 67.95 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 178.248 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.688 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -73.45 -39.91 64.6 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 177.741 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.495 ' CD1' ' OE1' ' A' ' 71' ' ' GLN . 11.3 mp -62.81 -42.89 99.91 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 107.456 -1.312 . . . . 0.0 107.456 178.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 3.6 mtpt -54.89 -47.96 73.63 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 179.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 87.0 m -69.38 -32.25 71.15 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.244 -0.91 . . . . 0.0 109.515 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.9 m -60.83 -48.12 83.25 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.094 -1.004 . . . . 0.0 108.457 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 95.9 mt -51.23 -36.71 17.07 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -53.29 -43.55 67.6 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.403 ' O ' ' HG3' ' A' ' 103' ' ' GLN . . . -64.32 -37.03 86.06 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.351 -0.843 . . . . 0.0 109.048 179.14 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.458 ' CD1' ' C ' ' A' ' 101' ' ' TYR . 0.5 OUTLIER -65.95 -28.21 68.74 Favored 'General case' 0 C--N 1.297 -1.682 0 O-C-N 120.26 -1.525 . . . . 0.0 107.832 179.41 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.53 ' ND2' ' O ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -66.6 -32.1 73.22 Favored 'General case' 0 C--N 1.298 -1.636 0 C-N-CA 119.152 -1.019 . . . . 0.0 110.084 -179.541 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.513 HE21 ' CA ' ' A' ' 104' ' ' LYS . 0.9 OUTLIER -66.84 -20.94 66.03 Favored 'General case' 0 N--CA 1.485 1.325 0 N-CA-C 104.71 -2.329 . . . . 0.0 104.71 177.999 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.513 ' CA ' HE21 ' A' ' 103' ' ' GLN . 0.0 OUTLIER -80.77 -36.37 31.96 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 177.289 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.551 ' CD1' ' C ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -94.49 6.84 47.56 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.064 -1.023 . . . . 0.0 108.475 179.335 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.503 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.49 2.3 0 CA-C-O 117.943 -1.476 . . . . 0.0 109.612 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.631 0.729 . . . . 0.0 109.186 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 43.7 mt -89.08 -49.83 6.52 Favored 'General case' 0 C--N 1.295 -1.766 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -65.32 -23.78 67.1 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 179.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -74.39 -51.86 13.78 Favored 'General case' 0 C--N 1.298 -1.658 0 C-N-CA 119.796 -0.762 . . . . 0.0 108.969 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.548 HD22 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -53.39 -37.6 62.62 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 -179.77 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.548 ' N ' HD22 ' A' ' 6' ' ' ASN . 11.9 m0 -53.41 -52.85 58.02 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.227 -0.921 . . . . 0.0 108.556 -179.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -56.46 -29.44 61.71 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.289 -0.882 . . . . 0.0 109.2 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 59.4 m -69.46 -63.76 1.01 Allowed 'General case' 0 N--CA 1.486 1.354 0 O-C-N 121.076 -1.015 . . . . 0.0 110.164 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.3 pp -59.05 -30.54 68.12 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 118.382 -1.327 . . . . 0.0 108.026 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -70.91 -58.16 3.87 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.94 -1.1 . . . . 0.0 108.931 178.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -58.96 -11.41 3.35 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.502 -0.749 . . . . 0.0 109.886 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -74.44 -53.24 9.93 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 107.594 -1.261 . . . . 0.0 107.594 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.16 -37.17 69.16 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.711 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.585 ' HZ2' ' HE3' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -67.72 -40.92 84.2 Favored 'General case' 0 C--N 1.296 -1.718 0 C-N-CA 118.51 -1.276 . . . . 0.0 108.74 -179.286 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.553 ' O ' ' N ' ' A' ' 20' ' ' ALA . 69.3 t -60.25 -23.93 29.14 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 O-C-N 120.98 -1.075 . . . . 0.0 109.52 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.466 ' O ' ' N ' ' A' ' 20' ' ' ALA . 12.6 mt -70.41 -70.77 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.875 0 O-C-N 121.021 -1.049 . . . . 0.0 109.93 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -48.25 -25.18 1.42 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.12 -0.987 . . . . 0.0 108.893 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.585 ' HE3' ' HZ2' ' A' ' 15' ' ' LYS . 0.0 OUTLIER -103.38 -1.14 29.1 Favored 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 179.228 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.553 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -57.78 -38.13 74.92 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 107.686 -1.227 . . . . 0.0 107.686 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.505 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 8.9 m-20 58.13 -8.73 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.264 179.431 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.603 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -147.11 144.2 28.86 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 120.574 -1.329 . . . . 0.0 109.745 178.636 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.07 -22.23 37.65 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.861 -0.524 . . . . 0.0 111.016 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.8 -54.96 19.96 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.138 -0.976 . . . . 0.0 110.351 -179.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.419 ' HB2' ' HB1' ' A' ' 20' ' ' ALA . 4.2 mt-30 -67.35 -16.57 64.33 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.147 -0.971 . . . . 0.0 110.614 -179.035 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.476 HG12 ' HB2' ' A' ' 79' ' ' ALA . 48.9 t -71.11 -48.38 55.56 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.019 0 O-C-N 120.916 -1.115 . . . . 0.0 108.39 179.659 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.456 ' HG2' HD22 ' A' ' 80' ' ' ASN . 5.8 mppt? -55.59 -50.94 68.76 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 179.068 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.437 ' N ' ' OD1' ' A' ' 28' ' ' ASP . 6.2 m-20 -54.67 -39.58 68.22 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-N 114.782 -1.099 . . . . 0.0 109.654 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.77 -62.08 1.54 Allowed 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.31 -0.868 . . . . 0.0 110.284 -179.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.474 HD23 ' SD ' ' A' ' 33' ' ' MET . 85.3 mt -62.95 -24.88 68.09 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.11 -0.994 . . . . 0.0 110.514 -179.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 31.6 m -60.86 -45.72 93.42 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.895 -1.128 . . . . 0.0 108.714 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 16.3 mmtm -71.44 -28.99 64.36 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-O 121.305 0.574 . . . . 0.0 109.517 -179.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' MET . . . . . 0.474 ' SD ' HD23 ' A' ' 30' ' ' LEU . 62.9 mtp -64.62 -67.66 0.42 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.153 -0.967 . . . . 0.0 108.812 178.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.473 ' O ' ' CD2' ' A' ' 38' ' ' LEU . 12.3 ttt-85 -48.72 -23.38 1.03 Allowed 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -179.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.403 ' N ' ' C ' ' A' ' 33' ' ' MET . . . -77.76 -58.27 3.36 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.95 -28.56 67.57 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.83 -1.169 . . . . 0.0 110.223 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -57.87 -58.77 6.92 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.98 -1.075 . . . . 0.0 108.609 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.473 ' CD2' ' O ' ' A' ' 34' ' ' ARG . 0.6 OUTLIER -62.34 -18.33 61.17 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.432 -0.793 . . . . 0.0 109.253 179.48 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -84.14 -39.15 19.8 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.773 -1.204 . . . . 0.0 108.248 178.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.47 -19.72 62.34 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.463 -0.773 . . . . 0.0 109.705 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.513 ' O ' ' N ' ' A' ' 43' ' ' ALA . 1.6 tm0? -46.43 -56.82 5.34 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.454 ' HG2' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -63.22 74.6 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.753 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.538 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.513 ' N ' ' O ' ' A' ' 41' ' ' GLN . . . -160.61 149.81 17.12 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.485 -1.384 . . . . 0.0 110.292 -179.223 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -154.91 74.35 5.66 Favored Pre-proline 0 N--CA 1.494 1.729 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.436 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 50.3 Cg_exo -46.8 -38.59 23.14 Favored 'Trans proline' 0 C--N 1.306 -1.688 0 C-N-CA 122.552 2.168 . . . . 0.0 114.315 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.436 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 73.0 Cg_endo -96.9 -92.01 0.0 OUTLIER 'Trans proline' 0 C--N 1.317 -1.111 0 C-N-CA 122.442 2.095 . . . . 0.0 112.149 -179.25 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 10.1 pttp -175.64 102.4 0.07 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.218 -0.927 . . . . 0.0 109.731 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.43 -177.34 6.46 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 178.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 52.07 22.37 1.85 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.751 -1.218 . . . . 0.0 108.291 -178.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -145.6 -56.8 0.31 Allowed 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -68.0 -163.79 0.04 OUTLIER 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.22 -0.925 . . . . 0.0 108.782 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.3 t -76.55 117.32 63.76 Favored Pre-proline 0 N--CA 1.486 1.363 0 O-C-N 120.998 -1.064 . . . . 0.0 108.948 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.585 ' C ' ' H ' ' A' ' 55' ' ' SER . 41.6 Cg_endo -83.25 -9.89 10.28 Favored 'Trans proline' 0 N--CA 1.496 1.645 0 C-N-CA 122.325 2.016 . . . . 0.0 111.494 -179.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.554 ' O ' ' CB ' ' A' ' 55' ' ' SER . 6.7 t0 63.14 -24.37 0.06 Allowed 'General case' 0 N--CA 1.491 1.577 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.595 -178.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.769 ' O ' ' N ' ' A' ' 57' ' ' GLU . 4.5 t 102.47 -26.44 0.0 OUTLIER Pre-proline 0 N--CA 1.52 3.029 0 N-CA-C 115.557 1.688 . . . . 0.0 115.557 177.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.55 ' O ' ' N ' ' A' ' 59' ' ' LYS . 85.7 Cg_exo -45.98 36.86 0.01 OUTLIER 'Trans proline' 0 N--CA 1.511 2.529 0 C-N-CA 122.677 2.251 . . . . 0.0 114.943 179.262 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.769 ' N ' ' O ' ' A' ' 55' ' ' SER . 25.3 tt0 50.41 23.4 1.25 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 120.426 -1.421 . . . . 0.0 107.189 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.503 ' SD ' ' O ' ' A' ' 57' ' ' GLU . 0.8 OUTLIER 66.41 -3.9 0.78 Allowed 'General case' 0 C--N 1.307 -1.282 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 -178.281 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.55 ' N ' ' O ' ' A' ' 56' ' ' PRO . 0.1 OUTLIER -52.93 -42.45 65.42 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 121.953 0.883 . . . . 0.0 109.396 179.514 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -55.39 -17.95 5.86 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 108.498 -0.926 . . . . 0.0 108.498 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.443 ' CD1' ' NZ ' ' A' ' 104' ' ' LYS . 30.8 t80 -75.11 -63.93 1.16 Allowed 'General case' 0 N--CA 1.492 1.627 0 CA-C-O 122.061 0.934 . . . . 0.0 109.44 178.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.544 ' O ' ' N ' ' A' ' 66' ' ' ASP . 0.0 OUTLIER -63.02 -31.88 73.11 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 -179.655 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.412 ' NE2' HD11 ' A' ' 67' ' ' ILE . 4.8 t60 -54.84 -38.9 68.01 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -65.63 -34.7 89.72 Favored Glycine 0 C--N 1.293 -1.848 0 N-CA-C 108.137 -1.985 . . . . 0.0 108.137 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -82.98 -32.97 26.75 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.304 -1.115 . . . . 0.0 108.517 178.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.544 ' N ' ' O ' ' A' ' 62' ' ' ARG . 14.6 t0 -72.25 -44.89 62.19 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 177.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.412 HD11 ' NE2' ' A' ' 63' ' ' HIS . 5.5 mm -63.13 -35.86 73.52 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.524 0 O-C-N 121.287 -0.883 . . . . 0.0 109.094 178.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.8 tp -54.18 -61.34 2.37 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 122.153 0.978 . . . . 0.0 108.96 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.439 HG22 ' O ' ' A' ' 66' ' ' ASP . 31.0 m -57.87 -13.32 2.45 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.835 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.548 -178.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -78.19 -54.82 4.26 Favored Glycine 0 N--CA 1.494 2.506 0 C-N-CA 119.806 -1.188 . . . . 0.0 111.172 -179.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.446 ' O ' ' NE2' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -67.08 -29.12 68.79 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.316 -1.697 . . . . 0.0 107.9 -179.837 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 14.4 mt -71.05 -31.43 44.92 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 177.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -58.14 -52.22 66.45 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 119.205 -0.998 . . . . 0.0 109.347 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -64.4 -31.98 73.42 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.361 -0.837 . . . . 0.0 109.471 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.12 -30.22 63.47 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 120.698 -1.251 . . . . 0.0 108.389 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.81 -33.81 64.78 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 178.292 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.4 tptt -68.65 -46.54 68.89 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.33 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 8.1 mp -58.0 -33.41 68.9 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 -178.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.476 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -64.08 -50.07 69.82 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.35 -0.844 . . . . 0.0 108.862 178.183 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.456 HD22 ' HG2' ' A' ' 27' ' ' LYS . 2.1 t-20 -74.2 -13.58 60.82 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.591 -0.693 . . . . 0.0 111.447 -178.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 82.5 mt-10 -93.09 -10.43 36.05 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.602 -1.311 . . . . 0.0 110.128 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 95.57 15.62 42.79 Favored Glycine 0 N--CA 1.496 2.641 0 N-CA-C 110.264 -1.134 . . . . 0.0 110.264 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.1 mmtt -96.44 75.66 2.89 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.205 -1.173 . . . . 0.0 108.312 179.154 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 22.0 t -73.29 -59.32 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.778 -0.576 . . . . 0.0 109.638 -179.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.522 ' H ' ' HD2' ' A' ' 85' ' ' LYS . 0.0 OUTLIER -48.41 -35.99 13.85 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.216 -0.927 . . . . 0.0 108.517 179.378 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.604 ' H ' ' CD ' ' A' ' 86' ' ' GLU . 27.2 mp0 -71.65 -47.84 51.68 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 178.432 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.34 -42.74 98.95 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.545 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.1 OUTLIER -60.75 -61.42 2.6 Favored 'General case' 0 C--N 1.296 -1.726 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 178.654 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -49.0 -37.59 20.81 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.154 -0.966 . . . . 0.0 109.07 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.547 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -63.08 -36.56 84.0 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 178.246 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.545 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -45.96 -46.97 16.58 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.456 ' OE1' ' O ' ' A' ' 88' ' ' GLN . 2.3 mp0 -62.76 -27.18 69.11 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.14 -0.975 . . . . 0.0 108.444 178.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.728 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -72.69 -41.22 65.54 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 177.915 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.416 HD12 ' N ' ' A' ' 94' ' ' LEU . 9.5 mp -63.44 -43.09 98.42 Favored 'General case' 0 C--N 1.305 -1.354 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 3.9 mtpt -56.27 -40.9 74.98 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.29 -0.881 . . . . 0.0 108.813 178.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 13.5 m -67.47 -31.75 72.12 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.15 -0.969 . . . . 0.0 108.868 179.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.24 -42.61 98.92 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 178.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.2 mt -53.81 -32.92 22.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.9 tpt180 -58.64 -45.4 89.38 Favored 'General case' 0 C--N 1.302 -1.496 0 C-N-CA 119.023 -1.071 . . . . 0.0 108.414 179.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.64 -24.96 67.75 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.461 -0.774 . . . . 0.0 109.18 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.408 ' O ' ' N ' ' A' ' 105' ' ' TYR . 6.2 t80 -74.72 -32.11 62.04 Favored 'General case' 0 C--N 1.297 -1.711 0 O-C-N 120.557 -1.34 . . . . 0.0 108.028 179.287 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.546 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.2 OUTLIER -65.5 -40.94 93.62 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 120.991 -1.068 . . . . 0.0 110.72 -179.096 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.654 HE21 ' N ' ' A' ' 104' ' ' LYS . 1.3 pp0? -64.87 -22.26 66.96 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 105.514 -2.032 . . . . 0.0 105.514 179.136 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.654 ' N ' HE21 ' A' ' 103' ' ' GLN . 0.0 OUTLIER -81.82 -33.31 30.82 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 176.631 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.568 ' CD1' ' C ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -90.61 3.77 53.18 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.117 -0.989 . . . . 0.0 108.59 179.7 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.491 2.342 0 CA-C-O 117.955 -1.469 . . . . 0.0 109.537 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.494 1.734 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 15.1 mt -87.38 -51.2 6.08 Favored 'General case' 0 C--N 1.296 -1.73 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 -179.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -64.36 -22.72 67.05 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -72.73 -44.78 61.24 Favored 'General case' 0 C--N 1.298 -1.657 0 C-N-CA 119.568 -0.853 . . . . 0.0 108.742 -179.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.651 HD22 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -54.83 -44.11 73.61 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 -179.856 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.651 ' N ' HD22 ' A' ' 6' ' ' ASN . 11.6 m95 -53.13 -48.08 68.18 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.556 -0.715 . . . . 0.0 109.524 -179.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -56.32 -33.0 65.17 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 120.805 -1.185 . . . . 0.0 108.163 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.3 m -68.19 -52.12 37.95 Favored 'General case' 0 C--N 1.306 -1.301 0 C-N-CA 119.185 -1.006 . . . . 0.0 108.371 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 25.9 mt -58.96 -38.84 80.0 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 178.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -68.33 -52.78 29.64 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.576 -0.849 . . . . 0.0 108.902 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -61.53 -15.39 37.88 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.599 -0.688 . . . . 0.0 109.628 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -74.94 -51.82 12.77 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 179.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.2 mt -57.61 -33.01 67.77 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-O 120.995 0.426 . . . . 0.0 111.425 -178.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -67.8 -47.62 68.58 Favored 'General case' 0 C--N 1.296 -1.754 0 O-C-N 121.066 -1.022 . . . . 0.0 108.654 -179.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.523 ' O ' ' N ' ' A' ' 20' ' ' ALA . 55.6 t -55.88 -25.49 19.01 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 C-N-CA 119.304 -0.958 . . . . 0.0 109.755 -179.1 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.487 ' O ' ' N ' ' A' ' 20' ' ' ALA . 7.2 mt -71.28 -72.48 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.181 0 O-C-N 120.936 -1.103 . . . . 0.0 110.213 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -46.8 -27.4 1.2 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.893 -1.129 . . . . 0.0 109.201 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -101.02 -4.07 28.16 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.474 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.548 ' O ' ' ND2' ' A' ' 22' ' ' ASN . . . -57.49 -54.56 45.43 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 178.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.465 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 39.8 m-20 66.11 -0.92 1.27 Allowed 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.007 179.084 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.593 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -144.63 142.48 30.16 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.587 -1.321 . . . . 0.0 109.19 177.55 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -56.0 -19.38 12.37 Favored 'General case' 0 C--N 1.295 -1.792 0 O-C-N 121.599 -0.688 . . . . 0.0 110.794 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -71.41 -58.89 3.1 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.176 -0.953 . . . . 0.0 111.055 -179.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.515 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 5.0 mt-30 -64.3 -17.58 63.78 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.319 -0.863 . . . . 0.0 111.281 -177.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.518 HG12 ' HB2' ' A' ' 79' ' ' ALA . 55.4 t -70.7 -48.06 60.27 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 120.895 -1.128 . . . . 0.0 108.479 179.707 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.451 ' HG2' HD22 ' A' ' 80' ' ' ASN . 4.1 mtpt -56.27 -51.44 68.15 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 179.267 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.473 ' N ' ' OD1' ' A' ' 28' ' ' ASP . 2.8 m-20 -52.56 -38.03 59.03 Favored 'General case' 0 C--N 1.296 -1.741 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.754 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.52 -64.36 0.88 Allowed 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 119.663 -0.815 . . . . 0.0 110.009 -179.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.459 HD23 ' SD ' ' A' ' 33' ' ' MET . 18.1 mt -61.13 -24.45 66.27 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.295 -0.878 . . . . 0.0 110.126 -178.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.437 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 53.3 m -59.7 -41.11 90.01 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 178.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.0 mtpm? -72.87 -32.08 65.16 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.359 -179.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' MET . . . . . 0.459 ' SD ' HD23 ' A' ' 30' ' ' LEU . 46.8 mtp -67.16 -68.09 0.4 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.01 -1.056 . . . . 0.0 108.956 178.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 12.9 ttt-85 -45.73 -26.44 0.64 Allowed 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -179.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.409 ' N ' ' C ' ' A' ' 33' ' ' MET . . . -74.79 -66.18 0.78 Allowed 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 178.389 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.91 -27.55 68.93 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.145 -0.972 . . . . 0.0 109.819 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.03 -42.15 84.73 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.01 -1.056 . . . . 0.0 108.401 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 25.6 mt -65.57 -30.18 70.88 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -82.53 -35.72 27.01 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.175 -0.953 . . . . 0.0 109.04 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -53.73 -26.16 21.98 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.437 HE21 ' C ' ' A' ' 41' ' ' GLN . 0.8 OUTLIER -52.14 -46.1 65.26 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.669 -0.644 . . . . 0.0 109.764 179.383 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.455 ' HD3' ' H ' ' A' ' 42' ' ' LYS . 4.6 mptt -68.17 3.99 1.43 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.164 -0.96 . . . . 0.0 110.09 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -80.99 144.41 31.83 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.839 -1.163 . . . . 0.0 109.337 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.7 m -154.19 67.9 5.82 Favored Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.147 -0.971 . . . . 0.0 109.932 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.419 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 22.9 Cg_exo -56.64 -42.71 62.25 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 C-N-CA 122.305 2.003 . . . . 0.0 113.527 179.043 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.419 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 65.4 Cg_endo -83.43 -14.18 8.21 Favored 'Trans proline' 0 N--CA 1.494 1.534 0 C-N-CA 121.985 1.79 . . . . 0.0 112.23 -179.231 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 24.0 mtpt 74.2 109.84 0.07 Allowed 'General case' 0 N--CA 1.498 1.955 0 CA-C-O 121.581 0.705 . . . . 0.0 109.539 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.518 ' C ' ' H ' ' A' ' 50' ' ' ASP . 1.5 tt -87.05 -48.06 8.4 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.589 -0.694 . . . . 0.0 109.791 -179.144 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -68.34 40.53 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.082 -1.011 . . . . 0.0 109.381 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.518 ' H ' ' C ' ' A' ' 48' ' ' LEU . 5.6 t0 -146.55 -70.09 0.25 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.251 -0.906 . . . . 0.0 109.598 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.403 ' O ' ' O ' ' A' ' 50' ' ' ASP . 21.9 pttp -64.28 -141.16 0.0 OUTLIER 'General case' 0 C--N 1.298 -1.664 0 O-C-N 121.351 -0.843 . . . . 0.0 108.958 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 38.5 t -74.22 133.51 78.02 Favored Pre-proline 0 N--CA 1.485 1.314 0 O-C-N 120.594 -1.317 . . . . 0.0 109.378 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.41 ' O ' ' CB ' ' A' ' 54' ' ' ASP . 31.4 Cg_endo -83.47 -16.82 6.69 Favored 'Trans proline' 0 N--CA 1.499 1.836 0 C-N-CA 122.489 2.126 . . . . 0.0 112.627 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.41 ' CB ' ' O ' ' A' ' 53' ' ' PRO . 1.0 OUTLIER 77.47 -133.85 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.611 -0.681 . . . . 0.0 109.768 -179.053 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.784 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 12.6 p -167.97 -30.02 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.581 0 O-C-N 120.745 -1.222 . . . . 0.0 113.454 -179.269 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.784 ' CD ' ' H ' ' A' ' 55' ' ' SER . 73.2 Cg_exo -55.63 41.74 0.03 OUTLIER 'Trans proline' 0 N--CA 1.503 2.065 0 C-N-CA 122.243 1.962 . . . . 0.0 113.435 -179.421 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.626 ' N ' ' O ' ' A' ' 55' ' ' SER . 13.2 tt0 50.32 23.63 1.28 Allowed 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 -179.212 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.418 ' N ' ' C ' ' A' ' 56' ' ' PRO . 1.1 mpt? 67.94 -5.78 0.8 Allowed 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 -178.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.522 ' N ' ' O ' ' A' ' 56' ' ' PRO . 0.2 OUTLIER -47.75 -51.95 20.4 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-O 121.735 0.779 . . . . 0.0 108.963 178.902 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -52.41 -25.48 10.07 Favored 'General case' 0 C--N 1.3 -1.579 0 C-N-CA 120.497 -0.481 . . . . 0.0 109.842 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -75.81 -57.1 4.08 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 178.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -61.98 -33.83 75.03 Favored 'General case' 0 C--N 1.302 -1.479 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.683 179.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.401 ' O ' ' N ' ' A' ' 67' ' ' ILE . 1.3 t60 -61.34 -38.97 88.85 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.242 -0.911 . . . . 0.0 108.925 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.58 -32.04 82.89 Favored Glycine 0 N--CA 1.484 1.891 0 N-CA-C 108.874 -1.69 . . . . 0.0 108.874 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.553 ' O ' HG23 ' A' ' 69' ' ' VAL . 52.7 m-85 -81.34 -41.64 21.74 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.185 -1.185 . . . . 0.0 107.995 178.36 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -69.96 -45.38 67.54 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 179.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.401 ' N ' ' O ' ' A' ' 63' ' ' HIS . 4.6 mm -55.1 -49.86 68.38 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 178.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.462 HD13 HG21 ' A' ' 97' ' ' THR . 14.0 tp -59.03 -41.95 89.03 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.553 HG23 ' O ' ' A' ' 65' ' ' PHE . 41.7 t -60.89 -18.96 18.55 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 178.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -79.6 -46.49 7.9 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 110.567 -1.013 . . . . 0.0 110.567 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.533 ' O ' ' NE2' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -67.73 -31.26 71.07 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 120.426 -1.632 . . . . 0.0 106.943 179.506 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 14.3 mt -72.84 -32.47 40.36 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.493 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 176.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -63.18 -52.04 63.93 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.454 -0.778 . . . . 0.0 110.013 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.52 -28.53 69.71 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.166 -0.959 . . . . 0.0 109.756 -179.048 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.57 -35.28 67.91 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 120.529 -1.357 . . . . 0.0 108.038 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.1 -33.04 64.72 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 178.349 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 6.8 tptt -67.48 -46.14 73.82 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 178.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 mp -58.48 -33.6 69.97 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.518 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -63.92 -50.59 68.08 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.026 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.451 HD22 ' HG2' ' A' ' 27' ' ' LYS . 