data_2baf_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 2baf _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 ' 49' ' ' ARG . . . . . 0.565 HH11 ' CG ' ' A' ' 49' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.494 1.774 0 CA-C-O 121.224 0.535 . . . . 0.0 109.585 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.438 ' O ' ' O ' ' A' ' 49' ' ' ARG . 95.9 p -59.82 -150.69 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.341 -0.85 . . . . 0.0 109.621 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.57 ' SG ' ' N ' ' A' ' 52' ' ' SER . 10.3 t 50.84 -100.69 0.09 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.076 -1.015 . . . . 0.0 109.15 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' SER . . . . . 0.618 ' HG ' ' H ' ' A' ' 53' ' ' LYS . 16.3 t -71.81 -165.35 0.16 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.223 -0.923 . . . . 0.0 108.967 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.618 ' H ' ' HG ' ' A' ' 52' ' ' SER . 19.4 tptm -120.87 106.17 11.39 Favored 'General case' 0 N--CA 1.498 1.969 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 9.9 t -125.99 117.82 49.99 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.522 -0.736 . . . . 0.0 109.541 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 12.1 tt -122.77 119.64 58.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 71.1 p -131.61 113.46 13.64 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.536 -0.728 . . . . 0.0 109.157 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.551 ' N ' ' OG1' ' A' ' 69' ' ' THR . 11.9 mtpt -121.85 112.73 18.71 Favored 'General case' 0 N--CA 1.513 2.697 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 178.781 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 81.8 p -119.07 128.7 54.58 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.575 -0.703 . . . . 0.0 109.613 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.7 m -131.63 126.1 57.12 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 178.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.57 133.98 52.81 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.721 -0.612 . . . . 0.0 109.635 -179.781 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -123.42 162.45 22.78 Favored 'General case' 0 N--CA 1.518 2.944 0 O-C-N 121.186 -0.946 . . . . 0.0 109.229 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.515 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -67.22 -41.12 86.27 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.622 -1.299 . . . . 0.0 112.635 -177.383 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.508 ' N ' ' OD1' ' A' ' 63' ' ' ASP . 18.8 p-10 -68.17 8.55 0.42 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.351 -1.468 . . . . 0.0 110.201 -177.568 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.515 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 85.55 9.25 79.14 Favored Glycine 0 N--CA 1.493 2.446 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 179.218 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -83.49 100.65 10.89 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 120.912 -1.346 . . . . 0.0 107.435 178.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.4 p -131.68 113.29 13.4 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.469 -0.77 . . . . 0.0 110.068 -178.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -94.64 120.53 35.02 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.437 -0.79 . . . . 0.0 109.79 -179.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.4 p -101.36 110.58 22.61 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.396 -0.815 . . . . 0.0 109.248 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.551 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 28.0 p -111.21 29.4 7.83 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 179.02 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.4 ptmt -65.44 67.48 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 69' ' ' THR . 72.0 mm-40 -101.63 156.83 17.25 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.335 -0.853 . . . . 0.0 109.989 -179.249 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.5 p -128.35 129.78 69.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 179.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.444 ' O ' ' O ' ' A' ' 53' ' ' LYS . 96.8 t -113.75 132.18 63.45 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 CA-C-O 122.279 1.037 . . . . 0.0 109.352 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.5 mmmt . . . . . 0 C--N 1.291 -1.966 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 179.594 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.429 ' O ' ' O ' ' A' ' 50' ' ' SER . 20.9 mmm180 . . . . . 0 N--CA 1.503 2.202 0 CA-C-O 121.314 0.578 . . . . 0.0 109.469 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.429 ' O ' ' O ' ' A' ' 49' ' ' ARG . 29.3 m -58.57 -156.81 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.278 -0.889 . . . . 0.0 109.945 -179.796 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.582 ' SG ' ' N ' ' A' ' 52' ' ' SER . 46.0 t 48.86 -119.41 1.19 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.295 -0.878 . . . . 0.0 109.346 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' SER . . . . . 0.582 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 42.0 m -60.64 128.09 34.91 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.058 -1.026 . . . . 0.0 108.843 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.442 ' O ' ' O ' ' A' ' 73' ' ' VAL . 0.0 OUTLIER -74.46 102.4 4.45 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.842 -1.161 . . . . 0.0 109.195 -179.419 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 10.3 p -126.01 116.02 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 17.9 tt -127.71 129.34 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 51.0 p -130.05 114.56 15.94 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.395 -0.816 . . . . 0.0 109.311 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.706 ' H ' ' HG1' ' A' ' 69' ' ' THR . 7.8 mtmt -121.4 113.5 19.97 Favored 'General case' 0 N--CA 1.514 2.771 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 178.692 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 65.9 p -116.38 136.29 53.13 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.479 -0.763 . . . . 0.0 109.886 -179.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.401 ' O ' ' CG2' ' A' ' 59' ' ' VAL . 2.7 m -131.72 124.05 53.13 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 178.538 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -108.97 133.45 52.95 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