1.9 t-20 -74.43 -12.61 60.55 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.639 -0.663 . . . . 0.0 111.395 -178.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -93.76 -10.63 33.57 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 120.622 -1.299 . . . . 0.0 110.536 -178.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 99.31 11.14 46.11 Favored Glycine 0 N--CA 1.498 2.772 0 C-N-CA 119.92 -1.133 . . . . 0.0 110.368 179.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.4 mmtp -95.91 85.06 3.98 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.094 -1.239 . . . . 0.0 108.282 179.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 30.9 t -77.22 -59.4 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.225 -178.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.468 ' H ' ' HD2' ' A' ' 85' ' ' LYS . 7.8 mptt -54.49 -37.08 64.86 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 120.771 -1.206 . . . . 0.0 109.221 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -66.93 -42.71 84.85 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 178.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.11 -49.09 68.72 Favored 'General case' 0 C--N 1.306 -1.316 0 C-N-CA 119.404 -0.918 . . . . 0.0 108.805 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.43 ' O ' ' OE1' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -61.55 -48.49 80.75 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 179.442 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -54.52 -33.11 59.38 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 120.978 -1.076 . . . . 0.0 108.419 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.514 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -66.39 -32.92 74.6 Favored 'General case' 0 C--N 1.306 -1.286 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 178.55 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -48.19 -50.32 29.54 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.43 ' OE1' ' O ' ' A' ' 88' ' ' GLN . 19.7 mp0 -60.57 -27.96 68.1 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 178.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.742 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -74.22 -40.24 62.57 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 106.896 -1.52 . . . . 0.0 106.896 178.404 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.457 ' CD1' ' OE1' ' A' ' 71' ' ' GLN . 8.7 mp -64.07 -42.19 97.06 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 179.264 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 6.2 mtpt -57.94 -44.48 86.96 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.885 -1.135 . . . . 0.0 108.256 178.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 23.9 m -66.96 -27.79 67.75 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.154 -0.967 . . . . 0.0 109.214 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.462 HG21 HD13 ' A' ' 68' ' ' LEU . 0.9 OUTLIER -62.21 -40.55 96.48 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 178.435 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 69.4 mt -49.83 -39.73 15.33 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.45 -43.95 80.02 Favored 'General case' 0 C--N 1.302 -1.466 0 C-N-CA 118.31 -1.356 . . . . 0.0 108.046 179.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.482 ' O ' ' OE1' ' A' ' 103' ' ' GLN . . . -65.83 -27.44 68.25 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.841 0.829 . . . . 0.0 109.305 179.316 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.44 ' O ' ' N ' ' A' ' 105' ' ' TYR . 12.4 t80 -71.71 -27.89 63.32 Favored 'General case' 0 C--N 1.294 -1.821 0 O-C-N 120.384 -1.448 . . . . 0.0 107.794 179.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.566 ' C ' HD22 ' A' ' 102' ' ' ASN . 0.4 OUTLIER -67.39 -41.84 84.33 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.109 -0.994 . . . . 0.0 110.229 -179.65 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.594 ' C ' HE21 ' A' ' 103' ' ' GLN . 0.0 OUTLIER -62.09 -21.74 65.23 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 105.403 -2.073 . . . . 0.0 105.403 178.663 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.408 ' N ' ' NE2' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -84.48 -34.95 23.27 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 177.247 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.558 ' CD1' ' C ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -88.54 8.24 29.15 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.921 -1.112 . . . . 0.0 109.018 -179.617 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.317 0 CA-C-O 117.958 -1.468 . . . . 0.0 109.485 179.868 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 . . . . . 0 N--CA 1.493 1.688 0 CA-C-O 121.64 0.733 . . . . 0.0 109.37 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 17.3 mt -89.07 -49.2 6.9 Favored 'General case' 0 C--N 1.295 -1.777 0 CA-C-O 121.631 0.729 . . . . 0.0 109.083 -178.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -66.86 -23.83 66.07 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 179.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -76.2 -49.91 15.92 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.851 -179.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.641 HD22 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -52.03 -42.81 63.36 Favored 'General case' 0 C--N 1.307 -1.245 0 O-C-N 121.252 -0.905 . . . . 0.0 108.695 -179.091 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.641 ' N ' HD22 ' A' ' 6' ' ' ASN . 11.0 m95 -57.61 -51.13 70.74 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.1 -1.0 . . . . 0.0 109.245 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -58.61 -30.16 67.03 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.131 -0.981 . . . . 0.0 108.726 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 46.5 m -67.96 -54.51 18.07 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 119.257 -0.977 . . . . 0.0 108.601 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.8 mt -59.05 -37.76 77.8 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 106.966 -1.494 . . . . 0.0 106.966 178.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -68.3 -55.07 13.38 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 119.725 -0.79 . . . . 0.0 109.104 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -59.05 -16.4 18.57 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.562 -0.711 . . . . 0.0 109.626 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -74.53 -53.55 9.23 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 179.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.9 mt -58.07 -30.69 66.41 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 122.011 -0.431 . . . . 0.0 111.278 -178.198 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.9 ttpp -69.15 -43.11 74.96 Favored 'General case' 0 C--N 1.295 -1.794 0 C-N-CA 118.622 -1.231 . . . . 0.0 108.963 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.532 ' O ' ' N ' ' A' ' 20' ' ' ALA . 53.7 t -57.93 -26.35 28.25 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.61 0 O-C-N 121.11 -0.994 . . . . 0.0 109.52 -179.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.489 ' O ' ' N ' ' A' ' 20' ' ' ALA . 9.6 mt -71.66 -72.25 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.084 -1.01 . . . . 0.0 110.499 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -47.12 -27.46 1.41 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.017 -1.052 . . . . 0.0 109.139 -179.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.74 2.47 30.33 Favored 'General case' 0 N--CA 1.5 2.061 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 178.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.608 ' C ' ' H ' ' A' ' 22' ' ' ASN . . . -56.66 -40.44 75.5 Favored 'General case' 0 N--CA 1.491 1.579 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 178.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.496 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 0.9 OUTLIER 57.25 -13.28 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.988 -0.445 . . . . 0.0 110.84 179.889 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.643 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -146.83 145.57 29.92 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 120.656 -1.278 . . . . 0.0 108.814 178.834 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -53.98 -35.44 61.83 Favored 'General case' 0 C--N 1.296 -1.747 0 O-C-N 121.901 -0.5 . . . . 0.0 111.761 -179.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.77 -49.36 76.84 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 120.987 -1.07 . . . . 0.0 110.671 -178.163 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.547 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 18.9 mt-30 -67.3 -17.68 64.87 Favored 'General case' 0 C--N 1.3 -1.551 0 O-C-N 121.038 -1.039 . . . . 0.0 110.271 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.449 HG12 ' HB2' ' A' ' 79' ' ' ALA . 47.2 t -73.05 -51.05 28.05 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.078 -1.014 . . . . 0.0 108.587 179.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.493 ' HG2' HD22 ' A' ' 80' ' ' ASN . 3.2 mppt? -54.21 -44.65 71.84 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -53.89 -38.79 65.16 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.046 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.77 -65.03 0.79 Allowed 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.483 -0.761 . . . . 0.0 110.452 -179.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 26.3 mt -61.7 -27.86 69.0 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.144 -0.972 . . . . 0.0 110.392 -178.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.427 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 33.7 m -62.25 -40.38 95.99 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 178.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 12.2 mmmt -72.39 -30.36 64.59 Favored 'General case' 0 C--N 1.296 -1.719 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.386 -179.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' MET . . . . . 0.409 ' O ' ' C ' ' A' ' 34' ' ' ARG . 48.7 mtt -63.71 -67.55 0.42 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.024 -1.048 . . . . 0.0 108.797 178.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.721 HH21 ' CB ' ' A' ' 73' ' ' ASP . 0.3 OUTLIER -44.01 -29.89 0.65 Allowed 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 -179.243 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.24 -59.1 2.89 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 178.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.77 -34.81 78.73 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.119 -0.988 . . . . 0.0 109.451 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.55 -38.46 71.93 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.194 -0.941 . . . . 0.0 108.697 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 11.9 mt -67.8 -29.0 68.07 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -85.11 -38.78 18.69 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.077 -1.015 . . . . 0.0 109.336 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.413 ' O ' ' CB ' ' A' ' 43' ' ' ALA . . . -56.5 -23.13 37.4 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.159 -0.963 . . . . 0.0 108.719 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.563 HE21 ' C ' ' A' ' 41' ' ' GLN . 0.6 OUTLIER -52.19 -51.55 57.42 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.264 -0.898 . . . . 0.0 108.94 179.315 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -67.04 10.11 0.16 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.406 -0.809 . . . . 0.0 109.444 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.49 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -79.37 128.71 33.67 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.878 -1.139 . . . . 0.0 108.772 179.682 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.665 ' O ' HG23 ' A' ' 44' ' ' THR . 12.2 t -154.56 61.93 3.4 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.335 -0.853 . . . . 0.0 109.637 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.453 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 86.4 Cg_exo -43.06 -37.31 6.36 Favored 'Trans proline' 0 C--N 1.304 -1.788 0 C-N-CA 122.716 2.277 . . . . 0.0 114.284 179.049 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.453 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 23.1 Cg_endo -93.75 -16.28 0.72 Allowed 'Trans proline' 0 N--CA 1.483 0.86 0 C-N-CA 122.566 2.177 . . . . 0.0 111.847 -179.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 21.3 mttm 80.06 98.29 0.06 Allowed 'General case' 0 N--CA 1.5 2.027 0 CA-C-O 121.25 0.547 . . . . 0.0 109.659 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.511 ' O ' HD23 ' A' ' 48' ' ' LEU . 1.0 OUTLIER -84.28 9.19 13.61 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.371 -0.831 . . . . 0.0 109.323 -179.89 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -99.61 27.82 5.08 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -148.87 -50.33 0.15 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.385 -0.822 . . . . 0.0 110.324 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -65.56 -160.55 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.181 -0.95 . . . . 0.0 109.377 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 20.8 t -73.13 129.99 85.4 Favored Pre-proline 0 N--CA 1.485 1.312 0 O-C-N 120.908 -1.12 . . . . 0.0 109.184 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -82.67 -9.11 11.19 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 122.64 2.227 . . . . 0.0 111.437 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 72.59 -114.48 0.05 Allowed 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 -178.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.737 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 1.4 t -167.87 -32.45 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.719 0 O-C-N 120.2 -1.563 . . . . 0.0 113.288 -179.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.737 ' CD ' ' H ' ' A' ' 55' ' ' SER . 68.1 Cg_exo -56.44 40.98 0.04 OUTLIER 'Trans proline' 0 N--CA 1.502 2.024 0 C-N-CA 122.068 1.845 . . . . 0.0 112.774 -179.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.645 ' N ' ' O ' ' A' ' 55' ' ' SER . 41.1 tt0 50.79 23.18 1.32 Allowed 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 106.999 -1.482 . . . . 0.0 106.999 -178.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.476 ' SD ' ' O ' ' A' ' 57' ' ' GLU . 0.3 OUTLIER 66.38 -3.51 0.83 Allowed 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 -178.272 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.558 ' N ' ' O ' ' A' ' 56' ' ' PRO . 0.9 OUTLIER -48.43 -48.38 37.41 Favored 'General case' 0 N--CA 1.487 1.404 0 CA-C-O 121.851 0.834 . . . . 0.0 109.424 178.984 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -51.13 -26.6 6.88 Favored 'General case' 0 C--N 1.295 -1.792 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 -179.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -77.93 -57.1 3.98 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 120.842 -1.161 . . . . 0.0 107.924 177.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.6 mtt-85 -58.44 -30.6 67.04 Favored 'General case' 0 N--CA 1.488 1.435 0 CA-C-O 121.366 0.603 . . . . 0.0 109.483 179.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.614 ' NE2' HD11 ' A' ' 67' ' ' ILE . 1.8 t60 -63.65 -39.74 95.1 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.276 -0.89 . . . . 0.0 109.041 179.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -61.51 -31.92 79.32 Favored Glycine 0 N--CA 1.486 2.009 0 C-N-CA 118.737 -1.697 . . . . 0.0 109.132 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -81.8 -40.08 23.08 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.054 -1.262 . . . . 0.0 108.291 178.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -70.73 -48.62 53.55 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 178.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.614 HD11 ' NE2' ' A' ' 63' ' ' HIS . 20.5 mm -56.49 -39.06 59.42 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 15.8 tp -56.99 -44.3 82.58 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.4 HG13 ' HG2' ' A' ' 34' ' ' ARG . 20.3 t -63.01 -17.22 18.99 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.45 0 O-C-N 120.918 -1.114 . . . . 0.0 109.095 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -76.24 -40.91 27.75 Favored Glycine 0 N--CA 1.487 2.079 0 C-N-CA 119.859 -1.162 . . . . 0.0 111.011 -178.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.592 ' C ' HE21 ' A' ' 71' ' ' GLN . 0.0 OUTLIER -78.38 -32.67 49.02 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.998 -1.295 . . . . 0.0 107.841 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 7.0 mt -74.19 -30.45 26.98 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.679 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 177.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.721 ' CB ' HH21 ' A' ' 34' ' ' ARG . 0.0 OUTLIER -61.1 -52.57 64.36 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 119.679 -0.808 . . . . 0.0 109.528 -179.658 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -62.27 -32.11 72.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.032 -1.042 . . . . 0.0 108.978 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.46 -34.55 65.44 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 120.87 -1.144 . . . . 0.0 108.252 179.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.71 -30.34 55.64 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 106.943 -1.503 . . . . 0.0 106.943 178.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.6 tptt -70.85 -48.94 51.23 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-O 121.657 0.742 . . . . 0.0 109.66 178.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.445 HD23 ' HB3' ' A' ' 86' ' ' GLU . 8.1 mp -56.93 -34.66 68.19 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 -179.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.449 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -64.62 -49.7 70.02 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.493 HD22 ' HG2' ' A' ' 27' ' ' LYS . 2.2 t-20 -73.08 -14.31 61.37 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.634 -0.666 . . . . 0.0 111.314 -179.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -94.55 -10.1 33.18 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.801 -1.187 . . . . 0.0 110.312 -178.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 97.38 12.6 47.84 Favored Glycine 0 N--CA 1.499 2.877 0 C-N-CA 120.237 -0.982 . . . . 0.0 110.77 178.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 14.3 mmtp -94.94 83.84 4.04 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.009 -1.289 . . . . 0.0 108.687 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 26.1 t -77.34 -56.45 7.87 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 O-C-N 121.79 -0.569 . . . . 0.0 110.009 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.496 ' H ' ' HD2' ' A' ' 85' ' ' LYS . 8.6 mptt -49.64 -39.42 35.94 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.221 -0.924 . . . . 0.0 108.648 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.547 ' OE1' ' N ' ' A' ' 86' ' ' GLU . 47.7 mp0 -70.18 -44.55 68.52 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 121.402 -0.811 . . . . 0.0 109.007 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.13 -38.91 86.38 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 119.359 -0.936 . . . . 0.0 109.338 -179.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.425 ' O ' ' N ' ' A' ' 91' ' ' ALA . 0.1 OUTLIER -61.39 -62.77 1.59 Allowed 'General case' 0 C--N 1.294 -1.825 0 CA-C-O 121.632 0.729 . . . . 0.0 109.607 179.796 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -49.76 -34.95 20.68 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.097 -1.002 . . . . 0.0 109.583 -179.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.531 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -62.03 -35.13 77.67 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 178.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.425 ' N ' ' O ' ' A' ' 88' ' ' GLN . . . -50.22 -43.43 52.78 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.027 -1.046 . . . . 0.0 108.204 178.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -62.8 -23.91 67.48 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 178.4 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.668 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -73.8 -37.92 64.77 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 106.441 -1.688 . . . . 0.0 106.441 177.87 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.435 HD12 ' N ' ' A' ' 94' ' ' LEU . 10.9 mp -68.29 -45.46 72.98 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -50.26 -38.99 43.63 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 107.85 -1.166 . . . . 0.0 107.85 179.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 34.7 m -72.79 -32.07 65.31 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.425 -0.797 . . . . 0.0 109.238 177.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.9 m -58.65 -46.97 85.99 Favored 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 4.3 mm -49.15 -40.91 13.76 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 179.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 10.1 ttt180 -64.5 -55.36 21.22 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 119.22 -0.992 . . . . 0.0 109.294 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.554 ' O ' ' NE2' ' A' ' 103' ' ' GLN . . . -63.4 -19.25 64.52 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.181 -0.949 . . . . 0.0 109.021 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.422 ' CD1' ' C ' ' A' ' 101' ' ' TYR . 9.1 t80 -74.56 -31.11 61.98 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 178.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.551 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -66.67 -42.36 86.7 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.998 -1.064 . . . . 0.0 110.096 -179.908 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.656 ' NE2' ' N ' ' A' ' 104' ' ' LYS . 2.0 pp0? -63.2 -15.76 57.99 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 116.808 -1.957 . . . . 0.0 105.778 179.443 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.656 ' N ' ' NE2' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -82.27 -34.19 28.84 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 106.759 -1.571 . . . . 0.0 106.759 175.572 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.527 ' CG ' ' O ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -91.76 6.36 46.28 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 179.338 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.32 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 179.63 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 . . . . . 0 N--CA 1.491 1.595 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.7 pp -88.53 -32.14 18.33 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 107.175 -1.417 . . . . 0.0 107.175 179.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -67.94 -25.1 65.29 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 105.579 -2.008 . . . . 0.0 105.579 177.037 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -72.95 -36.52 67.18 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.638 ' OD1' ' HB2' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -56.95 -41.28 78.0 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 179.452 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.603 ' N ' HD22 ' A' ' 6' ' ' ASN . 16.9 m95 -57.88 -46.91 84.16 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.079 -1.013 . . . . 0.0 108.841 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -63.2 -28.89 70.35 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 120.884 -1.135 . . . . 0.0 108.548 179.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 89.0 m -68.55 -62.86 1.2 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.464 -0.773 . . . . 0.0 109.733 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.2 pp -57.25 -31.3 65.41 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 118.451 -1.3 . . . . 0.0 108.181 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -70.03 -62.59 1.33 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.072 -1.018 . . . . 0.0 109.651 178.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -58.11 -11.89 2.97 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.368 -0.832 . . . . 0.0 109.79 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.462 ' O ' HG22 ' A' ' 16' ' ' VAL . 2.1 m-20 -72.65 -53.23 12.36 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 179.063 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.2 mt -56.75 -24.85 52.92 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.667 -178.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -68.67 -54.99 12.92 Favored 'General case' 0 C--N 1.301 -1.52 0 C-N-CA 118.414 -1.314 . . . . 0.0 109.166 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.636 ' O ' ' N ' ' A' ' 20' ' ' ALA . 12.5 m -55.01 -20.96 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 120.731 -1.23 . . . . 0.0 110.448 -179.048 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.498 ' O ' ' N ' ' A' ' 20' ' ' ALA . 10.6 mt -71.53 -72.88 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 O-C-N 120.373 -1.454 . . . . 0.0 109.622 179.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -47.71 -27.37 1.93 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.837 -1.164 . . . . 0.0 108.749 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.4 -0.19 32.94 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.636 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -57.99 -49.0 78.34 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 179.405 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.476 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 0.5 OUTLIER 67.88 -12.33 0.31 Allowed 'General case' 0 C--N 1.296 -1.742 0 O-C-N 121.772 -0.58 . . . . 0.0 109.926 179.336 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.642 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -144.84 143.8 30.8 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.946 -1.096 . . . . 0.0 109.554 178.925 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.21 -24.91 57.7 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 121.882 -0.511 . . . . 0.0 111.193 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.46 -51.61 64.92 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.073 -1.017 . . . . 0.0 109.965 -179.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.509 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 9.4 mt-30 -68.46 -17.55 64.22 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.285 -0.885 . . . . 0.0 110.548 -179.475 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.442 HG12 ' HB2' ' A' ' 79' ' ' ALA . 48.9 t -71.74 -50.23 40.2 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 O-C-N 120.962 -1.087 . . . . 0.0 108.661 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.474 ' HG2' HD22 ' A' ' 80' ' ' ASN . 5.1 mppt? -54.5 -53.22 57.27 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 106.954 -1.498 . . . . 0.0 106.954 179.164 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -52.36 -38.87 59.86 Favored 'General case' 0 C--N 1.296 -1.738 0 CA-C-N 114.717 -1.129 . . . . 0.0 109.453 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.58 -67.75 0.46 Allowed 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.468 -0.77 . . . . 0.0 110.433 -179.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.493 ' HB3' HD12 ' A' ' 76' ' ' LEU . 33.9 mt -59.16 -25.77 64.2 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.345 -0.847 . . . . 0.0 109.913 -178.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.455 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 20.8 m -61.39 -38.98 89.01 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 179.124 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 33.1 mttm -74.17 -31.06 62.54 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' MET . . . . . 0.442 ' SD ' HD23 ' A' ' 30' ' ' LEU . 41.2 mtp -66.65 -65.38 0.69 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.993 -1.067 . . . . 0.0 108.173 178.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.445 HH11 ' HD3' ' A' ' 34' ' ' ARG . 18.2 ttt-85 -47.68 -25.56 1.24 Allowed 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.0 -60.12 2.41 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 119.843 -0.743 . . . . 0.0 109.025 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.78 -33.21 75.15 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.018 -1.051 . . . . 0.0 109.826 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.48 -39.73 73.72 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.087 -1.008 . . . . 0.0 108.795 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.5 mt -65.96 -32.11 73.41 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.405 -0.809 . . . . 0.0 108.878 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -86.22 -36.61 19.33 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.224 -0.922 . . . . 0.0 109.986 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.638 ' HB2' ' OD1' ' A' ' 6' ' ' ASN . . . -60.02 -22.24 62.36 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.151 -0.968 . . . . 0.0 110.461 -179.075 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.579 ' C ' ' H ' ' A' ' 43' ' ' ALA . 1.1 tm0? -48.84 -66.54 0.38 Allowed 'General case' 0 C--N 1.3 -1.556 0 O-C-N 120.879 -1.138 . . . . 0.0 109.335 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.557 ' NZ ' ' NE2' ' A' ' 41' ' ' GLN . 2.8 mptp? -53.96 5.04 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.625 -0.672 . . . . 0.0 110.71 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.579 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -78.48 134.47 37.32 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.607 -1.308 . . . . 0.0 109.515 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -152.18 72.1 7.74 Favored Pre-proline 0 N--CA 1.492 1.656 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.44 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 52.0 Cg_exo -46.81 -39.12 23.91 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.521 2.147 . . . . 0.0 113.905 -179.305 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.44 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 89.5 Cg_endo -97.63 -95.75 0.0 OUTLIER 'Trans proline' 0 C--N 1.319 -1.02 0 C-N-CA 122.426 2.084 . . . . 0.0 111.852 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 4.0 pttt -175.6 116.57 0.15 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.283 -0.886 . . . . 0.0 110.005 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.54 ' CD2' ' H ' ' A' ' 49' ' ' GLU . 0.4 OUTLIER -83.86 -172.66 4.28 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 178.116 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.54 ' H ' ' CD2' ' A' ' 48' ' ' LEU . 59.8 mt-10 49.27 23.3 0.79 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.76 -1.212 . . . . 0.0 108.814 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.403 ' N ' ' C ' ' A' ' 48' ' ' LEU . 4.3 m-20 -140.49 -70.5 0.38 Allowed 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.421 ' HG3' ' N ' ' A' ' 52' ' ' SER . 17.5 pttp -66.96 -121.69 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 178.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.421 ' N ' ' HG3' ' A' ' 51' ' ' LYS . 9.1 t -81.89 114.1 47.91 Favored Pre-proline 0 N--CA 1.488 1.446 0 O-C-N 120.539 -1.351 . . . . 0.0 109.581 179.134 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -90.19 -16.24 1.8 Allowed 'Trans proline' 0 N--CA 1.491 1.372 0 C-N-CA 122.452 2.101 . . . . 0.0 112.023 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 65.05 -131.6 0.27 Allowed 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 -178.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.756 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 7.5 t -170.06 -33.84 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 120.859 -1.151 . . . . 0.0 112.363 179.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.756 ' CD ' ' H ' ' A' ' 55' ' ' SER . 95.0 Cg_exo -51.52 59.35 0.02 OUTLIER 'Trans proline' 0 N--CA 1.505 2.178 0 C-N-CA 122.608 2.205 . . . . 0.0 114.116 -178.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.634 ' N ' ' O ' ' A' ' 55' ' ' SER . 93.5 mt-10 42.42 29.51 0.16 Allowed 'General case' 0 N--CA 1.493 1.725 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.473 ' SD ' ' C ' ' A' ' 57' ' ' GLU . 1.3 mpt? 65.27 -8.17 0.27 Allowed 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 -178.107 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.61 ' H ' ' C ' ' A' ' 57' ' ' GLU . 2.4 tmtm? -48.1 -43.27 30.77 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-O 121.804 0.811 . . . . 0.0 109.169 179.296 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -56.29 -27.08 54.23 Favored 'General case' 0 C--N 1.294 -1.834 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 -179.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -73.94 -53.14 10.78 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.5 mtt85 -61.79 -33.0 73.33 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.392 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.427 ' O ' ' N ' ' A' ' 67' ' ' ILE . 0.7 OUTLIER -63.29 -35.88 81.84 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.226 -0.921 . . . . 0.0 108.704 179.594 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.34 -31.82 80.11 Favored Glycine 0 N--CA 1.485 1.915 0 N-CA-C 108.326 -1.91 . . . . 0.0 108.326 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.466 ' HZ ' ' HZ1' ' A' ' 104' ' ' LYS . 65.4 m-85 -81.67 -38.01 26.56 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 178.011 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -72.14 -47.4 51.33 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.427 ' N ' ' O ' ' A' ' 63' ' ' HIS . 4.8 mm -56.2 -48.88 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 179.037 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 14.8 tp -57.41 -44.93 84.99 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 65' ' ' PHE . 32.1 t -65.92 -19.93 26.49 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.366 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 178.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -77.75 -48.39 7.92 Favored Glycine 0 N--CA 1.488 2.145 0 C-N-CA 120.1 -1.047 . . . . 0.0 110.549 -178.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.58 ' C ' HE21 ' A' ' 71' ' ' GLN . 0.0 OUTLIER -71.37 -29.79 65.38 Favored 'General case' 0 C--N 1.305 -1.341 0 O-C-N 120.823 -1.398 . . . . 0.0 107.583 179.725 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 8.1 mt -75.16 -33.64 29.27 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.507 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 176.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -62.74 -58.69 6.59 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.256 -0.902 . . . . 0.0 109.332 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.72 -26.81 67.45 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.64 -31.13 63.35 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 107.821 -1.178 . . . . 0.0 107.821 178.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.493 HD12 ' HB3' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -57.07 -33.55 67.38 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 106.236 -1.764 . . . . 0.0 106.236 178.155 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.8 tptt -68.16 -48.17 66.06 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.517 179.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.5 mp -57.69 -34.95 69.97 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.442 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -64.21 -50.4 68.2 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 178.212 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.474 HD22 ' HG2' ' A' ' 27' ' ' LYS . 2.1 t-20 -73.44 -12.0 60.65 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.47 -0.769 . . . . 0.0 111.352 -179.11 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -95.12 -12.81 25.8 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.663 -1.273 . . . . 0.0 110.23 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 99.28 11.85 43.96 Favored Glycine 0 N--CA 1.495 2.607 0 C-N-CA 120.206 -0.997 . . . . 0.0 110.688 179.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.3 mmtp -93.65 78.68 4.28 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 120.887 -1.361 . . . . 0.0 108.135 179.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 26.3 t -75.91 -50.67 22.37 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.679 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.72 -179.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.455 ' H ' ' HD2' ' A' ' 85' ' ' LYS . 6.9 mptt -53.0 -38.7 62.53 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 120.936 -1.102 . . . . 0.0 108.18 179.119 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.541 ' N ' ' CD ' ' A' ' 86' ' ' GLU . 4.7 mp0 -69.08 -42.95 75.52 Favored 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 178.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.5 -51.97 44.72 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 119.532 -0.867 . . . . 0.0 109.707 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.5 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -60.44 -49.45 77.51 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 -179.893 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -55.0 -37.29 66.39 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.853 -1.155 . . . . 0.0 108.402 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.518 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -65.68 -31.91 73.18 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 178.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.5 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -49.87 -43.24 49.09 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 178.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -65.43 -27.51 68.57 Favored 'General case' 0 C--N 1.306 -1.285 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 178.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.668 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -73.42 -41.25 63.5 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 106.605 -1.628 . . . . 0.0 106.605 177.805 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.449 HD11 ' OE1' ' A' ' 71' ' ' GLN . 7.4 mp -67.56 -37.05 82.1 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 108.315 -0.995 . . . . 0.0 108.315 179.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 2.4 mtpt -53.89 -39.42 65.75 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 120.049 -1.657 . . . . 0.0 106.685 177.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.3 m -71.05 -26.01 62.89 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.431 ' O ' ' N ' ' A' ' 101' ' ' TYR . 1.2 m -60.84 -46.33 91.0 Favored 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 179.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 81.4 mt -51.33 -43.01 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 179.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -62.95 -56.76 14.33 Favored 'General case' 0 C--N 1.307 -1.269 0 C-N-CA 119.633 -0.827 . . . . 0.0 109.816 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.432 ' O ' ' HG3' ' A' ' 103' ' ' GLN . . . -63.68 -21.68 66.51 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.858 -1.151 . . . . 0.0 108.828 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.629 ' CE2' ' NZ ' ' A' ' 104' ' ' LYS . 11.2 t80 -75.89 -27.46 57.72 Favored 'General case' 0 C--N 1.291 -1.938 0 O-C-N 120.351 -1.468 . . . . 0.0 107.328 178.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.538 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -67.06 -36.25 81.63 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 119.588 -0.845 . . . . 0.0 109.944 -179.762 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.622 HE21 ' N ' ' A' ' 104' ' ' LYS . 1.3 pp0? -65.32 -23.68 67.07 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 105.158 -2.164 . . . . 0.0 105.158 178.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.629 ' NZ ' ' CE2' ' A' ' 101' ' ' TYR . 0.0 OUTLIER -80.95 -30.86 35.13 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 176.601 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.549 ' CD1' ' C ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -94.84 7.74 44.96 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.186 -0.947 . . . . 0.0 108.782 179.994 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.406 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.492 2.413 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.503 0.668 . . . . 0.0 109.296 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 60.9 mt -89.26 -48.27 7.48 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -63.64 -23.71 67.49 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 178.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -72.97 -47.37 45.97 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ASN . . . . . 0.558 HD22 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -53.99 -38.85 65.51 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 -179.814 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.558 ' N ' HD22 ' A' ' 6' ' ' ASN . 8.2 m95 -55.89 -55.58 30.87 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.146 -0.971 . . . . 0.0 109.621 -179.397 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -52.47 -29.8 26.62 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 120.586 -1.321 . . . . 0.0 109.689 -179.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 53.5 m -68.94 -65.38 0.71 Allowed 'General case' 0 N--CA 1.487 1.421 0 O-C-N 120.837 -1.165 . . . . 0.0 109.599 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.6 pp -57.99 -30.29 65.94 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 118.66 -1.216 . . . . 0.0 108.454 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.62 -59.94 2.49 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.862 -1.149 . . . . 0.0 109.209 178.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.5 t0 -57.38 -13.09 3.01 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.291 -0.881 . . . . 0.0 109.632 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.456 ' O ' HG22 ' A' ' 16' ' ' VAL . 2.1 m-20 -72.73 -52.37 15.41 Favored 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 107.166 -1.42 . . . . 0.0 107.166 179.214 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.6 mt -56.16 -25.9 48.33 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-O 121.058 0.456 . . . . 0.0 110.779 -179.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 25.3 ttmt -68.68 -56.16 9.08 Favored 'General case' 0 C--N 1.3 -1.55 0 C-N-CA 118.669 -1.212 . . . . 0.0 109.215 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.643 ' O ' ' N ' ' A' ' 20' ' ' ALA . 14.3 m -54.28 -20.42 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 C-N-CA 118.771 -1.172 . . . . 0.0 110.578 -178.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 9.3 mt -71.28 -72.08 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 O-C-N 120.339 -1.476 . . . . 0.0 109.093 179.212 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -48.47 -27.4 2.65 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.871 -1.143 . . . . 0.0 108.639 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -101.61 0.2 35.9 Favored 'General case' 0 N--CA 1.495 1.825 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.643 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -59.93 -43.56 94.87 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 179.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.513 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 21.6 m-20 59.46 -9.08 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.036 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.621 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -146.32 143.29 29.03 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 120.604 -1.31 . . . . 0.0 109.653 178.609 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.78 -29.71 54.89 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.679 -0.638 . . . . 0.0 111.423 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.67 -50.85 70.82 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.958 -1.089 . . . . 0.0 110.107 -178.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.499 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 6.3 mt-30 -68.7 -19.11 64.36 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.137 -0.977 . . . . 0.0 110.395 -179.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.484 HG12 ' HB2' ' A' ' 79' ' ' ALA . 43.0 t -71.95 -50.59 36.67 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 120.945 -1.097 . . . . 0.0 108.709 179.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.474 ' HG2' HD22 ' A' ' 80' ' ' ASN . 5.1 mtpt -54.79 -55.3 31.57 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 179.359 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -50.31 -38.36 41.19 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.85 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.56 -62.89 1.2 Allowed 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.243 -0.911 . . . . 0.0 110.05 -179.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 71.7 mt -61.46 -20.47 63.16 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.378 -0.826 . . . . 0.0 110.25 -179.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.432 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 56.7 m -61.21 -47.48 85.9 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 178.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.492 ' NZ ' ' CB ' ' A' ' 32' ' ' LYS . 0.4 OUTLIER -70.93 -25.81 62.91 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 121.807 -0.558 . . . . 0.0 109.793 -179.028 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' MET . . . . . 0.448 ' C ' ' N ' ' A' ' 35' ' ' ALA . 28.2 mtp -67.35 -66.94 0.5 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.784 -1.197 . . . . 0.0 108.905 178.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 22.0 ttt-85 -48.37 -21.58 0.55 Allowed 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.448 ' N ' ' C ' ' A' ' 33' ' ' MET . . . -75.06 -63.02 1.35 Allowed 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 178.201 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.25 -28.52 69.78 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.163 -0.961 . . . . 0.0 109.565 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.79 -41.83 87.6 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.071 -1.018 . . . . 0.0 108.648 179.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 22.7 mt -65.91 -28.62 69.08 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -85.94 -35.63 20.35 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.26 -0.9 . . . . 0.0 109.821 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.441 ' O ' ' CB ' ' A' ' 43' ' ' ALA . . . -55.64 -29.83 59.93 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.028 -1.045 . . . . 0.0 108.974 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.478 ' C ' ' NE2' ' A' ' 41' ' ' GLN . 1.0 OUTLIER -48.06 -53.02 17.78 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-O 122.112 0.958 . . . . 0.0 108.546 178.824 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.434 ' HG2' ' H ' ' A' ' 42' ' ' LYS . 1.6 mmmm -65.35 6.92 0.24 Allowed 'General case' 0 C--N 1.297 -1.688 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.762 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.463 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -81.66 145.56 30.5 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.827 -1.17 . . . . 0.0 110.127 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.6 p -152.05 67.91 7.19 Favored Pre-proline 0 N--CA 1.492 1.661 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.443 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 73.3 Cg_exo -42.87 -38.7 7.05 Favored 'Trans proline' 0 C--N 1.304 -1.795 0 C-N-CA 122.457 2.105 . . . . 0.0 113.376 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.443 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 94.3 Cg_endo -103.07 -98.04 0.0 OUTLIER 'Trans proline' 0 C--N 1.32 -0.935 0 C-N-CA 122.647 2.232 . . . . 0.0 111.983 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.2 102.78 0.08 Allowed 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 -179.348 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.441 ' O ' HD23 ' A' ' 48' ' ' LEU . 1.2 tt -82.05 34.61 0.41 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.796 -1.19 . . . . 0.0 109.733 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.437 ' O ' ' OD1' ' A' ' 50' ' ' ASP . 7.4 pt-20 -133.84 22.67 3.9 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 178.28 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.437 ' OD1' ' O ' ' A' ' 49' ' ' GLU . 0.4 OUTLIER -151.75 -44.76 0.11 Allowed 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -179.161 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.475 ' HG3' ' N ' ' A' ' 52' ' ' SER . 10.3 ptmm? -66.89 -152.78 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.55 -0.719 . . . . 0.0 109.543 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.475 ' N ' ' HG3' ' A' ' 51' ' ' LYS . 7.5 t -77.03 118.73 73.87 Favored Pre-proline 0 N--CA 1.485 1.315 0 O-C-N 120.787 -1.195 . . . . 0.0 109.173 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -83.54 -15.36 7.44 Favored 'Trans proline' 0 N--CA 1.493 1.477 0 C-N-CA 122.327 2.018 . . . . 0.0 111.761 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 47.9 t0 60.47 -132.84 0.79 Allowed 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 -179.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.813 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 11.7 t -165.6 -26.97 0.0 OUTLIER Pre-proline 0 N--CA 1.495 1.79 0 O-C-N 120.328 -1.483 . . . . 0.0 113.898 -179.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.813 ' CD ' ' H ' ' A' ' 55' ' ' SER . 62.7 Cg_exo -56.51 47.29 0.04 OUTLIER 'Trans proline' 0 N--CA 1.504 2.106 0 C-N-CA 122.204 1.936 . . . . 0.0 113.346 -179.605 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.61 ' N ' ' O ' ' A' ' 55' ' ' SER . 0.6 OUTLIER 48.64 27.5 1.52 Allowed 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 -179.005 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.498 ' SD ' ' OE2' ' A' ' 57' ' ' GLU . 1.6 mpp? 64.04 -4.75 0.35 Allowed 'General case' 0 C--N 1.308 -1.202 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -178.213 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.545 ' H ' ' C ' ' A' ' 57' ' ' GLU . 0.1 OUTLIER -48.2 -44.76 33.06 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.947 0.88 . . . . 0.0 108.668 179.009 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.412 ' H ' ' HB2' ' A' ' 56' ' ' PRO . 2.7 t70 -56.41 -25.92 51.62 Favored 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.488 ' N ' ' O ' ' A' ' 58' ' ' MET . 15.6 t80 -76.18 -54.08 7.34 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 177.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.4 mtt85 -59.55 -30.35 68.56 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 179.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.703 ' CE1' HD11 ' A' ' 67' ' ' ILE . 2.4 t60 -61.98 -40.97 97.44 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -62.16 -33.57 86.3 Favored Glycine 0 N--CA 1.484 1.863 0 N-CA-C 109.091 -1.604 . . . . 0.0 109.091 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -81.79 -37.9 26.42 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.012 -1.287 . . . . 0.0 108.264 178.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -71.99 -47.44 52.0 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 178.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.703 HD11 ' CE1' ' A' ' 63' ' ' HIS . 15.8 mm -54.55 -45.09 71.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 12.8 tp -57.81 -44.49 86.42 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 42.6 t -60.7 -15.15 10.75 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 O-C-N 121.076 -1.015 . . . . 0.0 109.265 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -79.64 -47.66 7.15 Favored Glycine 0 N--CA 1.49 2.265 0 C-N-CA 119.786 -1.197 . . . . 0.0 110.682 -179.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.55 ' C ' HE21 ' A' ' 71' ' ' GLN . 0.0 OUTLIER -69.6 -29.84 67.46 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.699 -1.471 . . . . 0.0 107.532 179.894 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 4.7 mt -73.46 -34.34 42.46 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 176.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -63.28 -56.11 19.22 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.445 -0.784 . . . . 0.0 109.694 -179.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -62.2 -29.09 70.14 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.225 -0.922 . . . . 0.0 109.354 -179.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.31 -29.59 62.8 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 120.642 -1.286 . . . . 0.0 108.229 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.69 -33.84 66.84 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 106.211 -1.774 . . . . 0.0 106.211 178.161 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.1 tptt -68.4 -46.79 69.03 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.301 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.8 mp -57.4 -35.1 69.6 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.484 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -63.74 -50.1 70.41 Favored 'General case' 0 C--N 1.297 -1.705 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 178.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.474 HD22 ' HG2' ' A' ' 27' ' ' LYS . 1.9 t-20 -74.87 -13.07 60.51 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.494 -0.753 . . . . 0.0 111.616 -178.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -93.84 -9.23 38.04 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 120.606 -1.309 . . . . 0.0 110.205 -179.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 97.35 12.65 47.78 Favored Glycine 0 N--CA 1.499 2.854 0 O-C-N 121.032 -1.042 . . . . 0.0 110.592 178.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.4 mmtp -95.08 81.24 3.66 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.044 -1.268 . . . . 0.0 108.127 179.235 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 53.1 t -76.51 -61.83 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.414 -178.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.3 mtmm -49.81 -34.95 21.13 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.03 -1.044 . . . . 0.0 108.427 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.611 ' CD ' ' H ' ' A' ' 86' ' ' GLU . 29.8 mp0 -68.27 -45.8 72.17 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 178.216 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.13 -46.52 73.86 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 119.463 -0.895 . . . . 0.0 108.871 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.474 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -59.71 -51.88 67.9 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 179.456 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.24 -33.85 71.5 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 120.902 -1.124 . . . . 0.0 108.338 179.049 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -66.35 -26.95 67.52 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 178.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -56.64 -47.45 79.7 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 178.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -64.72 -22.79 67.06 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 178.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.705 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -72.93 -39.59 66.14 Favored 'General case' 0 N--CA 1.485 1.275 0 N-CA-C 106.18 -1.785 . . . . 0.0 106.18 177.908 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.433 ' CD1' ' OE1' ' A' ' 71' ' ' GLN . 3.9 mp -63.46 -50.63 68.96 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 178.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 4.5 mtpp -50.33 -42.53 52.97 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 178.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 5.3 m -70.88 -40.95 71.95 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.34 -0.85 . . . . 0.0 109.034 179.048 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -61.15 -40.43 93.84 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 72.9 mt -54.94 -33.15 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -59.32 -50.82 72.52 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 119.656 -0.818 . . . . 0.0 109.564 -179.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.66 -34.91 78.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.824 -1.172 . . . . 0.0 108.619 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.489 ' CD1' ' C ' ' A' ' 101' ' ' TYR . 1.1 t80 -68.09 -26.11 65.66 Favored 'General case' 0 C--N 1.293 -1.871 0 O-C-N 120.579 -1.326 . . . . 0.0 107.829 179.131 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.527 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -65.92 -34.91 79.21 Favored 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 119.162 -1.015 . . . . 0.0 110.057 -179.442 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.576 HE21 ' N ' ' A' ' 104' ' ' LYS . 1.1 pp0? -65.68 -21.83 66.58 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 104.759 -2.311 . . . . 0.0 104.759 178.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.576 ' N ' HE21 ' A' ' 103' ' ' GLN . 0.0 OUTLIER -79.5 -33.9 41.74 Favored 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 176.849 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.549 ' CD1' ' C ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -94.1 3.14 55.72 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.122 -0.986 . . . . 0.0 108.442 179.016 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.52 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.491 2.36 0 CA-C-O 118.049 -1.417 . . . . 0.0 109.625 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -87.28 -15.69 37.33 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.483 -0.761 . . . . 0.0 109.088 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 44.4 mt -88.93 -50.08 6.41 Favored 'General case' 0 C--N 1.295 -1.771 0 CA-C-O 121.556 0.694 . . . . 0.0 109.172 -179.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.796 ' CD ' ' CB ' ' A' ' 4' ' ' GLU . . . -65.75 -26.34 67.68 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 178.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -76.87 -45.14 29.35 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.701 -179.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.575 HD22 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -52.33 -46.8 66.21 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 -179.19 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.575 ' N ' HD22 ' A' ' 6' ' ' ASN . 10.8 m95 -51.73 -57.76 8.33 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 179.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -58.5 -29.54 66.33 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 178.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.0 m -69.03 -55.41 10.91 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 119.328 -0.949 . . . . 0.0 108.986 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.8 mt -53.68 -40.82 66.27 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 106.845 -1.539 . . . . 0.0 106.845 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -68.21 -60.94 2.09 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 120.058 -0.657 . . . . 0.0 109.678 178.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -58.59 -13.6 6.14 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.394 -0.816 . . . . 0.0 110.153 -179.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.411 ' ND2' ' HG2' ' A' ' 33' ' ' MET . 4.8 m-20 -75.72 -54.69 6.55 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 179.331 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.4 mt -56.37 -28.58 59.59 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.296 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.2 ttpt -71.97 -42.71 66.22 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 120.802 -1.186 . . . . 0.0 108.942 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.573 ' O ' ' N ' ' A' ' 20' ' ' ALA . 72.5 t -59.33 -24.56 28.21 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.538 0 C-N-CA 119.323 -0.951 . . . . 0.0 109.256 -179.41 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.456 ' O ' ' N ' ' A' ' 20' ' ' ALA . 10.4 mt -70.94 -72.19 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.171 -0.956 . . . . 0.0 109.669 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -46.55 -28.3 1.38 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.249 -0.907 . . . . 0.0 109.139 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.69 1.98 32.55 Favored 'General case' 0 N--CA 1.504 2.234 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 179.082 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.573 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -57.08 -47.5 80.86 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.897 -1.127 . . . . 0.0 108.011 179.273 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.484 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 0.5 OUTLIER 67.13 -13.51 0.2 Allowed 'General case' 0 C--N 1.297 -1.711 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.728 179.659 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.649 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -146.17 146.41 30.82 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 120.842 -1.161 . . . . 0.0 110.029 179.043 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -58.62 -24.11 60.36 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.863 -0.523 . . . . 0.0 110.966 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.3 -51.29 64.21 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.0 -1.063 . . . . 0.0 110.017 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.519 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 7.0 mt-30 -69.33 -18.31 63.8 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.194 -0.941 . . . . 0.0 110.473 -179.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.552 HG12 ' HB2' ' A' ' 79' ' ' ALA . 61.6 t -71.17 -49.04 51.32 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 120.887 -1.133 . . . . 0.0 108.337 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.491 ' HG2' HD22 ' A' ' 80' ' ' ASN . 8.4 mtpt -56.53 -55.26 35.99 Favored 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 106.754 -1.573 . . . . 0.0 106.754 179.024 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -51.13 -40.12 57.78 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 114.675 -1.148 . . . . 0.0 109.244 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.02 -63.33 1.08 Allowed 'General case' 0 C--N 1.3 -1.549 0 O-C-N 121.387 -0.821 . . . . 0.0 109.402 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.484 HD23 ' SD ' ' A' ' 33' ' ' MET . 86.7 mt -62.95 -24.54 67.93 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.249 -0.907 . . . . 0.0 109.68 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.474 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 53.6 m -61.19 -39.68 91.09 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.942 -1.099 . . . . 0.0 108.344 179.284 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 39.3 mtpt -74.0 -30.68 62.59 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . 0.484 ' SD ' HD23 ' A' ' 30' ' ' LEU . 34.5 mtp -66.23 -73.15 0.14 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.106 -0.996 . . . . 0.0 109.293 178.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.693 HH21 ' CB ' ' A' ' 73' ' ' ASP . 0.0 OUTLIER -46.04 -26.47 0.74 Allowed 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -179.168 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.402 ' N ' ' C ' ' A' ' 33' ' ' MET . . . -73.42 -63.36 1.21 Allowed 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 119.896 -0.722 . . . . 0.0 109.36 179.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.43 -28.0 69.5 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.073 -1.017 . . . . 0.0 109.426 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.35 -45.51 93.21 Favored 'General case' 0 N--CA 1.487 1.421 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 14.8 mt -65.77 -24.25 66.9 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 179.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -83.15 -47.86 11.16 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 179.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.44 ' O ' ' HB2' ' A' ' 43' ' ' ALA . . . -60.0 -9.78 3.48 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.389 -0.819 . . . . 0.0 109.465 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.478 ' C ' ' NE2' ' A' ' 41' ' ' GLN . 1.3 tm0? -50.76 -57.1 9.17 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 120.683 -1.26 . . . . 0.0 108.017 179.233 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.423 ' HD3' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -74.32 32.2 0.09 Allowed 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.785 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.458 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -77.3 137.91 39.06 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.969 -1.082 . . . . 0.0 109.992 -179.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.63 ' N ' ' CD ' ' A' ' 45' ' ' PRO . 12.4 t -156.91 40.05 0.1 Allowed Pre-proline 0 N--CA 1.489 1.509 0 O-C-N 121.529 -0.732 . . . . 0.0 110.188 179.059 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.63 ' CD ' ' N ' ' A' ' 44' ' ' THR . 6.0 Cg_exo -45.28 -36.01 12.08 Favored 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 122.484 2.123 . . . . 0.0 113.923 178.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.48 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 46.7 Cg_endo -95.06 -12.93 0.79 Allowed 'Trans proline' 0 C--N 1.321 -0.872 0 C-N-CA 122.497 2.131 . . . . 0.0 111.333 -178.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.497 ' O ' ' NZ ' ' A' ' 51' ' ' LYS . 10.7 mtpt 82.89 105.93 0.06 Allowed 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.494 HD21 ' CZ ' ' A' ' 61' ' ' PHE . 1.1 mt -79.59 4.38 16.09 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.361 -0.837 . . . . 0.0 108.971 -179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -98.55 18.79 15.86 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -147.0 42.59 1.13 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.801 -0.562 . . . . 0.0 110.067 -179.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.497 ' NZ ' ' O ' ' A' ' 47' ' ' LYS . 9.9 ptpp? -171.3 -143.07 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 108.636 -0.875 . . . . 0.0 108.636 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 28.5 t -76.74 116.28 55.38 Favored Pre-proline 0 N--CA 1.485 1.295 0 O-C-N 120.658 -1.276 . . . . 0.0 109.431 179.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -85.76 -12.35 6.34 Favored 'Trans proline' 0 N--CA 1.492 1.402 0 C-N-CA 122.359 2.039 . . . . 0.0 111.471 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.427 ' OD1' ' N ' ' A' ' 54' ' ' ASP . 1.2 m-20 65.89 -126.73 0.29 Allowed 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 -178.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.704 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 0.7 OUTLIER -170.43 -37.44 0.0 OUTLIER Pre-proline 0 N--CA 1.488 1.442 0 O-C-N 120.614 -1.304 . . . . 0.0 111.972 -179.904 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.704 ' CD ' ' H ' ' A' ' 55' ' ' SER . 86.8 Cg_exo -54.02 48.56 0.03 OUTLIER 'Trans proline' 0 N--CA 1.504 2.118 0 C-N-CA 122.756 2.304 . . . . 0.0 113.606 -179.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.652 ' N ' ' O ' ' A' ' 55' ' ' SER . 1.2 mp0 45.58 29.71 0.67 Allowed 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 -179.15 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.447 ' O ' ' N ' ' A' ' 61' ' ' PHE . 7.6 mtm 63.73 -6.59 0.23 Allowed 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -178.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.567 ' H ' ' C ' ' A' ' 57' ' ' GLU . 0.0 OUTLIER -48.37 -39.23 21.57 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 122.065 0.936 . . . . 0.0 108.921 178.929 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.42 -21.32 64.01 Favored 'General case' 0 C--N 1.289 -2.05 0 O-C-N 121.365 -0.834 . . . . 0.0 108.868 -179.318 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.494 ' CZ ' HD21 ' A' ' 48' ' ' LEU . 3.0 t80 -74.94 -54.35 7.37 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.296 -0.877 . . . . 0.0 109.632 179.031 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.452 ' CD ' ' H ' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -65.4 -33.82 76.85 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.994 -1.066 . . . . 0.0 108.791 179.838 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.427 ' O ' ' N ' ' A' ' 67' ' ' ILE . 1.9 t60 -58.15 -38.91 77.52 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.83 -31.84 82.26 Favored Glycine 0 N--CA 1.483 1.823 0 N-CA-C 108.309 -1.917 . . . . 0.0 108.309 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 54.2 m-85 -82.39 -39.27 22.94 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.316 -1.108 . . . . 0.0 108.145 178.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -70.45 -47.04 62.58 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 178.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.427 ' N ' ' O ' ' A' ' 63' ' ' HIS . 4.7 mm -55.38 -42.57 67.77 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.357 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 178.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 11.7 tp -57.39 -46.23 83.67 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 179.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.449 HG13 ' CG ' ' A' ' 34' ' ' ARG . 37.7 t -59.99 -12.91 4.59 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.472 0 O-C-N 121.098 -1.001 . . . . 0.0 108.659 179.176 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -77.4 -44.03 14.26 Favored Glycine 0 N--CA 1.487 2.067 0 C-N-CA 119.812 -1.185 . . . . 0.0 110.597 -179.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.448 ' C ' ' CD ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -76.48 -37.81 56.26 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.889 -1.359 . . . . 0.0 107.555 179.528 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 51.9 mt -68.05 -29.48 44.83 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 N-CA-C 107.015 -1.476 . . . . 0.0 107.015 177.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.693 ' CB ' HH21 ' A' ' 34' ' ' ARG . 0.0 OUTLIER -63.17 -51.65 65.56 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.441 -0.787 . . . . 0.0 109.527 179.777 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -64.18 -32.01 73.43 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.106 -0.996 . . . . 0.0 109.787 -179.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.1 -37.76 64.05 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 120.741 -1.224 . . . . 0.0 108.814 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.95 -27.98 47.77 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 178.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.2 tptt -69.66 -47.23 64.05 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-O 121.667 0.746 . . . . 0.0 109.198 178.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.1 mp -58.69 -32.03 68.77 Favored 'General case' 0 C--N 1.306 -1.294 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.552 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -65.46 -52.83 50.24 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.491 HD22 ' HG2' ' A' ' 27' ' ' LYS . 2.0 t-20 . . . . . 0 N--CA 1.488 1.426 0 O-C-N 121.54 -0.725 . . . . 0.0 . -178.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.214 -0.78 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 98.27 15.22 36.18 Favored Glycine 0 N--CA 1.499 2.896 0 O-C-N 121.189 -0.944 . . . . 0.0 110.796 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 33.9 mmtt -98.57 84.21 3.13 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.071 -1.252 . . . . 0.0 108.675 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 53.6 t -75.33 -63.9 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 -179.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.527 ' HD3' ' H ' ' A' ' 85' ' ' LYS . 0.8 OUTLIER -47.88 -37.31 13.81 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.499 -0.75 . . . . 0.0 109.065 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -68.37 -44.18 75.75 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 178.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.52 -47.01 68.08 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.948 0.88 . . . . 0.0 109.046 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.528 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -56.26 -54.14 48.9 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 179.734 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -56.19 -41.58 75.75 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.069 -1.02 . . . . 0.0 108.906 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.576 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -61.25 -35.85 78.37 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 178.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -47.53 -43.69 25.1 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.059 -1.026 . . . . 0.0 108.717 179.123 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -63.1 -26.82 69.0 Favored 'General case' 0 N--CA 1.485 1.313 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 178.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.694 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -72.48 -38.99 68.05 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 106.492 -1.67 . . . . 0.0 106.492 177.615 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.464 HD12 ' N ' ' A' ' 94' ' ' LEU . 11.1 mp -65.74 -40.48 92.16 Favored 'General case' 0 C--N 1.307 -1.264 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 3.9 mtpt -55.06 -38.24 67.77 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 178.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 6.8 m -69.3 -30.74 68.88 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.477 -0.765 . . . . 0.0 108.945 178.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -60.96 -41.92 97.29 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 18.8 mt -51.6 -38.97 22.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -51.2 61.69 Favored 'General case' 0 C--N 1.302 -1.489 0 C-N-CA 119.152 -1.019 . . . . 0.0 109.057 179.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.35 -21.71 66.71 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.034 -1.042 . . . . 0.0 109.067 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.535 ' OH ' ' CE1' ' A' ' 105' ' ' TYR . 10.5 t80 -72.92 -32.89 65.61 Favored 'General case' 0 C--N 1.298 -1.674 0 N-CA-C 107.327 -1.361 . . . . 0.0 107.327 179.168 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.533 ' ND2' ' O ' ' A' ' 102' ' ' ASN . 0.3 OUTLIER -64.1 -30.48 71.55 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 178.327 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.633 ' NE2' ' N ' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -65.43 -27.21 68.37 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 104.95 -2.241 . . . . 0.0 104.95 177.931 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.633 ' N ' ' NE2' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -79.34 -47.25 16.12 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 105.414 -2.069 . . . . 0.0 105.414 176.489 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.535 ' CE1' ' OH ' ' A' ' 101' ' ' TYR . 0.6 OUTLIER -86.2 30.86 0.66 Allowed 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 177.191 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.495 2.578 0 CA-C-O 117.964 -1.465 . . . . 0.0 109.517 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 121.576 0.703 . . . . 0.0 109.678 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -85.24 -18.89 32.63 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.349 -0.844 . . . . 0.0 109.673 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 25.5 mt -88.5 -49.53 6.85 Favored 'General case' 0 C--N 1.296 -1.724 0 O-C-N 121.489 -0.757 . . . . 0.0 109.085 -179.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -62.83 -23.48 67.3 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 106.56 -1.644 . . . . 0.0 106.56 178.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.73 -53.22 9.64 Favored 'General case' 0 C--N 1.299 -1.622 0 C-N-CA 119.778 -0.769 . . . . 0.0 109.295 -179.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.597 HD22 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -53.71 -44.15 69.6 Favored 'General case' 0 N--CA 1.485 1.324 0 O-C-N 121.243 -0.911 . . . . 0.0 108.673 -179.306 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.597 ' N ' HD22 ' A' ' 6' ' ' ASN . 7.6 m95 -50.06 -54.43 20.35 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.103 -0.998 . . . . 0.0 109.241 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -53.7 -25.57 18.95 Favored 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.237 -0.914 . . . . 0.0 109.308 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.2 m -68.37 -65.06 0.75 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.073 -1.017 . . . . 0.0 110.059 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.652 ' H ' HD23 ' A' ' 10' ' ' LEU . 0.1 OUTLIER -60.27 -31.25 70.05 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 118.436 -1.305 . . . . 0.0 107.546 179.763 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -69.29 -55.19 11.21 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.982 -1.074 . . . . 0.0 108.487 178.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.428 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 42.7 t0 -61.01 -14.81 25.68 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.457 -0.777 . . . . 0.0 110.092 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.411 ' ND2' ' HG2' ' A' ' 33' ' ' MET . 3.9 m-20 -72.85 -47.62 44.61 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 178.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.677 HD13 ' HZ3' ' A' ' 95' ' ' LYS . 3.8 mt -57.07 -33.19 67.01 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.738 -178.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 6.4 ttpp -68.32 -42.86 78.74 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 118.862 -1.135 . . . . 0.0 108.563 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.556 ' O ' ' N ' ' A' ' 20' ' ' ALA . 57.3 t -57.87 -24.47 23.27 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 O-C-N 121.304 -0.873 . . . . 0.0 109.379 -179.502 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.489 ' O ' ' N ' ' A' ' 20' ' ' ALA . 12.1 mt -71.31 -72.99 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 121.165 -0.96 . . . . 0.0 110.318 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -46.72 -27.63 1.25 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.941 -1.099 . . . . 0.0 108.985 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -102.52 0.97 34.4 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 179.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.556 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -58.23 -39.36 78.86 Favored 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 178.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.5 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 9.3 m-20 59.13 -11.0 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.059 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.62 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -147.86 143.28 27.32 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.549 -1.345 . . . . 0.0 110.11 178.949 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.51 -20.58 32.35 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.779 -0.576 . . . . 0.0 111.488 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.08 -50.55 61.32 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.718 -1.239 . . . . 0.0 109.72 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.426 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 4.2 mt-30 -70.22 -19.46 63.15 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.336 -0.853 . . . . 0.0 110.597 -179.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.5 HG12 ' HB2' ' A' ' 79' ' ' ALA . 48.7 t -70.26 -47.27 67.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 120.883 -1.136 . . . . 0.0 108.606 -179.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.467 ' HG2' HD22 ' A' ' 80' ' ' ASN . 8.2 mtpt -55.5 -55.66 29.3 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 106.407 -1.701 . . . . 0.0 106.407 178.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -52.99 -34.08 54.51 Favored 'General case' 0 C--N 1.298 -1.664 0 CA-C-N 114.447 -1.251 . . . . 0.0 109.758 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.61 -65.83 0.65 Allowed 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.26 -0.9 . . . . 0.0 109.54 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.736 HD23 ' SD ' ' A' ' 33' ' ' MET . 53.9 mt -61.9 -18.65 60.96 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.318 -0.864 . . . . 0.0 109.972 -179.467 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.4 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 42.8 m -62.65 -51.31 67.74 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.055 -1.028 . . . . 0.0 109.259 179.453 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -69.74 -24.73 63.58 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.663 -0.648 . . . . 0.0 109.307 -179.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . 0.736 ' SD ' HD23 ' A' ' 30' ' ' LEU . 69.1 mtp -66.43 -61.82 1.79 Allowed 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.188 -1.041 . . . . 0.0 108.188 178.389 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.54 ' HE ' HG12 ' A' ' 69' ' ' VAL . 0.1 OUTLIER -47.67 -27.94 2.16 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 179.622 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.86 -66.18 0.82 Allowed 'General case' 0 N--CA 1.488 1.452 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.93 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.71 -30.33 71.34 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.898 -1.126 . . . . 0.0 110.033 -179.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.45 -43.19 93.22 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.052 -1.03 . . . . 0.0 108.502 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 28.3 mt -66.33 -22.12 66.27 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.321 -0.862 . . . . 0.0 108.758 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -83.47 -45.09 14.02 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.216 -0.927 . . . . 0.0 109.739 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.502 ' O ' ' HB3' ' A' ' 43' ' ' ALA . . . -55.2 -22.54 18.02 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.154 -0.966 . . . . 0.0 108.987 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -48.28 -51.34 26.24 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.312 -0.868 . . . . 0.0 109.937 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.502 ' HD3' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -68.89 4.0 1.71 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.166 -0.959 . . . . 0.0 109.628 -179.575 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.502 ' HB3' ' O ' ' A' ' 40' ' ' ALA . . . -82.43 149.42 27.64 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.013 -1.054 . . . . 0.0 110.234 -179.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 p -151.34 69.61 8.16 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.358 -0.839 . . . . 0.0 108.778 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.444 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 50.1 Cg_exo -45.77 -38.99 18.25 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 C-N-CA 122.647 2.232 . . . . 0.0 114.272 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.444 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 88.6 Cg_endo -98.68 -94.33 0.0 OUTLIER 'Trans proline' 0 C--N 1.318 -1.047 0 C-N-CA 122.447 2.098 . . . . 0.0 112.732 -178.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.57 117.26 0.42 Allowed 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 -179.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.547 ' O ' HD23 ' A' ' 48' ' ' LEU . 1.1 tt -81.77 0.91 37.0 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 120.953 -1.092 . . . . 0.0 108.721 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 66.5 mt-10 -99.07 30.59 3.36 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 177.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -147.65 -53.72 0.21 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.65 -0.656 . . . . 0.0 110.496 -178.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -65.23 -161.03 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.071 -1.018 . . . . 0.0 109.388 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 28.1 t -73.95 120.99 84.08 Favored Pre-proline 0 N--CA 1.488 1.457 0 O-C-N 120.804 -1.185 . . . . 0.0 109.352 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -83.32 -22.92 3.72 Favored 'Trans proline' 0 N--CA 1.494 1.507 0 C-N-CA 122.201 1.934 . . . . 0.0 111.899 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.8 t0 64.63 -137.72 0.26 Allowed 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.691 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 0.2 OUTLIER -161.83 -38.92 0.0 OUTLIER Pre-proline 0 N--CA 1.495 1.806 0 O-C-N 120.339 -1.476 . . . . 0.0 112.158 -179.383 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.691 ' CD ' ' H ' ' A' ' 55' ' ' SER . 67.0 Cg_exo -49.21 70.32 0.01 OUTLIER 'Trans proline' 0 N--CA 1.503 2.085 0 C-N-CA 122.7 2.267 . . . . 0.0 114.374 -178.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.571 ' N ' ' O ' ' A' ' 55' ' ' SER . 91.4 mt-10 39.47 32.22 0.08 Allowed 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.678 -0.639 . . . . 0.0 109.308 179.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.47 ' SD ' ' C ' ' A' ' 57' ' ' GLU . 0.9 OUTLIER 64.73 -8.7 0.21 Allowed 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 -178.46 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.572 ' N ' ' O ' ' A' ' 56' ' ' PRO . 0.6 OUTLIER -48.26 -45.56 34.65 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-O 121.916 0.865 . . . . 0.0 108.93 178.962 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.12 -28.9 27.93 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -179.457 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -74.3 -54.37 7.8 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 177.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.38 -29.06 68.69 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.494 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.624 ' NE2' HD11 ' A' ' 67' ' ' ILE . 2.1 t60 -62.68 -36.75 83.93 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 178.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -63.8 -28.23 72.34 Favored Glycine 0 N--CA 1.487 2.085 0 N-CA-C 107.794 -2.122 . . . . 0.0 107.794 178.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.428 ' O ' HG23 ' A' ' 69' ' ' VAL . 26.8 m-85 -81.86 -41.03 21.58 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 177.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -73.14 -45.99 53.55 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.624 HD11 ' NE2' ' A' ' 63' ' ' HIS . 19.7 mm -56.69 -48.57 80.59 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.414 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.704 HD13 ' C ' ' A' ' 68' ' ' LEU . 2.3 tm? -58.01 -45.04 87.52 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 179.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.54 HG12 ' HE ' ' A' ' 34' ' ' ARG . 26.3 t -60.94 -11.4 4.15 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 179.031 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -76.16 -42.05 25.03 Favored Glycine 0 N--CA 1.487 2.065 0 N-CA-C 109.347 -1.501 . . . . 0.0 109.347 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.504 ' O ' ' NE2' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -67.61 -29.69 69.09 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 178.63 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.57 HG23 HD22 ' A' ' 30' ' ' LEU . 46.8 mt -75.91 -32.9 24.28 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.454 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 176.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -59.35 -54.39 47.3 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 121.593 0.711 . . . . 0.0 109.423 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -63.97 -28.81 70.07 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.292 -0.88 . . . . 0.0 109.29 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.65 -32.97 66.27 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 120.807 -1.183 . . . . 0.0 108.355 179.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.77 -32.95 63.9 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 178.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.9 tptt -66.39 -45.51 79.76 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 mp -58.3 -31.72 67.78 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.5 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -64.91 -51.33 62.48 Favored 'General case' 0 C--N 1.3 -1.545 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 177.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.467 HD22 ' HG2' ' A' ' 27' ' ' LYS . 1.9 t-20 -73.33 -11.95 60.67 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.475 -0.766 . . . . 0.0 111.16 -179.055 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -93.79 -11.04 32.18 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 120.719 -1.238 . . . . 0.0 109.556 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.93 11.3 53.55 Favored Glycine 0 N--CA 1.498 2.769 0 N-CA-C 110.654 -0.978 . . . . 0.0 110.654 179.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 39.7 mmtt -94.65 82.13 3.92 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.952 -1.322 . . . . 0.0 108.842 179.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 43.5 t -77.38 -51.22 18.84 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.676 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 -179.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.0 mtmp? -54.15 -39.61 66.67 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.065 -1.022 . . . . 0.0 108.542 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -69.75 -40.97 75.82 Favored 'General case' 0 N--CA 1.486 1.33 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 178.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.66 -51.32 57.48 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 119.528 -0.869 . . . . 0.0 109.114 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.547 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -60.08 -46.37 89.81 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 179.383 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -55.11 -34.29 63.57 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 120.957 -1.089 . . . . 0.0 108.109 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.402 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -65.97 -28.71 69.1 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 107.216 -1.402 . . . . 0.0 107.216 178.118 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.547 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -50.52 -48.67 57.0 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 178.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.492 ' OE1' ' N ' ' A' ' 92' ' ' GLU . 14.1 mp0 -67.15 -22.1 65.79 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.292 -0.88 . . . . 0.0 109.34 178.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.703 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -71.04 -35.27 71.91 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 105.508 -2.034 . . . . 0.0 105.508 177.164 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.509 HD22 HD21 ' A' ' 14' ' ' LEU . 7.2 mp -70.94 -39.92 72.35 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 178.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . 0.677 ' HZ3' HD13 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -45.54 -40.45 8.67 Favored 'General case' 0 N--CA 1.498 1.973 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 178.766 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 53.4 m -72.72 -31.32 64.89 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.707 -0.621 . . . . 0.0 109.987 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.467 ' N ' ' O ' ' A' ' 94' ' ' LEU . 1.2 m -56.85 -43.63 81.36 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 49.8 mt -54.79 -46.36 74.68 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.498 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 51.7 ttt180 -62.28 -55.0 32.65 Favored 'General case' 0 C--N 1.308 -1.21 0 O-C-N 121.184 -0.947 . . . . 0.0 110.229 -179.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.54 -28.08 69.07 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.79 -1.194 . . . . 0.0 108.698 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.458 ' CD1' ' C ' ' A' ' 101' ' ' TYR . 3.4 t80 -70.86 -30.49 66.9 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 178.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.54 ' ND2' ' O ' ' A' ' 102' ' ' ASN . 0.1 OUTLIER -64.34 -32.0 73.43 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 119.013 -1.075 . . . . 0.0 108.536 179.416 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.511 ' NE2' ' N ' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -63.99 -26.0 68.38 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 105.105 -2.183 . . . . 0.0 105.105 177.854 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.511 ' N ' ' NE2' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -84.0 -32.46 24.94 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.123 -0.944 . . . . 0.0 108.663 178.012 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.54 ' CD1' ' C ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -95.11 0.82 54.66 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.108 -0.995 . . . . 0.0 109.173 -179.266 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.51 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.494 2.509 0 CA-C-O 117.927 -1.485 . . . . 0.0 109.742 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.594 0 CA-C-O 121.523 0.677 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -83.09 -12.67 56.86 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.348 -0.845 . . . . 0.0 109.177 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 70.2 mt -87.57 -52.5 5.31 Favored 'General case' 0 C--N 1.296 -1.743 0 O-C-N 121.656 -0.653 . . . . 0.0 109.392 -178.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -62.98 -23.72 67.57 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 179.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.52 -51.87 18.11 Favored 'General case' 0 C--N 1.297 -1.709 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.635 ' OD1' ' HB2' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -50.61 -40.9 54.08 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 -179.872 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.545 ' N ' HD22 ' A' ' 6' ' ' ASN . 7.0 m95 -51.94 -52.46 50.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.198 -0.939 . . . . 0.0 108.865 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -55.98 -28.58 57.73 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 120.719 -1.238 . . . . 0.0 108.919 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 10.4 m -69.52 -64.67 0.83 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.168 -0.958 . . . . 0.0 109.986 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.6 pp -57.02 -30.8 64.51 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.65 -1.282 . . . . 0.0 107.922 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.28 -55.32 8.28 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.912 -1.118 . . . . 0.0 108.349 178.144 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -58.57 -14.15 7.43 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.501 -0.749 . . . . 0.0 109.551 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.496 ' O ' HG22 ' A' ' 16' ' ' VAL . 1.6 m-20 -73.12 -50.11 24.62 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 179.34 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.3 mt -56.86 -30.01 63.43 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.829 -0.544 . . . . 0.0 111.087 -178.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -69.11 -51.39 39.05 Favored 'General case' 0 C--N 1.3 -1.581 0 C-N-CA 118.539 -1.264 . . . . 0.0 109.727 -179.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.624 ' O ' ' N ' ' A' ' 20' ' ' ALA . 15.4 m -55.74 -20.92 9.22 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 C-N-CA 118.458 -1.297 . . . . 0.0 110.105 -179.35 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.445 ' O ' ' N ' ' A' ' 20' ' ' ALA . 11.5 mt -70.16 -73.51 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 O-C-N 120.442 -1.412 . . . . 0.0 108.947 179.085 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -46.94 -28.66 1.69 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.311 -0.868 . . . . 0.0 109.007 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.37 1.46 35.5 Favored 'General case' 0 N--CA 1.496 1.867 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.624 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -56.9 -44.11 82.02 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 107.453 -1.314 . . . . 0.0 107.453 179.473 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.48 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 0.4 OUTLIER 67.76 -15.02 0.2 Allowed 'General case' 0 C--N 1.297 -1.678 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.949 179.437 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.647 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -148.21 142.79 26.51 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.653 -1.279 . . . . 0.0 110.051 178.576 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.86 -21.22 10.71 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.987 -0.446 . . . . 0.0 111.463 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.34 -52.13 55.94 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.857 -1.152 . . . . 0.0 109.601 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.501 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 5.4 mt-30 -69.76 -18.31 63.49 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.281 -0.887 . . . . 0.0 110.425 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.524 HG12 ' HB2' ' A' ' 79' ' ' ALA . 57.6 t -70.02 -48.95 59.87 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 O-C-N 120.925 -1.109 . . . . 0.0 108.388 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.474 ' HG2' HD22 ' A' ' 80' ' ' ASN . 7.0 mtpt -56.27 -55.12 37.27 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 178.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -50.78 -37.46 42.5 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-N 114.711 -1.132 . . . . 0.0 109.45 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.73 -68.71 0.39 Allowed 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.335 -0.853 . . . . 0.0 110.042 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 95.9 mt -60.28 -20.87 60.87 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.379 -0.826 . . . . 0.0 109.696 -179.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.463 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 7.8 m -62.42 -45.64 92.2 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.096 -1.002 . . . . 0.0 108.523 179.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 40.9 mtmt -72.81 -27.16 61.8 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.764 -0.585 . . . . 0.0 109.475 -179.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 29.5 mtp -63.98 -67.93 0.39 Allowed 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 178.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 15.8 ttt-85 -47.11 -26.4 1.09 Allowed 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.67 -57.9 3.61 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 120.009 -0.676 . . . . 0.0 109.344 178.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.25 -39.93 95.99 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.111 -0.993 . . . . 0.0 110.078 -179.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.92 -39.02 71.04 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.019 -1.051 . . . . 0.0 108.891 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 26.5 mt -66.01 -33.78 76.58 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.23 -0.919 . . . . 0.0 108.937 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -86.33 -41.94 14.12 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.096 -1.003 . . . . 0.0 109.549 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.635 ' HB2' ' OD1' ' A' ' 6' ' ' ASN . . . -58.84 -14.53 9.16 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.318 -0.864 . . . . 0.0 109.761 -179.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.45 ' C ' ' H ' ' A' ' 43' ' ' ALA . 2.2 tm0? -48.49 -51.57 26.57 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 120.963 -1.086 . . . . 0.0 109.692 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.465 ' HD3' ' H ' ' A' ' 42' ' ' LYS . 2.1 mppt? -71.0 14.24 0.16 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.345 -0.847 . . . . 0.0 109.706 -179.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.45 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -78.04 151.27 33.58 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.887 -1.133 . . . . 0.0 108.719 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -152.31 69.18 7.38 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.171 -0.956 . . . . 0.0 109.564 -179.392 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.442 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 33.3 Cg_exo -49.31 -40.05 43.54 Favored 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.586 2.191 . . . . 0.0 113.878 178.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.442 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 69.7 Cg_endo -95.98 -14.58 0.51 Allowed 'Trans proline' 0 N--CA 1.483 0.862 0 C-N-CA 122.467 2.111 . . . . 0.0 112.635 -178.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 43.3 mttm 71.83 101.69 0.07 Allowed 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.8 mp -84.33 22.98 1.15 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.122 -0.986 . . . . 0.0 108.791 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -107.04 26.41 10.17 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 107.416 -1.327 . . . . 0.0 107.416 178.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -144.26 -59.5 0.38 Allowed 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 -179.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -65.99 -162.96 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.585 0 O-C-N 121.325 -0.859 . . . . 0.0 108.888 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.3 t -75.11 145.12 80.14 Favored Pre-proline 0 N--CA 1.485 1.313 0 O-C-N 120.722 -1.236 . . . . 0.0 109.029 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.448 ' O ' ' CB ' ' A' ' 54' ' ' ASP . 43.4 Cg_endo -80.78 -14.57 11.19 Favored 'Trans proline' 0 N--CA 1.499 1.835 0 C-N-CA 122.719 2.28 . . . . 0.0 112.309 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.448 ' CB ' ' O ' ' A' ' 53' ' ' PRO . 10.3 t0 76.27 -143.99 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.825 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 40.4 t -162.36 -26.62 0.0 OUTLIER Pre-proline 0 N--CA 1.495 1.817 0 O-C-N 120.379 -1.451 . . . . 0.0 113.801 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.825 ' CD ' ' H ' ' A' ' 55' ' ' SER . 73.2 Cg_exo -56.43 40.91 0.04 OUTLIER 'Trans proline' 0 N--CA 1.503 2.043 0 C-N-CA 121.981 1.788 . . . . 0.0 113.021 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.648 ' N ' ' O ' ' A' ' 55' ' ' SER . 7.1 tp10 49.87 25.56 1.64 Allowed 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 -178.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.51 ' O ' ' N ' ' A' ' 61' ' ' PHE . 2.1 mtp 63.95 -5.08 0.32 Allowed 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 -177.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.566 ' H ' ' C ' ' A' ' 57' ' ' GLU . 0.5 OUTLIER -46.59 -50.37 17.52 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.346 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -54.03 -24.91 18.77 Favored 'General case' 0 C--N 1.297 -1.693 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.51 ' N ' ' O ' ' A' ' 58' ' ' MET . 3.8 t80 -77.25 -54.18 6.8 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 107.134 -1.432 . . . . 0.0 107.134 177.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.8 mtt-85 -62.54 -31.02 71.74 Favored 'General case' 0 N--CA 1.489 1.512 0 CA-C-O 121.328 0.585 . . . . 0.0 109.474 178.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.425 ' N ' ' O ' ' A' ' 59' ' ' LYS . 1.6 t60 -59.6 -40.89 88.99 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.67 -31.32 80.51 Favored Glycine 0 C--N 1.296 -1.649 0 N-CA-C 108.702 -1.759 . . . . 0.0 108.702 179.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -81.07 -41.46 22.55 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.055 -1.262 . . . . 0.0 108.062 178.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -71.26 -46.19 61.51 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 5.3 mm -55.78 -44.72 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 179.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 5.4 tp -58.04 -52.94 63.44 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.598 -0.689 . . . . 0.0 109.756 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 46.0 t -61.08 -15.76 12.9 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 O-C-N 121.281 -0.887 . . . . 0.0 110.692 -178.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -78.19 -43.79 12.72 Favored Glycine 0 N--CA 1.49 2.236 0 C-N-CA 119.25 -1.453 . . . . 0.0 110.382 -178.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.551 ' C ' HE21 ' A' ' 71' ' ' GLN . 0.0 OUTLIER -70.77 -30.8 67.38 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 120.681 -1.482 . . . . 0.0 107.429 179.47 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 27.9 mt -75.42 -30.11 21.94 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.558 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -59.87 -53.18 60.95 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 119.47 -0.892 . . . . 0.0 109.03 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.445 ' OD1' ' O ' ' A' ' 71' ' ' GLN . 0.4 OUTLIER -66.31 -32.53 73.99 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.071 -1.018 . . . . 0.0 109.297 179.909 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.44 -27.12 64.0 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 120.709 -1.245 . . . . 0.0 107.916 179.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.95 -34.15 67.75 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 105.797 -1.927 . . . . 0.0 105.797 177.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 9.2 tptt -69.73 -49.04 57.0 Favored 'General case' 0 C--N 1.305 -1.333 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.596 179.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 8.5 mp -55.1 -37.18 66.52 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.524 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -62.55 -50.29 71.9 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.313 -0.867 . . . . 0.0 108.902 178.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.474 HD22 ' HG2' ' A' ' 27' ' ' LYS . 1.9 t-20 -73.23 -12.37 60.84 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.504 -0.747 . . . . 0.0 111.389 -178.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -94.16 -9.57 35.96 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 120.672 -1.268 . . . . 0.0 109.58 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.67 11.29 54.0 Favored Glycine 0 N--CA 1.497 2.751 0 O-C-N 121.131 -0.981 . . . . 0.0 110.662 178.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 5.7 mmtp -94.21 83.26 4.22 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.921 -1.341 . . . . 0.0 108.464 179.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 57.9 t -77.55 -54.0 13.46 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.773 0 O-C-N 121.786 -0.571 . . . . 0.0 109.653 -179.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.479 ' HD3' ' H ' ' A' ' 85' ' ' LYS . 0.6 OUTLIER -53.42 -39.7 64.56 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 120.954 -1.092 . . . . 0.0 108.604 179.329 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -67.25 -42.33 84.13 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 178.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.412 ' O ' ' HB3' ' A' ' 90' ' ' ALA . . . -67.05 -51.87 49.23 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 119.564 -0.854 . . . . 0.0 109.1 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.522 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -59.95 -48.29 82.32 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 179.585 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -55.87 -33.42 64.56 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.412 ' HB3' ' O ' ' A' ' 87' ' ' ALA . . . -67.04 -27.58 67.51 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 178.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.522 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -53.06 -50.78 63.64 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 179.059 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -63.42 -24.65 67.93 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 178.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.683 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -75.23 -36.16 61.35 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 177.859 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.431 ' CD1' ' OE1' ' A' ' 71' ' ' GLN . 4.1 mp -64.78 -49.15 71.86 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 178.646 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -50.32 -42.92 53.49 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 24.4 m -71.32 -35.27 71.17 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.165 -0.96 . . . . 0.0 109.125 179.005 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.2 m -60.79 -44.89 96.24 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 179.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 86.2 mt -51.26 -37.89 18.77 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.374 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.2 tpm_? -56.27 -54.49 44.69 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-O 121.907 0.86 . . . . 0.0 109.571 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.491 ' O ' ' N ' ' A' ' 103' ' ' GLN . . . -63.37 -53.89 45.43 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 120.434 -1.416 . . . . 0.0 108.184 179.222 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.491 ' O ' ' CG ' ' A' ' 104' ' ' LYS . 0.6 OUTLIER -53.33 -21.75 6.16 Favored 'General case' 0 C--N 1.297 -1.688 0 O-C-N 120.697 -1.252 . . . . 0.0 107.724 179.366 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.543 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -65.85 -28.25 68.83 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 176.917 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.499 HE21 ' N ' ' A' ' 104' ' ' LYS . 1.4 pp0? -61.83 -18.93 61.84 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 105.358 -2.09 . . . . 0.0 105.358 178.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.499 ' N ' HE21 ' A' ' 103' ' ' GLN . 0.0 OUTLIER -79.63 -28.12 40.93 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 177.476 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.485 ' O ' ' CG ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -101.96 3.5 39.04 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 107.756 -1.201 . . . . 0.0 107.756 178.544 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.488 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.491 2.351 0 N-CA-C 109.312 -1.515 . . . . 0.0 109.312 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -85.28 -20.5 29.94 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.403 -0.811 . . . . 0.0 108.964 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 48.9 mt -89.57 -49.12 6.85 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -62.64 -22.29 66.33 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 178.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -72.99 -49.54 28.4 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.641 HD22 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -50.13 -44.17 52.2 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.207 -0.933 . . . . 0.0 108.683 -179.73 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.641 ' N ' HD22 ' A' ' 6' ' ' ASN . 16.2 m95 -54.7 -49.21 71.27 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.187 -0.946 . . . . 0.0 109.367 -179.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -55.41 -29.49 58.65 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 120.875 -1.14 . . . . 0.0 109.083 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 35.4 m -69.39 -65.46 0.71 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 119.289 -0.965 . . . . 0.0 109.789 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.1 pp -58.55 -28.86 65.88 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.776 -1.202 . . . . 0.0 108.566 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -71.74 -59.7 2.61 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.932 -1.105 . . . . 0.0 109.268 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -57.25 -13.77 3.58 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.45 -0.781 . . . . 0.0 109.378 -179.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -74.25 -54.27 8.04 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 13.4 mt -55.53 -27.55 49.48 Favored 'General case' 0 N--CA 1.49 1.548 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.574 -178.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 9.0 ttpp -70.16 -46.64 64.24 Favored 'General case' 0 C--N 1.298 -1.672 0 C-N-CA 118.919 -1.112 . . . . 0.0 108.569 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.523 ' O ' ' N ' ' A' ' 20' ' ' ALA . 71.9 t -55.84 -26.69 21.06 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.579 0 O-C-N 121.415 -0.803 . . . . 0.0 109.944 -179.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.526 ' O ' ' N ' ' A' ' 20' ' ' ALA . 7.1 mt -71.23 -71.25 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 O-C-N 121.053 -1.03 . . . . 0.0 110.468 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -46.75 -28.78 1.63 Allowed 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.931 -1.106 . . . . 0.0 108.789 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.43 ' O ' ' OD2' ' A' ' 21' ' ' ASP . 1.0 OUTLIER -99.96 -1.47 37.07 Favored 'General case' 0 N--CA 1.498 1.928 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 179.522 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.57 ' O ' ' NE2' ' A' ' 25' ' ' GLN . . . -58.26 -59.93 4.55 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.893 -1.129 . . . . 0.0 108.299 178.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.43 ' OD2' ' O ' ' A' ' 19' ' ' LYS . 1.4 m-20 69.55 -7.62 0.85 Allowed 'General case' 0 C--N 1.295 -1.765 0 O-C-N 121.75 -0.594 . . . . 0.0 110.566 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.57 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -142.96 143.05 31.8 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 120.724 -1.235 . . . . 0.0 109.569 178.048 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.94 -27.78 46.08 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.714 -0.616 . . . . 0.0 111.101 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.2 -51.61 62.9 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.029 -1.044 . . . . 0.0 110.887 -178.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.57 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 9.4 mt-30 -68.37 -24.07 64.75 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 120.955 -1.091 . . . . 0.0 110.884 -178.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.572 HG12 ' HB2' ' A' ' 79' ' ' ALA . 49.1 t -70.78 -47.74 61.58 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.036 0 O-C-N 120.693 -1.254 . . . . 0.0 108.99 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.458 ' HG2' HD22 ' A' ' 80' ' ' ASN . 12.7 mtpt -54.91 -55.11 34.11 Favored 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 106.376 -1.712 . . . . 0.0 106.376 179.048 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.474 ' N ' ' OD1' ' A' ' 28' ' ' ASP . 2.6 m-20 -52.14 -37.99 56.13 Favored 'General case' 0 C--N 1.296 -1.728 0 CA-C-N 114.33 -1.305 . . . . 0.0 109.574 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.81 -64.09 0.95 Allowed 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.357 -0.839 . . . . 0.0 110.333 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.406 ' HB3' HD12 ' A' ' 76' ' ' LEU . 90.0 mt -60.15 -23.37 63.87 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.165 -0.959 . . . . 0.0 109.955 -179.204 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 48.1 m -61.86 -46.11 90.87 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.036 -1.04 . . . . 0.0 108.93 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.481 ' O ' ' HB3' ' A' ' 35' ' ' ALA . 50.5 mttm -72.26 -28.71 63.3 Favored 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.809 -0.557 . . . . 0.0 109.623 -179.353 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . 0.416 ' C ' ' N ' ' A' ' 35' ' ' ALA . 48.6 mtp -65.36 -63.46 1.09 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.808 -1.183 . . . . 0.0 108.557 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.8 ttt-85 -50.06 -22.92 1.8 Allowed 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 32' ' ' LYS . . . -75.11 -58.7 3.12 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.414 ' O ' ' N ' ' A' ' 40' ' ' ALA . . . -62.89 -31.0 71.96 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.169 -0.957 . . . . 0.0 109.64 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.83 -44.12 90.85 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.165 -0.959 . . . . 0.0 108.82 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 17.2 mt -64.79 -32.24 73.83 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.366 -0.834 . . . . 0.0 109.227 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -84.69 -23.87 29.21 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.125 -0.984 . . . . 0.0 109.138 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.525 ' O ' ' HB3' ' A' ' 43' ' ' ALA . . . -61.8 -34.01 75.14 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.428 -0.795 . . . . 0.0 110.348 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.501 ' C ' ' H ' ' A' ' 43' ' ' ALA . 0.8 OUTLIER -40.33 -63.06 0.67 Allowed 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.33 -0.856 . . . . 0.0 110.077 -179.885 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 67.7 mmtt -57.62 1.05 0.04 OUTLIER 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.523 -0.736 . . . . 0.0 110.459 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' A' ' 40' ' ' ALA . . . -84.12 145.57 28.35 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.817 -1.177 . . . . 0.0 110.842 -179.151 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 m -159.37 90.22 1.96 Allowed Pre-proline 0 N--CA 1.49 1.544 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.417 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 23.3 Cg_exo -53.57 -43.68 55.63 Favored 'Trans proline' 0 N--CA 1.49 1.297 0 C-N-CA 121.601 1.534 . . . . 0.0 112.367 -179.105 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.417 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 96.6 Cg_endo -84.96 -90.6 0.0 OUTLIER 'Trans proline' 0 C--N 1.317 -1.087 0 C-N-CA 121.372 1.382 . . . . 0.0 110.574 178.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.7 pttt -176.6 122.23 0.15 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.076 -1.015 . . . . 0.0 109.829 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.452 ' C ' ' N ' ' A' ' 50' ' ' ASP . 0.7 OUTLIER -80.34 -174.71 4.73 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 178.575 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 50.74 18.83 0.53 Allowed 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.007 -1.058 . . . . 0.0 108.165 -179.147 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.452 ' N ' ' C ' ' A' ' 48' ' ' LEU . 33.4 m-20 -148.61 -55.0 0.19 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.733 -0.604 . . . . 0.0 110.054 -179.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.7 ptpp? -65.69 -162.59 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.537 0 O-C-N 120.974 -1.079 . . . . 0.0 109.289 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 3.7 m -79.36 115.82 55.93 Favored Pre-proline 0 N--CA 1.487 1.415 0 O-C-N 121.095 -1.003 . . . . 0.0 109.0 179.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.441 ' O ' ' CB ' ' A' ' 54' ' ' ASP . 31.1 Cg_endo -86.72 -17.22 3.38 Favored 'Trans proline' 0 N--CA 1.493 1.496 0 C-N-CA 122.356 2.038 . . . . 0.0 111.441 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.441 ' CB ' ' O ' ' A' ' 53' ' ' PRO . 6.2 t0 75.4 164.22 0.26 Allowed 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.264 -1.014 . . . . 0.0 108.264 -178.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.688 ' O ' ' N ' ' A' ' 57' ' ' GLU . 0.1 OUTLIER -80.28 -47.4 1.33 Allowed Pre-proline 0 N--CA 1.497 1.898 0 O-C-N 120.638 -1.289 . . . . 0.0 112.18 -178.405 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.6 ' O ' ' N ' ' A' ' 59' ' ' LYS . 30.2 Cg_exo -39.98 62.58 0.0 OUTLIER 'Trans proline' 0 N--CA 1.505 2.154 0 C-N-CA 123.523 2.816 . . . . 0.0 115.363 -178.356 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.688 ' N ' ' O ' ' A' ' 55' ' ' SER . 30.3 mt-10 36.63 29.08 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.038 0 CA-C-O 121.437 0.637 . . . . 0.0 109.477 179.273 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.534 ' N ' ' O ' ' A' ' 56' ' ' PRO . 0.1 OUTLIER 65.16 -8.07 0.26 Allowed 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -177.902 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.6 ' N ' ' O ' ' A' ' 56' ' ' PRO . 4.2 tmtm? -50.2 -40.79 48.26 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-O 121.704 0.764 . . . . 0.0 109.015 179.021 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -56.65 -27.31 58.27 Favored 'General case' 0 C--N 1.296 -1.724 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -179.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -73.17 -53.61 10.54 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 177.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -62.85 -32.47 73.71 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.661 179.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -61.7 -38.08 86.54 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.154 -0.966 . . . . 0.0 108.542 179.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.1 -30.67 78.42 Favored Glycine 0 N--CA 1.481 1.675 0 N-CA-C 108.381 -1.888 . . . . 0.0 108.381 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.496 ' CE2' ' NZ ' ' A' ' 104' ' ' LYS . 56.2 m-85 -84.01 -39.51 19.57 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.35 -1.088 . . . . 0.0 108.26 178.292 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -69.34 -46.4 67.14 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 178.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 5.6 mm -56.69 -38.87 59.99 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 179.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.72 -48.17 82.08 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.404 -0.81 . . . . 0.0 109.545 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 53.7 t -60.94 -17.33 15.55 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 O-C-N 121.65 -0.656 . . . . 0.0 109.632 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -78.55 -43.61 12.01 Favored Glycine 0 N--CA 1.487 2.087 0 C-N-CA 119.609 -1.281 . . . . 0.0 110.792 -178.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.462 ' NE2' ' C ' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -71.7 -30.74 65.99 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.557 -1.555 . . . . 0.0 107.501 179.713 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 12.0 mt -74.01 -31.35 29.98 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 177.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -62.83 -57.52 10.57 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.252 -0.905 . . . . 0.0 110.099 -179.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -62.69 -29.2 70.47 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.132 -0.98 . . . . 0.0 109.746 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -74.32 -29.29 61.54 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 120.645 -1.284 . . . . 0.0 108.355 179.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.406 HD12 ' HB3' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -56.49 -33.18 65.72 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 106.171 -1.789 . . . . 0.0 106.171 178.185 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.4 tptt -69.03 -42.37 76.45 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.422 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 8.1 mp -59.51 -37.62 78.79 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.37 -0.831 . . . . 0.0 108.85 -178.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.572 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -63.4 -51.33 66.24 Favored 'General case' 0 C--N 1.298 -1.642 0 O-C-N 121.272 -0.893 . . . . 0.0 109.23 178.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.458 HD22 ' HG2' ' A' ' 27' ' ' LYS . 1.8 t-20 -72.6 -11.07 60.5 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.418 -0.802 . . . . 0.0 111.012 -178.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -95.04 -10.86 29.56 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 120.904 -1.122 . . . . 0.0 109.513 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.83 12.92 48.62 Favored Glycine 0 N--CA 1.496 2.651 0 N-CA-C 110.693 -0.963 . . . . 0.0 110.693 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp -95.22 77.43 3.46 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.971 -1.311 . . . . 0.0 108.43 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.418 HG22 HG21 ' A' ' 26' ' ' VAL . 71.2 t -75.63 -52.01 19.3 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.747 0 O-C-N 121.864 -0.523 . . . . 0.0 109.646 -179.344 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.455 ' H ' ' HD2' ' A' ' 85' ' ' LYS . 4.7 mptt -53.74 -37.15 63.08 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.091 -1.078 . . . . 0.0 108.091 179.25 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -70.24 -42.61 72.0 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 178.334 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.65 -53.74 37.24 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 119.627 -0.829 . . . . 0.0 109.18 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.566 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -59.69 -46.03 90.31 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 179.52 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -58.62 -39.22 79.83 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.117 -0.99 . . . . 0.0 108.403 179.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.528 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -64.73 -29.58 70.56 Favored 'General case' 0 N--CA 1.485 1.31 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 178.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.566 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -49.17 -47.43 45.85 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.983 -1.073 . . . . 0.0 108.16 178.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -62.37 -27.06 68.81 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 178.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.669 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -72.64 -36.39 67.99 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 177.939 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.403 HD11 ' OE1' ' A' ' 71' ' ' GLN . 10.0 mp -65.57 -48.24 73.06 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.459 -1.312 . . . . 0.0 107.459 178.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 3.6 mtpt -52.81 -48.37 66.99 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.371 -0.83 . . . . 0.0 109.189 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 45.4 m -69.28 -34.27 74.49 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.163 -0.961 . . . . 0.0 109.674 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.4 m -58.52 -48.04 82.16 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 4.2 mm -50.32 -33.7 10.67 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.312 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.22 -42.05 76.62 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 179.217 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.41 -28.18 69.07 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.609 -0.682 . . . . 0.0 109.48 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -67.83 -35.66 78.99 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 179.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.544 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -61.6 -32.77 72.9 Favored 'General case' 0 C--N 1.303 -1.451 0 C-N-CA 119.052 -1.059 . . . . 0.0 108.358 179.584 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.552 ' NE2' ' N ' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -64.04 -23.45 67.34 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 105.178 -2.156 . . . . 0.0 105.178 177.846 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.552 ' N ' ' NE2' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -83.86 -33.8 24.76 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 177.577 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.538 ' CD1' ' C ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -89.98 4.77 49.13 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 120.947 -1.096 . . . . 0.0 108.55 179.39 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.395 0 CA-C-O 117.94 -1.478 . . . . 0.0 109.519 179.714 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.463 0 CA-C-O 121.252 0.548 . . . . 0.0 109.552 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -85.93 -16.45 38.41 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.427 -0.796 . . . . 0.0 109.419 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 69.2 mt -88.36 -51.94 5.47 Favored 'General case' 0 C--N 1.295 -1.762 0 O-C-N 121.608 -0.682 . . . . 0.0 109.326 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -64.47 -25.11 67.86 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -73.41 -43.4 60.55 Favored 'General case' 0 C--N 1.296 -1.741 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.584 HD22 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -57.82 -40.61 80.44 Favored 'General case' 0 C--N 1.307 -1.264 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 -179.886 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.584 ' N ' HD22 ' A' ' 6' ' ' ASN . 8.2 m95 -52.67 -53.01 53.33 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.165 -0.959 . . . . 0.0 108.702 -179.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 51.1 tt0 -59.38 -30.84 68.71 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 120.918 -1.114 . . . . 0.0 108.434 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.3 m -67.98 -54.28 19.77 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 119.451 -0.899 . . . . 0.0 108.79 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.4 mt -58.27 -37.27 74.64 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 178.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -69.34 -60.86 2.06 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.385 -0.822 . . . . 0.0 109.809 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -55.67 -14.72 2.37 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.347 -0.846 . . . . 0.0 109.349 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.53 ' O ' HG22 ' A' ' 16' ' ' VAL . 2.2 m-20 -74.6 -54.62 7.11 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 107.637 -1.245 . . . . 0.0 107.637 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.5 mt -55.92 -22.38 25.62 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.537 -0.727 . . . . 0.0 110.312 -178.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 11.7 tttp -70.21 -57.61 4.72 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.068 -1.02 . . . . 0.0 109.102 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.617 ' O ' ' N ' ' A' ' 20' ' ' ALA . 14.9 m -52.68 -22.76 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 C-N-CA 118.864 -1.135 . . . . 0.0 110.316 -178.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 9.4 mt -70.2 -74.87 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 120.441 -1.412 . . . . 0.0 109.926 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -47.67 -28.57 2.46 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.143 -0.973 . . . . 0.0 108.724 -179.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.13 4.33 36.87 Favored 'General case' 0 N--CA 1.495 1.809 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.617 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -57.65 -38.45 75.09 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 179.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.529 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 0.6 OUTLIER 63.57 -17.6 0.06 Allowed 'General case' 0 N--CA 1.494 1.753 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.225 179.744 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.63 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -146.6 144.23 29.4 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.749 -1.219 . . . . 0.0 109.787 179.773 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -56.06 -15.75 4.04 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.721 -0.612 . . . . 0.0 110.106 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.51 -55.54 13.13 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.215 -0.928 . . . . 0.0 109.568 -179.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -68.34 -19.04 64.63 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.557 -0.714 . . . . 0.0 110.609 -179.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.555 HG12 ' HB2' ' A' ' 79' ' ' ALA . 47.5 t -70.8 -46.71 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 O-C-N 120.936 -1.102 . . . . 0.0 108.589 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.43 ' HG2' HD22 ' A' ' 80' ' ' ASN . 14.0 mtpt -55.58 -56.74 16.78 Favored 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 178.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -51.8 -34.14 38.64 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-N 114.403 -1.271 . . . . 0.0 109.64 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.84 -69.66 0.33 Allowed 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.289 -0.882 . . . . 0.0 110.32 -179.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 30' ' ' LEU . 93.0 mt -57.1 -19.99 22.79 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.52 -0.738 . . . . 0.0 109.414 -178.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.428 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 39.4 m -64.17 -40.76 96.81 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 178.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 58.2 mttt -73.94 -32.07 63.33 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 36.8 mtp -66.67 -69.09 0.33 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 120.988 -1.07 . . . . 0.0 108.74 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.3 ttt-85 -45.9 -29.18 1.31 Allowed 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.32 -64.76 0.95 Allowed 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 120.049 -0.66 . . . . 0.0 109.843 179.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.66 -33.17 73.5 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.043 -1.036 . . . . 0.0 109.224 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.25 -38.07 82.36 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 179.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.5 mt -65.68 -26.32 67.73 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 179.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 61.0 t0 -84.66 -37.42 21.05 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.12 -0.987 . . . . 0.0 110.041 -179.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.563 ' O ' ' N ' ' A' ' 42' ' ' LYS . . . -58.46 -69.34 0.19 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.07 -1.019 . . . . 0.0 109.607 -179.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.626 HE22 ' NH2' ' A' ' 62' ' ' ARG . 0.0 OUTLIER 11.78 -78.42 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.606 0 CA-C-O 121.702 0.763 . . . . 0.0 111.354 -179.581 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.563 ' N ' ' O ' ' A' ' 40' ' ' ALA . 44.7 mmtt -56.26 13.0 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.926 -0.483 . . . . 0.0 110.682 179.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.607 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -75.42 148.38 39.18 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.432 -1.418 . . . . 0.0 110.236 -178.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -153.58 76.51 6.11 Favored Pre-proline 0 N--CA 1.492 1.648 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.421 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 46.9 Cg_exo -49.67 -39.79 46.89 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.537 2.158 . . . . 0.0 113.89 179.781 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.421 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 88.6 Cg_endo -93.1 -93.72 0.0 OUTLIER 'Trans proline' 0 C--N 1.32 -0.967 0 C-N-CA 121.848 1.699 . . . . 0.0 111.589 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.444 ' NZ ' ' CB ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -177.78 103.06 0.05 OUTLIER 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.157 -0.965 . . . . 0.0 110.227 179.899 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.414 ' C ' ' N ' ' A' ' 50' ' ' ASP . 0.5 OUTLIER -82.85 -175.05 5.61 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 107.019 -1.474 . . . . 0.0 107.019 178.17 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 51.35 20.38 0.95 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.796 -1.19 . . . . 0.0 108.36 -179.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.414 ' N ' ' C ' ' A' ' 48' ' ' LEU . 7.7 m-20 -143.16 -61.33 0.42 Allowed 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 7.9 ptpp? -66.64 -146.98 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 178.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 25.9 t -77.96 131.92 68.83 Favored Pre-proline 0 C--N 1.307 -1.273 0 O-C-N 120.65 -1.281 . . . . 0.0 108.279 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -80.99 -11.61 12.27 Favored 'Trans proline' 0 N--CA 1.496 1.656 0 C-N-CA 122.354 2.036 . . . . 0.0 111.468 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 69.02 -128.2 0.1 Allowed 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 -178.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.805 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 24.2 t -168.27 -28.45 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.714 0 C-N-CA 118.645 -1.222 . . . . 0.0 113.523 -179.42 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.805 ' CD ' ' H ' ' A' ' 55' ' ' SER . 73.4 Cg_exo -54.75 45.65 0.03 OUTLIER 'Trans proline' 0 N--CA 1.503 2.081 0 C-N-CA 122.277 1.985 . . . . 0.0 113.205 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.678 ' N ' ' O ' ' A' ' 55' ' ' SER . 38.6 mt-10 46.98 27.94 0.8 Allowed 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 -179.383 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 8.9 mtm 65.4 -8.25 0.28 Allowed 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 -177.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.601 ' H ' ' C ' ' A' ' 57' ' ' GLU . 1.0 OUTLIER -50.21 -46.65 54.69 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-O 121.716 0.769 . . . . 0.0 109.875 179.191 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.463 ' H ' ' HB2' ' A' ' 56' ' ' PRO . 8.0 t70 -52.31 -17.81 1.32 Allowed 'General case' 0 C--N 1.293 -1.875 0 O-C-N 121.089 -1.007 . . . . 0.0 109.331 -178.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -74.74 -68.07 0.58 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.166 -0.959 . . . . 0.0 109.265 178.46 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.626 ' NH2' HE22 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -58.46 -27.11 64.09 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 -179.644 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.594 ' CE1' HD11 ' A' ' 67' ' ' ILE . 3.5 t60 -60.99 -45.61 94.11 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.874 -0.788 . . . . 0.0 108.874 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -60.54 -32.09 76.9 Favored Glycine 0 N--CA 1.484 1.889 0 C-N-CA 118.89 -1.624 . . . . 0.0 109.214 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.505 ' O ' HG23 ' A' ' 69' ' ' VAL . 88.5 m-85 -82.0 -41.98 19.98 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.106 -1.232 . . . . 0.0 108.258 178.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 51.9 t0 -69.5 -46.41 66.64 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 179.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.594 HD11 ' CE1' ' A' ' 63' ' ' HIS . 17.7 mm -54.59 -47.08 72.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 178.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.9 tp -60.53 -47.28 86.88 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.459 -0.776 . . . . 0.0 108.964 179.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 65' ' ' PHE . 55.3 t -62.45 -21.77 27.94 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 O-C-N 121.181 -0.949 . . . . 0.0 110.072 -179.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -77.19 -49.4 7.5 Favored Glycine 0 N--CA 1.49 2.286 0 C-N-CA 119.686 -1.245 . . . . 0.0 110.471 -178.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.522 ' O ' ' NE2' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -67.32 -28.01 67.64 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 120.67 -1.488 . . . . 0.0 107.519 179.743 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 4.5 mt -74.58 -33.06 31.19 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.474 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 176.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -60.27 -53.79 53.49 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.527 -0.733 . . . . 0.0 109.708 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -64.14 -31.53 72.76 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.439 -0.788 . . . . 0.0 109.764 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.25 -31.56 67.69 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 120.434 -1.416 . . . . 0.0 107.801 179.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.59 -33.38 66.16 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 178.087 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 5.8 tptt -67.13 -43.52 82.2 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-O 121.724 0.773 . . . . 0.0 109.526 178.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.9 mp -59.78 -32.04 70.23 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.555 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -64.11 -55.22 23.56 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.587 -0.696 . . . . 0.0 109.372 178.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.43 HD22 ' HG2' ' A' ' 27' ' ' LYS . 2.7 t-20 -73.37 -10.63 59.94 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.431 -0.793 . . . . 0.0 111.494 -178.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -92.41 -10.91 36.35 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 120.791 -1.193 . . . . 0.0 109.575 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.22 12.39 51.96 Favored Glycine 0 N--CA 1.496 2.681 0 N-CA-C 110.299 -1.12 . . . . 0.0 110.299 178.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 17.3 mmtp -93.86 82.56 4.28 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.064 -1.257 . . . . 0.0 108.001 179.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 19.4 t -76.69 -60.45 2.31 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.809 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.956 -178.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.411 ' H ' ' HD2' ' A' ' 85' ' ' LYS . 7.6 mptt -49.43 -38.0 27.67 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.03 -1.044 . . . . 0.0 109.084 179.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.602 ' H ' ' CD ' ' A' ' 86' ' ' GLU . 35.3 mp0 -68.02 -46.3 71.57 Favored 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 179.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.2 -45.51 80.55 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 119.194 -1.003 . . . . 0.0 108.971 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.535 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -61.94 -58.82 6.43 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 179.488 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -53.4 -37.68 62.72 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.056 -1.027 . . . . 0.0 108.805 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.581 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -63.32 -35.08 79.19 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 178.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.535 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -48.24 -41.97 29.09 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -65.43 -26.41 67.95 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 178.248 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.688 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -73.45 -39.91 64.6 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 177.741 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.495 ' CD1' ' OE1' ' A' ' 71' ' ' GLN . 11.3 mp -62.81 -42.89 99.91 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 107.456 -1.312 . . . . 0.0 107.456 178.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 3.6 mtpt -54.89 -47.96 73.63 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 179.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 87.0 m -69.38 -32.25 71.15 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.244 -0.91 . . . . 0.0 109.515 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.9 m -60.83 -48.12 83.25 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.094 -1.004 . . . . 0.0 108.457 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 95.9 mt -51.23 -36.71 17.07 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -53.29 -43.55 67.6 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.403 ' O ' ' HG3' ' A' ' 103' ' ' GLN . . . -64.32 -37.03 86.06 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.351 -0.843 . . . . 0.0 109.048 179.14 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.458 ' CD1' ' C ' ' A' ' 101' ' ' TYR . 0.5 OUTLIER -65.95 -28.21 68.74 Favored 'General case' 0 C--N 1.297 -1.682 0 O-C-N 120.26 -1.525 . . . . 0.0 107.832 179.41 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.53 ' ND2' ' O ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -66.6 -32.1 73.22 Favored 'General case' 0 C--N 1.298 -1.636 0 C-N-CA 119.152 -1.019 . . . . 0.0 110.084 -179.541 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.513 HE21 ' CA ' ' A' ' 104' ' ' LYS . 0.9 OUTLIER -66.84 -20.94 66.03 Favored 'General case' 0 N--CA 1.485 1.325 0 N-CA-C 104.71 -2.329 . . . . 0.0 104.71 177.999 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.513 ' CA ' HE21 ' A' ' 103' ' ' GLN . 0.0 OUTLIER -80.77 -36.37 31.96 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 177.289 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.551 ' CD1' ' C ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -94.49 6.84 47.56 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.064 -1.023 . . . . 0.0 108.475 179.335 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.503 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.49 2.3 0 CA-C-O 117.943 -1.476 . . . . 0.0 109.612 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -86.15 -17.96 33.54 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.314 -0.866 . . . . 0.0 109.186 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 43.7 mt -89.08 -49.83 6.52 Favored 'General case' 0 C--N 1.295 -1.766 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -65.32 -23.78 67.1 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 179.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -74.39 -51.86 13.78 Favored 'General case' 0 C--N 1.298 -1.658 0 C-N-CA 119.796 -0.762 . . . . 0.0 108.969 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.548 HD22 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -53.39 -37.6 62.62 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 -179.77 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.548 ' N ' HD22 ' A' ' 6' ' ' ASN . 11.9 m0 -53.41 -52.85 58.02 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.227 -0.921 . . . . 0.0 108.556 -179.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -56.46 -29.44 61.71 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.289 -0.882 . . . . 0.0 109.2 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 59.4 m -69.46 -63.76 1.01 Allowed 'General case' 0 N--CA 1.486 1.354 0 O-C-N 121.076 -1.015 . . . . 0.0 110.164 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.3 pp -59.05 -30.54 68.12 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 118.382 -1.327 . . . . 0.0 108.026 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -70.91 -58.16 3.87 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.94 -1.1 . . . . 0.0 108.931 178.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -58.96 -11.41 3.35 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.502 -0.749 . . . . 0.0 109.886 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -74.44 -53.24 9.93 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 107.594 -1.261 . . . . 0.0 107.594 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.16 -37.17 69.16 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.711 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.585 ' HZ2' ' HE3' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -67.72 -40.92 84.2 Favored 'General case' 0 C--N 1.296 -1.718 0 C-N-CA 118.51 -1.276 . . . . 0.0 108.74 -179.286 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.553 ' O ' ' N ' ' A' ' 20' ' ' ALA . 69.3 t -60.25 -23.93 29.14 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 O-C-N 120.98 -1.075 . . . . 0.0 109.52 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.466 ' O ' ' N ' ' A' ' 20' ' ' ALA . 12.6 mt -70.41 -70.77 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.875 0 O-C-N 121.021 -1.049 . . . . 0.0 109.93 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -48.25 -25.18 1.42 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.12 -0.987 . . . . 0.0 108.893 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.585 ' HE3' ' HZ2' ' A' ' 15' ' ' LYS . 0.0 OUTLIER -103.38 -1.14 29.1 Favored 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 179.228 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.553 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -57.78 -38.13 74.92 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 107.686 -1.227 . . . . 0.0 107.686 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.505 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 8.9 m-20 58.13 -8.73 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.264 179.431 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.603 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -147.11 144.2 28.86 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 120.574 -1.329 . . . . 0.0 109.745 178.636 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.07 -22.23 37.65 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.861 -0.524 . . . . 0.0 111.016 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.8 -54.96 19.96 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.138 -0.976 . . . . 0.0 110.351 -179.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.419 ' HB2' ' HB1' ' A' ' 20' ' ' ALA . 4.2 mt-30 -67.35 -16.57 64.33 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.147 -0.971 . . . . 0.0 110.614 -179.035 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.476 HG12 ' HB2' ' A' ' 79' ' ' ALA . 48.9 t -71.11 -48.38 55.56 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.019 0 O-C-N 120.916 -1.115 . . . . 0.0 108.39 179.659 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.456 ' HG2' HD22 ' A' ' 80' ' ' ASN . 5.8 mppt? -55.59 -50.94 68.76 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 179.068 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.437 ' N ' ' OD1' ' A' ' 28' ' ' ASP . 6.2 m-20 -54.67 -39.58 68.22 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-N 114.782 -1.099 . . . . 0.0 109.654 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.77 -62.08 1.54 Allowed 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.31 -0.868 . . . . 0.0 110.284 -179.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.474 HD23 ' SD ' ' A' ' 33' ' ' MET . 85.3 mt -62.95 -24.88 68.09 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.11 -0.994 . . . . 0.0 110.514 -179.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 31.6 m -60.86 -45.72 93.42 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.895 -1.128 . . . . 0.0 108.714 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 16.3 mmtm -71.44 -28.99 64.36 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-O 121.305 0.574 . . . . 0.0 109.517 -179.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . 0.474 ' SD ' HD23 ' A' ' 30' ' ' LEU . 62.9 mtp -64.62 -67.66 0.42 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.153 -0.967 . . . . 0.0 108.812 178.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.473 ' O ' ' CD2' ' A' ' 38' ' ' LEU . 12.3 ttt-85 -48.72 -23.38 1.03 Allowed 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -179.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.403 ' N ' ' C ' ' A' ' 33' ' ' MET . . . -77.76 -58.27 3.36 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.95 -28.56 67.57 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.83 -1.169 . . . . 0.0 110.223 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -57.87 -58.77 6.92 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.98 -1.075 . . . . 0.0 108.609 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.473 ' CD2' ' O ' ' A' ' 34' ' ' ARG . 0.6 OUTLIER -62.34 -18.33 61.17 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.432 -0.793 . . . . 0.0 109.253 179.48 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -84.14 -39.15 19.8 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 120.773 -1.204 . . . . 0.0 108.248 178.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.47 -19.72 62.34 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.463 -0.773 . . . . 0.0 109.705 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.513 ' O ' ' N ' ' A' ' 43' ' ' ALA . 1.6 tm0? -46.43 -56.82 5.34 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.454 ' HG2' ' H ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -63.22 74.6 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.753 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.538 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.513 ' N ' ' O ' ' A' ' 41' ' ' GLN . . . -160.61 149.81 17.12 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.485 -1.384 . . . . 0.0 110.292 -179.223 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -154.91 74.35 5.66 Favored Pre-proline 0 N--CA 1.494 1.729 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.436 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 50.3 Cg_exo -46.8 -38.59 23.14 Favored 'Trans proline' 0 C--N 1.306 -1.688 0 C-N-CA 122.552 2.168 . . . . 0.0 114.315 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.436 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 73.0 Cg_endo -96.9 -92.01 0.0 OUTLIER 'Trans proline' 0 C--N 1.317 -1.111 0 C-N-CA 122.442 2.095 . . . . 0.0 112.149 -179.25 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 10.1 pttp -175.64 102.4 0.07 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.218 -0.927 . . . . 0.0 109.731 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.43 -177.34 6.46 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 178.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 52.07 22.37 1.85 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.751 -1.218 . . . . 0.0 108.291 -178.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -145.6 -56.8 0.31 Allowed 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -68.0 -163.79 0.04 OUTLIER 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.22 -0.925 . . . . 0.0 108.782 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.3 t -76.55 117.32 63.76 Favored Pre-proline 0 N--CA 1.486 1.363 0 O-C-N 120.998 -1.064 . . . . 0.0 108.948 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.585 ' C ' ' H ' ' A' ' 55' ' ' SER . 41.6 Cg_endo -83.25 -9.89 10.28 Favored 'Trans proline' 0 N--CA 1.496 1.645 0 C-N-CA 122.325 2.016 . . . . 0.0 111.494 -179.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.554 ' O ' ' CB ' ' A' ' 55' ' ' SER . 6.7 t0 63.14 -24.37 0.06 Allowed 'General case' 0 N--CA 1.491 1.577 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.595 -178.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.769 ' O ' ' N ' ' A' ' 57' ' ' GLU . 4.5 t 102.47 -26.44 0.0 OUTLIER Pre-proline 0 N--CA 1.52 3.029 0 N-CA-C 115.557 1.688 . . . . 0.0 115.557 177.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.55 ' O ' ' N ' ' A' ' 59' ' ' LYS . 85.7 Cg_exo -45.98 36.86 0.01 OUTLIER 'Trans proline' 0 N--CA 1.511 2.529 0 C-N-CA 122.677 2.251 . . . . 0.0 114.943 179.262 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.769 ' N ' ' O ' ' A' ' 55' ' ' SER . 25.3 tt0 50.41 23.4 1.25 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 120.426 -1.421 . . . . 0.0 107.189 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.503 ' SD ' ' O ' ' A' ' 57' ' ' GLU . 0.8 OUTLIER 66.41 -3.9 0.78 Allowed 'General case' 0 C--N 1.307 -1.282 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 -178.281 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.55 ' N ' ' O ' ' A' ' 56' ' ' PRO . 0.1 OUTLIER -52.93 -42.45 65.42 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 121.953 0.883 . . . . 0.0 109.396 179.514 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -55.39 -17.95 5.86 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 108.498 -0.926 . . . . 0.0 108.498 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.443 ' CD1' ' NZ ' ' A' ' 104' ' ' LYS . 30.8 t80 -75.11 -63.93 1.16 Allowed 'General case' 0 N--CA 1.492 1.627 0 CA-C-O 122.061 0.934 . . . . 0.0 109.44 178.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.544 ' O ' ' N ' ' A' ' 66' ' ' ASP . 0.0 OUTLIER -63.02 -31.88 73.11 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 -179.655 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.412 ' NE2' HD11 ' A' ' 67' ' ' ILE . 4.8 t60 -54.84 -38.9 68.01 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -65.63 -34.7 89.72 Favored Glycine 0 C--N 1.293 -1.848 0 N-CA-C 108.137 -1.985 . . . . 0.0 108.137 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -82.98 -32.97 26.75 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.304 -1.115 . . . . 0.0 108.517 178.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.544 ' N ' ' O ' ' A' ' 62' ' ' ARG . 14.6 t0 -72.25 -44.89 62.19 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 177.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.412 HD11 ' NE2' ' A' ' 63' ' ' HIS . 5.5 mm -63.13 -35.86 73.52 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.524 0 O-C-N 121.287 -0.883 . . . . 0.0 109.094 178.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.8 tp -54.18 -61.34 2.37 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 122.153 0.978 . . . . 0.0 108.96 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.439 HG22 ' O ' ' A' ' 66' ' ' ASP . 31.0 m -57.87 -13.32 2.45 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.835 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.548 -178.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -78.19 -54.82 4.26 Favored Glycine 0 N--CA 1.494 2.506 0 C-N-CA 119.806 -1.188 . . . . 0.0 111.172 -179.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.446 ' O ' ' NE2' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -67.08 -29.12 68.79 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.316 -1.697 . . . . 0.0 107.9 -179.837 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 14.4 mt -71.05 -31.43 44.92 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 177.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -58.14 -52.22 66.45 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 119.205 -0.998 . . . . 0.0 109.347 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -64.4 -31.98 73.42 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.361 -0.837 . . . . 0.0 109.471 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.12 -30.22 63.47 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 120.698 -1.251 . . . . 0.0 108.389 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.81 -33.81 64.78 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 178.292 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.4 tptt -68.65 -46.54 68.89 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.33 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 8.1 mp -58.0 -33.41 68.9 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 -178.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.476 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -64.08 -50.07 69.82 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.35 -0.844 . . . . 0.0 108.862 178.183 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.456 HD22 ' HG2' ' A' ' 27' ' ' LYS . 2.1 t-20 -74.2 -13.58 60.82 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.591 -0.693 . . . . 0.0 111.447 -178.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 82.5 mt-10 -93.09 -10.43 36.05 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.602 -1.311 . . . . 0.0 110.128 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 95.57 15.62 42.79 Favored Glycine 0 N--CA 1.496 2.641 0 N-CA-C 110.264 -1.134 . . . . 0.0 110.264 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.1 mmtt -96.44 75.66 2.89 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.205 -1.173 . . . . 0.0 108.312 179.154 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 22.0 t -73.29 -59.32 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.778 -0.576 . . . . 0.0 109.638 -179.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.522 ' H ' ' HD2' ' A' ' 85' ' ' LYS . 0.0 OUTLIER -48.41 -35.99 13.85 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.216 -0.927 . . . . 0.0 108.517 179.378 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.604 ' H ' ' CD ' ' A' ' 86' ' ' GLU . 27.2 mp0 -71.65 -47.84 51.68 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 178.432 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -63.34 -42.74 98.95 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.545 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.1 OUTLIER -60.75 -61.42 2.6 Favored 'General case' 0 C--N 1.296 -1.726 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 178.654 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -49.0 -37.59 20.81 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.154 -0.966 . . . . 0.0 109.07 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.547 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -63.08 -36.56 84.0 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 178.246 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.545 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -45.96 -46.97 16.58 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.456 ' OE1' ' O ' ' A' ' 88' ' ' GLN . 2.3 mp0 -62.76 -27.18 69.11 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.14 -0.975 . . . . 0.0 108.444 178.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.728 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -72.69 -41.22 65.54 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 177.915 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.416 HD12 ' N ' ' A' ' 94' ' ' LEU . 9.5 mp -63.44 -43.09 98.42 Favored 'General case' 0 C--N 1.305 -1.354 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 3.9 mtpt -56.27 -40.9 74.98 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.29 -0.881 . . . . 0.0 108.813 178.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 13.5 m -67.47 -31.75 72.12 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.15 -0.969 . . . . 0.0 108.868 179.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.24 -42.61 98.92 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 178.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 54.2 mt -53.81 -32.92 22.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.9 tpt180 -58.64 -45.4 89.38 Favored 'General case' 0 C--N 1.302 -1.496 0 C-N-CA 119.023 -1.071 . . . . 0.0 108.414 179.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.64 -24.96 67.75 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.461 -0.774 . . . . 0.0 109.18 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.408 ' O ' ' N ' ' A' ' 105' ' ' TYR . 6.2 t80 -74.72 -32.11 62.04 Favored 'General case' 0 C--N 1.297 -1.711 0 O-C-N 120.557 -1.34 . . . . 0.0 108.028 179.287 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.546 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.2 OUTLIER -65.5 -40.94 93.62 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 120.991 -1.068 . . . . 0.0 110.72 -179.096 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.654 HE21 ' N ' ' A' ' 104' ' ' LYS . 1.3 pp0? -64.87 -22.26 66.96 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 105.514 -2.032 . . . . 0.0 105.514 179.136 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.654 ' N ' HE21 ' A' ' 103' ' ' GLN . 0.0 OUTLIER -81.82 -33.31 30.82 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 176.631 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.568 ' CD1' ' C ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -90.61 3.77 53.18 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.117 -0.989 . . . . 0.0 108.59 179.7 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.491 2.342 0 CA-C-O 117.955 -1.469 . . . . 0.0 109.537 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.586 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -86.03 -19.43 30.32 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.313 -0.867 . . . . 0.0 109.278 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 15.1 mt -87.38 -51.2 6.08 Favored 'General case' 0 C--N 1.296 -1.73 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 -179.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -64.36 -22.72 67.05 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -72.73 -44.78 61.24 Favored 'General case' 0 C--N 1.298 -1.657 0 C-N-CA 119.568 -0.853 . . . . 0.0 108.742 -179.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.651 HD22 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -54.83 -44.11 73.61 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 -179.856 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.651 ' N ' HD22 ' A' ' 6' ' ' ASN . 11.6 m95 -53.13 -48.08 68.18 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.556 -0.715 . . . . 0.0 109.524 -179.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -56.32 -33.0 65.17 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 120.805 -1.185 . . . . 0.0 108.163 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.3 m -68.19 -52.12 37.95 Favored 'General case' 0 C--N 1.306 -1.301 0 C-N-CA 119.185 -1.006 . . . . 0.0 108.371 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 25.9 mt -58.96 -38.84 80.0 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 178.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -68.33 -52.78 29.64 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.576 -0.849 . . . . 0.0 108.902 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -61.53 -15.39 37.88 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.599 -0.688 . . . . 0.0 109.628 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -74.94 -51.82 12.77 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 179.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.2 mt -57.61 -33.01 67.77 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-O 120.995 0.426 . . . . 0.0 111.425 -178.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -67.8 -47.62 68.58 Favored 'General case' 0 C--N 1.296 -1.754 0 O-C-N 121.066 -1.022 . . . . 0.0 108.654 -179.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.523 ' O ' ' N ' ' A' ' 20' ' ' ALA . 55.6 t -55.88 -25.49 19.01 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 C-N-CA 119.304 -0.958 . . . . 0.0 109.755 -179.1 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.487 ' O ' ' N ' ' A' ' 20' ' ' ALA . 7.2 mt -71.28 -72.48 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.181 0 O-C-N 120.936 -1.103 . . . . 0.0 110.213 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -46.8 -27.4 1.2 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.893 -1.129 . . . . 0.0 109.201 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -101.02 -4.07 28.16 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.474 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.548 ' O ' ' ND2' ' A' ' 22' ' ' ASN . . . -57.49 -54.56 45.43 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 178.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.465 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 39.8 m-20 66.11 -0.92 1.27 Allowed 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.007 179.084 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.593 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -144.63 142.48 30.16 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.587 -1.321 . . . . 0.0 109.19 177.55 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -56.0 -19.38 12.37 Favored 'General case' 0 C--N 1.295 -1.792 0 O-C-N 121.599 -0.688 . . . . 0.0 110.794 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -71.41 -58.89 3.1 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.176 -0.953 . . . . 0.0 111.055 -179.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.515 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 5.0 mt-30 -64.3 -17.58 63.78 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.319 -0.863 . . . . 0.0 111.281 -177.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.518 HG12 ' HB2' ' A' ' 79' ' ' ALA . 55.4 t -70.7 -48.06 60.27 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 120.895 -1.128 . . . . 0.0 108.479 179.707 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.451 ' HG2' HD22 ' A' ' 80' ' ' ASN . 4.1 mtpt -56.27 -51.44 68.15 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 179.267 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.473 ' N ' ' OD1' ' A' ' 28' ' ' ASP . 2.8 m-20 -52.56 -38.03 59.03 Favored 'General case' 0 C--N 1.296 -1.741 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.754 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.52 -64.36 0.88 Allowed 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 119.663 -0.815 . . . . 0.0 110.009 -179.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.459 HD23 ' SD ' ' A' ' 33' ' ' MET . 18.1 mt -61.13 -24.45 66.27 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.295 -0.878 . . . . 0.0 110.126 -178.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.437 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 53.3 m -59.7 -41.11 90.01 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 178.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.0 mtpm? -72.87 -32.08 65.16 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.359 -179.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . 0.459 ' SD ' HD23 ' A' ' 30' ' ' LEU . 46.8 mtp -67.16 -68.09 0.4 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.01 -1.056 . . . . 0.0 108.956 178.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 12.9 ttt-85 -45.73 -26.44 0.64 Allowed 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -179.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.409 ' N ' ' C ' ' A' ' 33' ' ' MET . . . -74.79 -66.18 0.78 Allowed 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 178.389 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.91 -27.55 68.93 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.145 -0.972 . . . . 0.0 109.819 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.03 -42.15 84.73 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.01 -1.056 . . . . 0.0 108.401 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 25.6 mt -65.57 -30.18 70.88 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -82.53 -35.72 27.01 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.175 -0.953 . . . . 0.0 109.04 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -53.73 -26.16 21.98 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.437 HE21 ' C ' ' A' ' 41' ' ' GLN . 0.8 OUTLIER -52.14 -46.1 65.26 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.669 -0.644 . . . . 0.0 109.764 179.383 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.455 ' HD3' ' H ' ' A' ' 42' ' ' LYS . 4.6 mptt -68.17 3.99 1.43 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.164 -0.96 . . . . 0.0 110.09 -179.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -80.99 144.41 31.83 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.839 -1.163 . . . . 0.0 109.337 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.7 m -154.19 67.9 5.82 Favored Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.147 -0.971 . . . . 0.0 109.932 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.419 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 22.9 Cg_exo -56.64 -42.71 62.25 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 C-N-CA 122.305 2.003 . . . . 0.0 113.527 179.043 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.419 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 65.4 Cg_endo -83.43 -14.18 8.21 Favored 'Trans proline' 0 N--CA 1.494 1.534 0 C-N-CA 121.985 1.79 . . . . 0.0 112.23 -179.231 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 24.0 mtpt 74.2 109.84 0.07 Allowed 'General case' 0 N--CA 1.498 1.955 0 CA-C-O 121.581 0.705 . . . . 0.0 109.539 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.518 ' C ' ' H ' ' A' ' 50' ' ' ASP . 1.5 tt -87.05 -48.06 8.4 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.589 -0.694 . . . . 0.0 109.791 -179.144 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -68.34 40.53 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.082 -1.011 . . . . 0.0 109.381 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.518 ' H ' ' C ' ' A' ' 48' ' ' LEU . 5.6 t0 -146.55 -70.09 0.25 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.251 -0.906 . . . . 0.0 109.598 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.403 ' O ' ' O ' ' A' ' 50' ' ' ASP . 21.9 pttp -64.28 -141.16 0.0 OUTLIER 'General case' 0 C--N 1.298 -1.664 0 O-C-N 121.351 -0.843 . . . . 0.0 108.958 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 38.5 t -74.22 133.51 78.02 Favored Pre-proline 0 N--CA 1.485 1.314 0 O-C-N 120.594 -1.317 . . . . 0.0 109.378 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.41 ' O ' ' CB ' ' A' ' 54' ' ' ASP . 31.4 Cg_endo -83.47 -16.82 6.69 Favored 'Trans proline' 0 N--CA 1.499 1.836 0 C-N-CA 122.489 2.126 . . . . 0.0 112.627 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.41 ' CB ' ' O ' ' A' ' 53' ' ' PRO . 1.0 OUTLIER 77.47 -133.85 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.611 -0.681 . . . . 0.0 109.768 -179.053 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.784 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 12.6 p -167.97 -30.02 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.581 0 O-C-N 120.745 -1.222 . . . . 0.0 113.454 -179.269 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.784 ' CD ' ' H ' ' A' ' 55' ' ' SER . 73.2 Cg_exo -55.63 41.74 0.03 OUTLIER 'Trans proline' 0 N--CA 1.503 2.065 0 C-N-CA 122.243 1.962 . . . . 0.0 113.435 -179.421 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.626 ' N ' ' O ' ' A' ' 55' ' ' SER . 13.2 tt0 50.32 23.63 1.28 Allowed 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 -179.212 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.418 ' N ' ' C ' ' A' ' 56' ' ' PRO . 1.1 mpt? 67.94 -5.78 0.8 Allowed 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 -178.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.522 ' N ' ' O ' ' A' ' 56' ' ' PRO . 0.2 OUTLIER -47.75 -51.95 20.4 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-O 121.735 0.779 . . . . 0.0 108.963 178.902 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -52.41 -25.48 10.07 Favored 'General case' 0 C--N 1.3 -1.579 0 C-N-CA 120.497 -0.481 . . . . 0.0 109.842 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -75.81 -57.1 4.08 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 178.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -61.98 -33.83 75.03 Favored 'General case' 0 C--N 1.302 -1.479 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.683 179.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.401 ' O ' ' N ' ' A' ' 67' ' ' ILE . 1.3 t60 -61.34 -38.97 88.85 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.242 -0.911 . . . . 0.0 108.925 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -64.58 -32.04 82.89 Favored Glycine 0 N--CA 1.484 1.891 0 N-CA-C 108.874 -1.69 . . . . 0.0 108.874 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.553 ' O ' HG23 ' A' ' 69' ' ' VAL . 52.7 m-85 -81.34 -41.64 21.74 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.185 -1.185 . . . . 0.0 107.995 178.36 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -69.96 -45.38 67.54 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 179.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.401 ' N ' ' O ' ' A' ' 63' ' ' HIS . 4.6 mm -55.1 -49.86 68.38 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 178.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.462 HD13 HG21 ' A' ' 97' ' ' THR . 14.0 tp -59.03 -41.95 89.03 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.553 HG23 ' O ' ' A' ' 65' ' ' PHE . 41.7 t -60.89 -18.96 18.55 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 178.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -79.6 -46.49 7.9 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 110.567 -1.013 . . . . 0.0 110.567 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.533 ' O ' ' NE2' ' A' ' 71' ' ' GLN . 0.0 OUTLIER -67.73 -31.26 71.07 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 120.426 -1.632 . . . . 0.0 106.943 179.506 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 14.3 mt -72.84 -32.47 40.36 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.493 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 176.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -63.18 -52.04 63.93 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.454 -0.778 . . . . 0.0 110.013 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.52 -28.53 69.71 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.166 -0.959 . . . . 0.0 109.756 -179.048 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.57 -35.28 67.91 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 120.529 -1.357 . . . . 0.0 108.038 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.1 -33.04 64.72 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 178.349 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 6.8 tptt -67.48 -46.14 73.82 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 178.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 mp -58.48 -33.6 69.97 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.518 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -63.92 -50.59 68.08 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.026 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.451 HD22 ' HG2' ' A' ' 27' ' ' LYS . 1.9 t-20 -74.43 -12.61 60.55 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.639 -0.663 . . . . 0.0 111.395 -178.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -93.76 -10.63 33.57 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 120.622 -1.299 . . . . 0.0 110.536 -178.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 99.31 11.14 46.11 Favored Glycine 0 N--CA 1.498 2.772 0 C-N-CA 119.92 -1.133 . . . . 0.0 110.368 179.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.4 mmtp -95.91 85.06 3.98 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.094 -1.239 . . . . 0.0 108.282 179.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 30.9 t -77.22 -59.4 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.225 -178.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.468 ' H ' ' HD2' ' A' ' 85' ' ' LYS . 7.8 mptt -54.49 -37.08 64.86 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 120.771 -1.206 . . . . 0.0 109.221 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -66.93 -42.71 84.85 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 178.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.11 -49.09 68.72 Favored 'General case' 0 C--N 1.306 -1.316 0 C-N-CA 119.404 -0.918 . . . . 0.0 108.805 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.43 ' O ' ' OE1' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -61.55 -48.49 80.75 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 179.442 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -54.52 -33.11 59.38 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 120.978 -1.076 . . . . 0.0 108.419 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.514 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -66.39 -32.92 74.6 Favored 'General case' 0 C--N 1.306 -1.286 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 178.55 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -48.19 -50.32 29.54 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.43 ' OE1' ' O ' ' A' ' 88' ' ' GLN . 19.7 mp0 -60.57 -27.96 68.1 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 178.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.742 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -74.22 -40.24 62.57 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 106.896 -1.52 . . . . 0.0 106.896 178.404 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.457 ' CD1' ' OE1' ' A' ' 71' ' ' GLN . 8.7 mp -64.07 -42.19 97.06 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 179.264 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 6.2 mtpt -57.94 -44.48 86.96 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.885 -1.135 . . . . 0.0 108.256 178.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 23.9 m -66.96 -27.79 67.75 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.154 -0.967 . . . . 0.0 109.214 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.462 HG21 HD13 ' A' ' 68' ' ' LEU . 0.9 OUTLIER -62.21 -40.55 96.48 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 178.435 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 69.4 mt -49.83 -39.73 15.33 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.45 -43.95 80.02 Favored 'General case' 0 C--N 1.302 -1.466 0 C-N-CA 118.31 -1.356 . . . . 0.0 108.046 179.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.482 ' O ' ' OE1' ' A' ' 103' ' ' GLN . . . -65.83 -27.44 68.25 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.841 0.829 . . . . 0.0 109.305 179.316 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.44 ' O ' ' N ' ' A' ' 105' ' ' TYR . 12.4 t80 -71.71 -27.89 63.32 Favored 'General case' 0 C--N 1.294 -1.821 0 O-C-N 120.384 -1.448 . . . . 0.0 107.794 179.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.566 ' C ' HD22 ' A' ' 102' ' ' ASN . 0.4 OUTLIER -67.39 -41.84 84.33 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.109 -0.994 . . . . 0.0 110.229 -179.65 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.594 ' C ' HE21 ' A' ' 103' ' ' GLN . 0.0 OUTLIER -62.09 -21.74 65.23 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 105.403 -2.073 . . . . 0.0 105.403 178.663 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.408 ' N ' ' NE2' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -84.48 -34.95 23.27 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 177.247 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.558 ' CD1' ' C ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -88.54 8.24 29.15 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.921 -1.112 . . . . 0.0 109.018 -179.617 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.317 0 CA-C-O 117.958 -1.468 . . . . 0.0 109.485 179.868 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 -86.16 -16.08 39.0 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.304 -0.872 . . . . 0.0 109.37 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 17.3 mt -89.07 -49.2 6.9 Favored 'General case' 0 C--N 1.295 -1.777 0 CA-C-O 121.631 0.729 . . . . 0.0 109.083 -178.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -66.86 -23.83 66.07 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 179.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -76.2 -49.91 15.92 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.851 -179.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.641 HD22 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -52.03 -42.81 63.36 Favored 'General case' 0 C--N 1.307 -1.245 0 O-C-N 121.252 -0.905 . . . . 0.0 108.695 -179.091 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.641 ' N ' HD22 ' A' ' 6' ' ' ASN . 11.0 m95 -57.61 -51.13 70.74 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.1 -1.0 . . . . 0.0 109.245 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -58.61 -30.16 67.03 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.131 -0.981 . . . . 0.0 108.726 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 46.5 m -67.96 -54.51 18.07 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 119.257 -0.977 . . . . 0.0 108.601 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.8 mt -59.05 -37.76 77.8 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 106.966 -1.494 . . . . 0.0 106.966 178.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -68.3 -55.07 13.38 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 119.725 -0.79 . . . . 0.0 109.104 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -59.05 -16.4 18.57 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.562 -0.711 . . . . 0.0 109.626 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -74.53 -53.55 9.23 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 179.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.9 mt -58.07 -30.69 66.41 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 122.011 -0.431 . . . . 0.0 111.278 -178.198 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.9 ttpp -69.15 -43.11 74.96 Favored 'General case' 0 C--N 1.295 -1.794 0 C-N-CA 118.622 -1.231 . . . . 0.0 108.963 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.532 ' O ' ' N ' ' A' ' 20' ' ' ALA . 53.7 t -57.93 -26.35 28.25 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.61 0 O-C-N 121.11 -0.994 . . . . 0.0 109.52 -179.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.489 ' O ' ' N ' ' A' ' 20' ' ' ALA . 9.6 mt -71.66 -72.25 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.084 -1.01 . . . . 0.0 110.499 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -47.12 -27.46 1.41 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.017 -1.052 . . . . 0.0 109.139 -179.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.74 2.47 30.33 Favored 'General case' 0 N--CA 1.5 2.061 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 178.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.608 ' C ' ' H ' ' A' ' 22' ' ' ASN . . . -56.66 -40.44 75.5 Favored 'General case' 0 N--CA 1.491 1.579 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 178.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.496 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 0.9 OUTLIER 57.25 -13.28 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.988 -0.445 . . . . 0.0 110.84 179.889 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.643 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -146.83 145.57 29.92 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 120.656 -1.278 . . . . 0.0 108.814 178.834 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -53.98 -35.44 61.83 Favored 'General case' 0 C--N 1.296 -1.747 0 O-C-N 121.901 -0.5 . . . . 0.0 111.761 -179.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.77 -49.36 76.84 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 120.987 -1.07 . . . . 0.0 110.671 -178.163 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.547 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 18.9 mt-30 -67.3 -17.68 64.87 Favored 'General case' 0 C--N 1.3 -1.551 0 O-C-N 121.038 -1.039 . . . . 0.0 110.271 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.449 HG12 ' HB2' ' A' ' 79' ' ' ALA . 47.2 t -73.05 -51.05 28.05 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.078 -1.014 . . . . 0.0 108.587 179.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.493 ' HG2' HD22 ' A' ' 80' ' ' ASN . 3.2 mppt? -54.21 -44.65 71.84 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -53.89 -38.79 65.16 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.046 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.77 -65.03 0.79 Allowed 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.483 -0.761 . . . . 0.0 110.452 -179.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 26.3 mt -61.7 -27.86 69.0 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.144 -0.972 . . . . 0.0 110.392 -178.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.427 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 33.7 m -62.25 -40.38 95.99 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 178.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 12.2 mmmt -72.39 -30.36 64.59 Favored 'General case' 0 C--N 1.296 -1.719 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.386 -179.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . 0.409 ' O ' ' C ' ' A' ' 34' ' ' ARG . 48.7 mtt -63.71 -67.55 0.42 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.024 -1.048 . . . . 0.0 108.797 178.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.721 HH21 ' CB ' ' A' ' 73' ' ' ASP . 0.3 OUTLIER -44.01 -29.89 0.65 Allowed 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 -179.243 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.24 -59.1 2.89 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 178.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.77 -34.81 78.73 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.119 -0.988 . . . . 0.0 109.451 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.55 -38.46 71.93 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.194 -0.941 . . . . 0.0 108.697 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 11.9 mt -67.8 -29.0 68.07 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -85.11 -38.78 18.69 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.077 -1.015 . . . . 0.0 109.336 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.413 ' O ' ' CB ' ' A' ' 43' ' ' ALA . . . -56.5 -23.13 37.4 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.159 -0.963 . . . . 0.0 108.719 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.563 HE21 ' C ' ' A' ' 41' ' ' GLN . 0.6 OUTLIER -52.19 -51.55 57.42 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.264 -0.898 . . . . 0.0 108.94 179.315 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -67.04 10.11 0.16 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.406 -0.809 . . . . 0.0 109.444 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.49 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -79.37 128.71 33.67 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.878 -1.139 . . . . 0.0 108.772 179.682 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.665 ' O ' HG23 ' A' ' 44' ' ' THR . 12.2 t -154.56 61.93 3.4 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.335 -0.853 . . . . 0.0 109.637 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.453 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 86.4 Cg_exo -43.06 -37.31 6.36 Favored 'Trans proline' 0 C--N 1.304 -1.788 0 C-N-CA 122.716 2.277 . . . . 0.0 114.284 179.049 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.453 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 23.1 Cg_endo -93.75 -16.28 0.72 Allowed 'Trans proline' 0 N--CA 1.483 0.86 0 C-N-CA 122.566 2.177 . . . . 0.0 111.847 -179.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 21.3 mttm 80.06 98.29 0.06 Allowed 'General case' 0 N--CA 1.5 2.027 0 CA-C-O 121.25 0.547 . . . . 0.0 109.659 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.511 ' O ' HD23 ' A' ' 48' ' ' LEU . 1.0 OUTLIER -84.28 9.19 13.61 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.371 -0.831 . . . . 0.0 109.323 -179.89 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -99.61 27.82 5.08 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -148.87 -50.33 0.15 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.385 -0.822 . . . . 0.0 110.324 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -65.56 -160.55 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.181 -0.95 . . . . 0.0 109.377 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 20.8 t -73.13 129.99 85.4 Favored Pre-proline 0 N--CA 1.485 1.312 0 O-C-N 120.908 -1.12 . . . . 0.0 109.184 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -82.67 -9.11 11.19 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 122.64 2.227 . . . . 0.0 111.437 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 72.59 -114.48 0.05 Allowed 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 -178.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.737 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 1.4 t -167.87 -32.45 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.719 0 O-C-N 120.2 -1.563 . . . . 0.0 113.288 -179.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.737 ' CD ' ' H ' ' A' ' 55' ' ' SER . 68.1 Cg_exo -56.44 40.98 0.04 OUTLIER 'Trans proline' 0 N--CA 1.502 2.024 0 C-N-CA 122.068 1.845 . . . . 0.0 112.774 -179.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.645 ' N ' ' O ' ' A' ' 55' ' ' SER . 41.1 tt0 50.79 23.18 1.32 Allowed 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 106.999 -1.482 . . . . 0.0 106.999 -178.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.476 ' SD ' ' O ' ' A' ' 57' ' ' GLU . 0.3 OUTLIER 66.38 -3.51 0.83 Allowed 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 -178.272 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.558 ' N ' ' O ' ' A' ' 56' ' ' PRO . 0.9 OUTLIER -48.43 -48.38 37.41 Favored 'General case' 0 N--CA 1.487 1.404 0 CA-C-O 121.851 0.834 . . . . 0.0 109.424 178.984 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -51.13 -26.6 6.88 Favored 'General case' 0 C--N 1.295 -1.792 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 -179.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -77.93 -57.1 3.98 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 120.842 -1.161 . . . . 0.0 107.924 177.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.6 mtt-85 -58.44 -30.6 67.04 Favored 'General case' 0 N--CA 1.488 1.435 0 CA-C-O 121.366 0.603 . . . . 0.0 109.483 179.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.614 ' NE2' HD11 ' A' ' 67' ' ' ILE . 1.8 t60 -63.65 -39.74 95.1 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.276 -0.89 . . . . 0.0 109.041 179.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -61.51 -31.92 79.32 Favored Glycine 0 N--CA 1.486 2.009 0 C-N-CA 118.737 -1.697 . . . . 0.0 109.132 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -81.8 -40.08 23.08 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.054 -1.262 . . . . 0.0 108.291 178.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -70.73 -48.62 53.55 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 178.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.614 HD11 ' NE2' ' A' ' 63' ' ' HIS . 20.5 mm -56.49 -39.06 59.42 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 15.8 tp -56.99 -44.3 82.58 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.4 HG13 ' HG2' ' A' ' 34' ' ' ARG . 20.3 t -63.01 -17.22 18.99 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.45 0 O-C-N 120.918 -1.114 . . . . 0.0 109.095 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -76.24 -40.91 27.75 Favored Glycine 0 N--CA 1.487 2.079 0 C-N-CA 119.859 -1.162 . . . . 0.0 111.011 -178.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.592 ' C ' HE21 ' A' ' 71' ' ' GLN . 0.0 OUTLIER -78.38 -32.67 49.02 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.998 -1.295 . . . . 0.0 107.841 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 7.0 mt -74.19 -30.45 26.98 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.679 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 177.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.721 ' CB ' HH21 ' A' ' 34' ' ' ARG . 0.0 OUTLIER -61.1 -52.57 64.36 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 119.679 -0.808 . . . . 0.0 109.528 -179.658 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -62.27 -32.11 72.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.032 -1.042 . . . . 0.0 108.978 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.46 -34.55 65.44 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 120.87 -1.144 . . . . 0.0 108.252 179.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.71 -30.34 55.64 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 106.943 -1.503 . . . . 0.0 106.943 178.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.6 tptt -70.85 -48.94 51.23 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-O 121.657 0.742 . . . . 0.0 109.66 178.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.445 HD23 ' HB3' ' A' ' 86' ' ' GLU . 8.1 mp -56.93 -34.66 68.19 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 -179.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.449 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -64.62 -49.7 70.02 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.493 HD22 ' HG2' ' A' ' 27' ' ' LYS . 2.2 t-20 -73.08 -14.31 61.37 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.634 -0.666 . . . . 0.0 111.314 -179.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -94.55 -10.1 33.18 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.801 -1.187 . . . . 0.0 110.312 -178.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 97.38 12.6 47.84 Favored Glycine 0 N--CA 1.499 2.877 0 C-N-CA 120.237 -0.982 . . . . 0.0 110.77 178.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 14.3 mmtp -94.94 83.84 4.04 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.009 -1.289 . . . . 0.0 108.687 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 26.1 t -77.34 -56.45 7.87 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 O-C-N 121.79 -0.569 . . . . 0.0 110.009 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.496 ' H ' ' HD2' ' A' ' 85' ' ' LYS . 8.6 mptt -49.64 -39.42 35.94 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.221 -0.924 . . . . 0.0 108.648 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.547 ' OE1' ' N ' ' A' ' 86' ' ' GLU . 47.7 mp0 -70.18 -44.55 68.52 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 121.402 -0.811 . . . . 0.0 109.007 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.13 -38.91 86.38 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 119.359 -0.936 . . . . 0.0 109.338 -179.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.425 ' O ' ' N ' ' A' ' 91' ' ' ALA . 0.1 OUTLIER -61.39 -62.77 1.59 Allowed 'General case' 0 C--N 1.294 -1.825 0 CA-C-O 121.632 0.729 . . . . 0.0 109.607 179.796 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -49.76 -34.95 20.68 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.097 -1.002 . . . . 0.0 109.583 -179.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.531 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -62.03 -35.13 77.67 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 178.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.425 ' N ' ' O ' ' A' ' 88' ' ' GLN . . . -50.22 -43.43 52.78 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.027 -1.046 . . . . 0.0 108.204 178.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -62.8 -23.91 67.48 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 178.4 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.668 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -73.8 -37.92 64.77 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 106.441 -1.688 . . . . 0.0 106.441 177.87 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.435 HD12 ' N ' ' A' ' 94' ' ' LEU . 10.9 mp -68.29 -45.46 72.98 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -50.26 -38.99 43.63 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 107.85 -1.166 . . . . 0.0 107.85 179.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 34.7 m -72.79 -32.07 65.31 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.425 -0.797 . . . . 0.0 109.238 177.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.9 m -58.65 -46.97 85.99 Favored 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 4.3 mm -49.15 -40.91 13.76 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 179.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 10.1 ttt180 -64.5 -55.36 21.22 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 119.22 -0.992 . . . . 0.0 109.294 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.554 ' O ' ' NE2' ' A' ' 103' ' ' GLN . . . -63.4 -19.25 64.52 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.181 -0.949 . . . . 0.0 109.021 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.422 ' CD1' ' C ' ' A' ' 101' ' ' TYR . 9.1 t80 -74.56 -31.11 61.98 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 178.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.551 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -66.67 -42.36 86.7 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.998 -1.064 . . . . 0.0 110.096 -179.908 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.656 ' NE2' ' N ' ' A' ' 104' ' ' LYS . 2.0 pp0? -63.2 -15.76 57.99 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 116.808 -1.957 . . . . 0.0 105.778 179.443 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.656 ' N ' ' NE2' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -82.27 -34.19 28.84 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 106.759 -1.571 . . . . 0.0 106.759 175.572 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.527 ' CG ' ' O ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -91.76 6.36 46.28 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 179.338 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.32 0 N-CA-C 109.32 -1.512 . . . . 0.0 109.32 179.63 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.551 0 CA-C-O 121.276 0.56 . . . . 0.0 109.495 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -86.57 -26.01 24.71 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.224 -0.922 . . . . 0.0 109.185 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.7 pp -88.53 -32.14 18.33 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 107.175 -1.417 . . . . 0.0 107.175 179.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -67.94 -25.1 65.29 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 105.579 -2.008 . . . . 0.0 105.579 177.037 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -72.95 -36.52 67.18 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.638 ' OD1' ' HB2' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -56.95 -41.28 78.0 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 179.452 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.603 ' N ' HD22 ' A' ' 6' ' ' ASN . 16.9 m95 -57.88 -46.91 84.16 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.079 -1.013 . . . . 0.0 108.841 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -63.2 -28.89 70.35 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 120.884 -1.135 . . . . 0.0 108.548 179.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 89.0 m -68.55 -62.86 1.2 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.464 -0.773 . . . . 0.0 109.733 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.2 pp -57.25 -31.3 65.41 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 118.451 -1.3 . . . . 0.0 108.181 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -70.03 -62.59 1.33 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.072 -1.018 . . . . 0.0 109.651 178.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -58.11 -11.89 2.97 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.368 -0.832 . . . . 0.0 109.79 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.462 ' O ' HG22 ' A' ' 16' ' ' VAL . 2.1 m-20 -72.65 -53.23 12.36 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 179.063 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.2 mt -56.75 -24.85 52.92 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.667 -178.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -68.67 -54.99 12.92 Favored 'General case' 0 C--N 1.301 -1.52 0 C-N-CA 118.414 -1.314 . . . . 0.0 109.166 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.636 ' O ' ' N ' ' A' ' 20' ' ' ALA . 12.5 m -55.01 -20.96 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 120.731 -1.23 . . . . 0.0 110.448 -179.048 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.498 ' O ' ' N ' ' A' ' 20' ' ' ALA . 10.6 mt -71.53 -72.88 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 O-C-N 120.373 -1.454 . . . . 0.0 109.622 179.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -47.71 -27.37 1.93 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.837 -1.164 . . . . 0.0 108.749 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.4 -0.19 32.94 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.636 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -57.99 -49.0 78.34 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 179.405 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.476 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 0.5 OUTLIER 67.88 -12.33 0.31 Allowed 'General case' 0 C--N 1.296 -1.742 0 O-C-N 121.772 -0.58 . . . . 0.0 109.926 179.336 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.642 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -144.84 143.8 30.8 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.946 -1.096 . . . . 0.0 109.554 178.925 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.21 -24.91 57.7 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 121.882 -0.511 . . . . 0.0 111.193 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.46 -51.61 64.92 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.073 -1.017 . . . . 0.0 109.965 -179.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.509 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 9.4 mt-30 -68.46 -17.55 64.22 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.285 -0.885 . . . . 0.0 110.548 -179.475 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.442 HG12 ' HB2' ' A' ' 79' ' ' ALA . 48.9 t -71.74 -50.23 40.2 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 O-C-N 120.962 -1.087 . . . . 0.0 108.661 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.474 ' HG2' HD22 ' A' ' 80' ' ' ASN . 5.1 mppt? -54.5 -53.22 57.27 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 106.954 -1.498 . . . . 0.0 106.954 179.164 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -52.36 -38.87 59.86 Favored 'General case' 0 C--N 1.296 -1.738 0 CA-C-N 114.717 -1.129 . . . . 0.0 109.453 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.58 -67.75 0.46 Allowed 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.468 -0.77 . . . . 0.0 110.433 -179.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.493 ' HB3' HD12 ' A' ' 76' ' ' LEU . 33.9 mt -59.16 -25.77 64.2 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.345 -0.847 . . . . 0.0 109.913 -178.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.455 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 20.8 m -61.39 -38.98 89.01 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 179.124 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 33.1 mttm -74.17 -31.06 62.54 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . 0.442 ' SD ' HD23 ' A' ' 30' ' ' LEU . 41.2 mtp -66.65 -65.38 0.69 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.993 -1.067 . . . . 0.0 108.173 178.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.445 HH11 ' HD3' ' A' ' 34' ' ' ARG . 18.2 ttt-85 -47.68 -25.56 1.24 Allowed 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.0 -60.12 2.41 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 119.843 -0.743 . . . . 0.0 109.025 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.78 -33.21 75.15 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.018 -1.051 . . . . 0.0 109.826 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.48 -39.73 73.72 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.087 -1.008 . . . . 0.0 108.795 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.5 mt -65.96 -32.11 73.41 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.405 -0.809 . . . . 0.0 108.878 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -86.22 -36.61 19.33 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.224 -0.922 . . . . 0.0 109.986 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.638 ' HB2' ' OD1' ' A' ' 6' ' ' ASN . . . -60.02 -22.24 62.36 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.151 -0.968 . . . . 0.0 110.461 -179.075 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.579 ' C ' ' H ' ' A' ' 43' ' ' ALA . 1.1 tm0? -48.84 -66.54 0.38 Allowed 'General case' 0 C--N 1.3 -1.556 0 O-C-N 120.879 -1.138 . . . . 0.0 109.335 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.557 ' NZ ' ' NE2' ' A' ' 41' ' ' GLN . 2.8 mptp? -53.96 5.04 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.625 -0.672 . . . . 0.0 110.71 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.579 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -78.48 134.47 37.32 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.607 -1.308 . . . . 0.0 109.515 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -152.18 72.1 7.74 Favored Pre-proline 0 N--CA 1.492 1.656 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.44 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 52.0 Cg_exo -46.81 -39.12 23.91 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.521 2.147 . . . . 0.0 113.905 -179.305 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.44 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 89.5 Cg_endo -97.63 -95.75 0.0 OUTLIER 'Trans proline' 0 C--N 1.319 -1.02 0 C-N-CA 122.426 2.084 . . . . 0.0 111.852 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 4.0 pttt -175.6 116.57 0.15 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.283 -0.886 . . . . 0.0 110.005 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.54 ' CD2' ' H ' ' A' ' 49' ' ' GLU . 0.4 OUTLIER -83.86 -172.66 4.28 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 178.116 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.54 ' H ' ' CD2' ' A' ' 48' ' ' LEU . 59.8 mt-10 49.27 23.3 0.79 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.76 -1.212 . . . . 0.0 108.814 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.403 ' N ' ' C ' ' A' ' 48' ' ' LEU . 4.3 m-20 -140.49 -70.5 0.38 Allowed 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.421 ' HG3' ' N ' ' A' ' 52' ' ' SER . 17.5 pttp -66.96 -121.69 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 178.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.421 ' N ' ' HG3' ' A' ' 51' ' ' LYS . 9.1 t -81.89 114.1 47.91 Favored Pre-proline 0 N--CA 1.488 1.446 0 O-C-N 120.539 -1.351 . . . . 0.0 109.581 179.134 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -90.19 -16.24 1.8 Allowed 'Trans proline' 0 N--CA 1.491 1.372 0 C-N-CA 122.452 2.101 . . . . 0.0 112.023 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 65.05 -131.6 0.27 Allowed 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 -178.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.756 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 7.5 t -170.06 -33.84 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 120.859 -1.151 . . . . 0.0 112.363 179.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.756 ' CD ' ' H ' ' A' ' 55' ' ' SER . 95.0 Cg_exo -51.52 59.35 0.02 OUTLIER 'Trans proline' 0 N--CA 1.505 2.178 0 C-N-CA 122.608 2.205 . . . . 0.0 114.116 -178.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.634 ' N ' ' O ' ' A' ' 55' ' ' SER . 93.5 mt-10 42.42 29.51 0.16 Allowed 'General case' 0 N--CA 1.493 1.725 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.473 ' SD ' ' C ' ' A' ' 57' ' ' GLU . 1.3 mpt? 65.27 -8.17 0.27 Allowed 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 -178.107 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.61 ' H ' ' C ' ' A' ' 57' ' ' GLU . 2.4 tmtm? -48.1 -43.27 30.77 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-O 121.804 0.811 . . . . 0.0 109.169 179.296 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -56.29 -27.08 54.23 Favored 'General case' 0 C--N 1.294 -1.834 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 -179.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -73.94 -53.14 10.78 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.5 mtt85 -61.79 -33.0 73.33 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.392 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.427 ' O ' ' N ' ' A' ' 67' ' ' ILE . 0.7 OUTLIER -63.29 -35.88 81.84 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.226 -0.921 . . . . 0.0 108.704 179.594 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.34 -31.82 80.11 Favored Glycine 0 N--CA 1.485 1.915 0 N-CA-C 108.326 -1.91 . . . . 0.0 108.326 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.466 ' HZ ' ' HZ1' ' A' ' 104' ' ' LYS . 65.4 m-85 -81.67 -38.01 26.56 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 178.011 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -72.14 -47.4 51.33 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.427 ' N ' ' O ' ' A' ' 63' ' ' HIS . 4.8 mm -56.2 -48.88 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 179.037 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 14.8 tp -57.41 -44.93 84.99 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 65' ' ' PHE . 32.1 t -65.92 -19.93 26.49 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.366 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 178.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -77.75 -48.39 7.92 Favored Glycine 0 N--CA 1.488 2.145 0 C-N-CA 120.1 -1.047 . . . . 0.0 110.549 -178.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.58 ' C ' HE21 ' A' ' 71' ' ' GLN . 0.0 OUTLIER -71.37 -29.79 65.38 Favored 'General case' 0 C--N 1.305 -1.341 0 O-C-N 120.823 -1.398 . . . . 0.0 107.583 179.725 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 8.1 mt -75.16 -33.64 29.27 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.507 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 176.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -62.74 -58.69 6.59 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.256 -0.902 . . . . 0.0 109.332 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.72 -26.81 67.45 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.64 -31.13 63.35 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 107.821 -1.178 . . . . 0.0 107.821 178.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.493 HD12 ' HB3' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -57.07 -33.55 67.38 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 106.236 -1.764 . . . . 0.0 106.236 178.155 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.8 tptt -68.16 -48.17 66.06 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.517 179.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.5 mp -57.69 -34.95 69.97 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.442 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -64.21 -50.4 68.2 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 178.212 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.474 HD22 ' HG2' ' A' ' 27' ' ' LYS . 2.1 t-20 -73.44 -12.0 60.65 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.47 -0.769 . . . . 0.0 111.352 -179.11 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -95.12 -12.81 25.8 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.663 -1.273 . . . . 0.0 110.23 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 99.28 11.85 43.96 Favored Glycine 0 N--CA 1.495 2.607 0 C-N-CA 120.206 -0.997 . . . . 0.0 110.688 179.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.3 mmtp -93.65 78.68 4.28 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 120.887 -1.361 . . . . 0.0 108.135 179.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 26.3 t -75.91 -50.67 22.37 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.679 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.72 -179.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.455 ' H ' ' HD2' ' A' ' 85' ' ' LYS . 6.9 mptt -53.0 -38.7 62.53 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 120.936 -1.102 . . . . 0.0 108.18 179.119 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.541 ' N ' ' CD ' ' A' ' 86' ' ' GLU . 4.7 mp0 -69.08 -42.95 75.52 Favored 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 178.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.5 -51.97 44.72 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 119.532 -0.867 . . . . 0.0 109.707 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.5 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -60.44 -49.45 77.51 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 -179.893 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -55.0 -37.29 66.39 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.853 -1.155 . . . . 0.0 108.402 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.518 ' O ' ' N ' ' A' ' 93' ' ' GLN . . . -65.68 -31.91 73.18 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 178.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.5 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -49.87 -43.24 49.09 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 178.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -65.43 -27.51 68.57 Favored 'General case' 0 C--N 1.306 -1.285 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 178.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.668 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -73.42 -41.25 63.5 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 106.605 -1.628 . . . . 0.0 106.605 177.805 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.449 HD11 ' OE1' ' A' ' 71' ' ' GLN . 7.4 mp -67.56 -37.05 82.1 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 108.315 -0.995 . . . . 0.0 108.315 179.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 2.4 mtpt -53.89 -39.42 65.75 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 120.049 -1.657 . . . . 0.0 106.685 177.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.3 m -71.05 -26.01 62.89 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.431 ' O ' ' N ' ' A' ' 101' ' ' TYR . 1.2 m -60.84 -46.33 91.0 Favored 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 179.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 81.4 mt -51.33 -43.01 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 179.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -62.95 -56.76 14.33 Favored 'General case' 0 C--N 1.307 -1.269 0 C-N-CA 119.633 -0.827 . . . . 0.0 109.816 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.432 ' O ' ' HG3' ' A' ' 103' ' ' GLN . . . -63.68 -21.68 66.51 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.858 -1.151 . . . . 0.0 108.828 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.629 ' CE2' ' NZ ' ' A' ' 104' ' ' LYS . 11.2 t80 -75.89 -27.46 57.72 Favored 'General case' 0 C--N 1.291 -1.938 0 O-C-N 120.351 -1.468 . . . . 0.0 107.328 178.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.538 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -67.06 -36.25 81.63 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 119.588 -0.845 . . . . 0.0 109.944 -179.762 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.622 HE21 ' N ' ' A' ' 104' ' ' LYS . 1.3 pp0? -65.32 -23.68 67.07 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 105.158 -2.164 . . . . 0.0 105.158 178.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.629 ' NZ ' ' CE2' ' A' ' 101' ' ' TYR . 0.0 OUTLIER -80.95 -30.86 35.13 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 176.601 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.549 ' CD1' ' C ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -94.84 7.74 44.96 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.186 -0.947 . . . . 0.0 108.782 179.994 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.406 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.492 2.413 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.575 0 CA-C-O 121.354 0.597 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -86.22 -20.92 27.8 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.275 -0.891 . . . . 0.0 109.296 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 60.9 mt -89.26 -48.27 7.48 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -63.64 -23.71 67.49 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 178.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -72.97 -47.37 45.97 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.558 HD22 ' N ' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -53.99 -38.85 65.51 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 -179.814 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.558 ' N ' HD22 ' A' ' 6' ' ' ASN . 8.2 m95 -55.89 -55.58 30.87 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.146 -0.971 . . . . 0.0 109.621 -179.397 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -52.47 -29.8 26.62 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 120.586 -1.321 . . . . 0.0 109.689 -179.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 53.5 m -68.94 -65.38 0.71 Allowed 'General case' 0 N--CA 1.487 1.421 0 O-C-N 120.837 -1.165 . . . . 0.0 109.599 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.6 pp -57.99 -30.29 65.94 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 118.66 -1.216 . . . . 0.0 108.454 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.62 -59.94 2.49 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.862 -1.149 . . . . 0.0 109.209 178.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.5 t0 -57.38 -13.09 3.01 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.291 -0.881 . . . . 0.0 109.632 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.456 ' O ' HG22 ' A' ' 16' ' ' VAL . 2.1 m-20 -72.73 -52.37 15.41 Favored 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 107.166 -1.42 . . . . 0.0 107.166 179.214 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.6 mt -56.16 -25.9 48.33 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-O 121.058 0.456 . . . . 0.0 110.779 -179.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 25.3 ttmt -68.68 -56.16 9.08 Favored 'General case' 0 C--N 1.3 -1.55 0 C-N-CA 118.669 -1.212 . . . . 0.0 109.215 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.643 ' O ' ' N ' ' A' ' 20' ' ' ALA . 14.3 m -54.28 -20.42 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 C-N-CA 118.771 -1.172 . . . . 0.0 110.578 -178.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 9.3 mt -71.28 -72.08 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 O-C-N 120.339 -1.476 . . . . 0.0 109.093 179.212 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -48.47 -27.4 2.65 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.871 -1.143 . . . . 0.0 108.639 179.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -101.61 0.2 35.9 Favored 'General case' 0 N--CA 1.495 1.825 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.643 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . -59.93 -43.56 94.87 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 179.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.513 ' C ' ' ND2' ' A' ' 22' ' ' ASN . 21.6 m-20 59.46 -9.08 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.036 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.621 ' ND2' ' N ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -146.32 143.29 29.03 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 120.604 -1.31 . . . . 0.0 109.653 178.609 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.78 -29.71 54.89 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.679 -0.638 . . . . 0.0 111.423 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.67 -50.85 70.82 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.958 -1.089 . . . . 0.0 110.107 -178.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.499 ' NE2' ' O ' ' A' ' 20' ' ' ALA . 6.3 mt-30 -68.7 -19.11 64.36 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.137 -0.977 . . . . 0.0 110.395 -179.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.484 HG12 ' HB2' ' A' ' 79' ' ' ALA . 43.0 t -71.95 -50.59 36.67 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 120.945 -1.097 . . . . 0.0 108.709 179.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.474 ' HG2' HD22 ' A' ' 80' ' ' ASN . 5.1 mtpt -54.79 -55.3 31.57 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 179.359 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -50.31 -38.36 41.19 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.85 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.56 -62.89 1.2 Allowed 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.243 -0.911 . . . . 0.0 110.05 -179.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 71.7 mt -61.46 -20.47 63.16 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.378 -0.826 . . . . 0.0 110.25 -179.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.432 ' OG1' ' O ' ' A' ' 27' ' ' LYS . 56.7 m -61.21 -47.48 85.9 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 178.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.492 ' NZ ' ' CB ' ' A' ' 32' ' ' LYS . 0.4 OUTLIER -70.93 -25.81 62.91 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 121.807 -0.558 . . . . 0.0 109.793 -179.028 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' MET . . . . . 0.448 ' C ' ' N ' ' A' ' 35' ' ' ALA . 28.2 mtp -67.35 -66.94 0.5 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.784 -1.197 . . . . 0.0 108.905 178.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 22.0 ttt-85 -48.37 -21.58 0.55 Allowed 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.448 ' N ' ' C ' ' A' ' 33' ' ' MET . . . -75.06 -63.02 1.35 Allowed 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 178.201 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.25 -28.52 69.78 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.163 -0.961 . . . . 0.0 109.565 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.79 -41.83 87.6 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.071 -1.018 . . . . 0.0 108.648 179.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 22.7 mt -65.91 -28.62 69.08 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -85.94 -35.63 20.35 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.26 -0.9 . . . . 0.0 109.821 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.441 ' O ' ' CB ' ' A' ' 43' ' ' ALA . . . -55.64 -29.83 59.93 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.028 -1.045 . . . . 0.0 108.974 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.478 ' C ' ' NE2' ' A' ' 41' ' ' GLN . 1.0 OUTLIER -48.06 -53.02 17.78 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-O 122.112 0.958 . . . . 0.0 108.546 178.824 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.434 ' HG2' ' H ' ' A' ' 42' ' ' LYS . 1.6 mmmm -65.35 6.92 0.24 Allowed 'General case' 0 C--N 1.297 -1.688 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.762 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.463 ' H ' ' C ' ' A' ' 41' ' ' GLN . . . -81.66 145.56 30.5 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.827 -1.17 . . . . 0.0 110.127 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.6 p -152.05 67.91 7.19 Favored Pre-proline 0 N--CA 1.492 1.661 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.443 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 73.3 Cg_exo -42.87 -38.7 7.05 Favored 'Trans proline' 0 C--N 1.304 -1.795 0 C-N-CA 122.457 2.105 . . . . 0.0 113.376 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.443 ' CD ' ' N ' ' A' ' 45' ' ' PRO . 94.3 Cg_endo -103.07 -98.04 0.0 OUTLIER 'Trans proline' 0 C--N 1.32 -0.935 0 C-N-CA 122.647 2.232 . . . . 0.0 111.983 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.2 102.78 0.08 Allowed 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 -179.348 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.441 ' O ' HD23 ' A' ' 48' ' ' LEU . 1.2 tt -82.05 34.61 0.41 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.796 -1.19 . . . . 0.0 109.733 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.437 ' O ' ' OD1' ' A' ' 50' ' ' ASP . 7.4 pt-20 -133.84 22.67 3.9 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 178.28 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.437 ' OD1' ' O ' ' A' ' 49' ' ' GLU . 0.4 OUTLIER -151.75 -44.76 0.11 Allowed 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -179.161 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.475 ' HG3' ' N ' ' A' ' 52' ' ' SER . 10.3 ptmm? -66.89 -152.78 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.55 -0.719 . . . . 0.0 109.543 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.475 ' N ' ' HG3' ' A' ' 51' ' ' LYS . 7.5 t -77.03 118.73 73.87 Favored Pre-proline 0 N--CA 1.485 1.315 0 O-C-N 120.787 -1.195 . . . . 0.0 109.173 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -83.54 -15.36 7.44 Favored 'Trans proline' 0 N--CA 1.493 1.477 0 C-N-CA 122.327 2.018 . . . . 0.0 111.761 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 47.9 t0 60.47 -132.84 0.79 Allowed 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 -179.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.813 ' H ' ' CD ' ' A' ' 56' ' ' PRO . 11.7 t -165.6 -26.97 0.0 OUTLIER Pre-proline 0 N--CA 1.495 1.79 0 O-C-N 120.328 -1.483 . . . . 0.0 113.898 -179.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.813 ' CD ' ' H ' ' A' ' 55' ' ' SER . 62.7 Cg_exo -56.51 47.29 0.04 OUTLIER 'Trans proline' 0 N--CA 1.504 2.106 0 C-N-CA 122.204 1.936 . . . . 0.0 113.346 -179.605 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.61 ' N ' ' O ' ' A' ' 55' ' ' SER . 0.6 OUTLIER 48.64 27.5 1.52 Allowed 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 -179.005 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.498 ' SD ' ' OE2' ' A' ' 57' ' ' GLU . 1.6 mpp? 64.04 -4.75 0.35 Allowed 'General case' 0 C--N 1.308 -1.202 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -178.213 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.545 ' H ' ' C ' ' A' ' 57' ' ' GLU . 0.1 OUTLIER -48.2 -44.76 33.06 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.947 0.88 . . . . 0.0 108.668 179.009 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.412 ' H ' ' HB2' ' A' ' 56' ' ' PRO . 2.7 t70 -56.41 -25.92 51.62 Favored 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.488 ' N ' ' O ' ' A' ' 58' ' ' MET . 15.6 t80 -76.18 -54.08 7.34 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 177.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.4 mtt85 -59.55 -30.35 68.56 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 179.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.703 ' CE1' HD11 ' A' ' 67' ' ' ILE . 2.4 t60 -61.98 -40.97 97.44 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -62.16 -33.57 86.3 Favored Glycine 0 N--CA 1.484 1.863 0 N-CA-C 109.091 -1.604 . . . . 0.0 109.091 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -81.79 -37.9 26.42 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.012 -1.287 . . . . 0.0 108.264 178.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -71.99 -47.44 52.0 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 178.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.703 HD11 ' CE1' ' A' ' 63' ' ' HIS . 15.8 mm -54.55 -45.09 71.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 12.8 tp -57.81 -44.49 86.42 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 42.6 t -60.7 -15.15 10.75 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 O-C-N 121.076 -1.015 . . . . 0.0 109.265 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -79.64 -47.66 7.15 Favored Glycine 0 N--CA 1.49 2.265 0 C-N-CA 119.786 -1.197 . . . . 0.0 110.682 -179.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.55 ' C ' HE21 ' A' ' 71' ' ' GLN . 0.0 OUTLIER -69.6 -29.84 67.46 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.699 -1.471 . . . . 0.0 107.532 179.894 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 4.7 mt -73.46 -34.34 42.46 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 176.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -63.28 -56.11 19.22 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.445 -0.784 . . . . 0.0 109.694 -179.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -62.2 -29.09 70.14 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.225 -0.922 . . . . 0.0 109.354 -179.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.31 -29.59 62.8 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 120.642 -1.286 . . . . 0.0 108.229 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.69 -33.84 66.84 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 106.211 -1.774 . . . . 0.0 106.211 178.161 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 10.1 tptt -68.4 -46.79 69.03 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.301 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.8 mp -57.4 -35.1 69.6 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.484 ' HB2' HG12 ' A' ' 26' ' ' VAL . . . -63.74 -50.1 70.41 Favored 'General case' 0 C--N 1.297 -1.705 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 178.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.474 HD22 ' HG2' ' A' ' 27' ' ' LYS . 1.9 t-20 -74.87 -13.07 60.51 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.494 -0.753 . . . . 0.0 111.616 -178.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -93.84 -9.23 38.04 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 120.606 -1.309 . . . . 0.0 110.205 -179.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 97.35 12.65 47.78 Favored Glycine 0 N--CA 1.499 2.854 0 O-C-N 121.032 -1.042 . . . . 0.0 110.592 178.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.4 mmtp -95.08 81.24 3.66 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.044 -1.268 . . . . 0.0 108.127 179.235 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 53.1 t -76.51 -61.83 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.414 -178.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.3 mtmm -49.81 -34.95 21.13 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.03 -1.044 . . . . 0.0 108.427 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.611 ' CD ' ' H ' ' A' ' 86' ' ' GLU . 29.8 mp0 -68.27 -45.8 72.17 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 178.216 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.13 -46.52 73.86 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 119.463 -0.895 . . . . 0.0 108.871 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.474 ' O ' ' HB3' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -59.71 -51.88 67.9 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 179.456 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.24 -33.85 71.5 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 120.902 -1.124 . . . . 0.0 108.338 179.049 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -66.35 -26.95 67.52 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 178.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' A' ' 88' ' ' GLN . . . -56.64 -47.45 79.7 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 178.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -64.72 -22.79 67.06 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 178.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.705 ' C ' HE21 ' A' ' 93' ' ' GLN . 0.0 OUTLIER -72.93 -39.59 66.14 Favored 'General case' 0 N--CA 1.485 1.275 0 N-CA-C 106.18 -1.785 . . . . 0.0 106.18 177.908 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.433 ' CD1' ' OE1' ' A' ' 71' ' ' GLN . 3.9 mp -63.46 -50.63 68.96 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 178.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 4.5 mtpp -50.33 -42.53 52.97 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 178.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 5.3 m -70.88 -40.95 71.95 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.34 -0.85 . . . . 0.0 109.034 179.048 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -61.15 -40.43 93.84 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 72.9 mt -54.94 -33.15 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -59.32 -50.82 72.52 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 119.656 -0.818 . . . . 0.0 109.564 -179.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.66 -34.91 78.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.824 -1.172 . . . . 0.0 108.619 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.489 ' CD1' ' C ' ' A' ' 101' ' ' TYR . 1.1 t80 -68.09 -26.11 65.66 Favored 'General case' 0 C--N 1.293 -1.871 0 O-C-N 120.579 -1.326 . . . . 0.0 107.829 179.131 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.527 ' C ' ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -65.92 -34.91 79.21 Favored 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 119.162 -1.015 . . . . 0.0 110.057 -179.442 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.576 HE21 ' N ' ' A' ' 104' ' ' LYS . 1.1 pp0? -65.68 -21.83 66.58 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 104.759 -2.311 . . . . 0.0 104.759 178.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.576 ' N ' HE21 ' A' ' 103' ' ' GLN . 0.0 OUTLIER -79.5 -33.9 41.74 Favored 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 176.849 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.549 ' CD1' ' C ' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -94.1 3.14 55.72 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.122 -0.986 . . . . 0.0 108.442 179.016 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.52 ' N ' ' O ' ' A' ' 102' ' ' ASN . . . . . . . . 0 N--CA 1.491 2.36 0 CA-C-O 118.049 -1.417 . . . . 0.0 109.625 -179.91 . . . . . . . . 1 1 . 1 stop_ save_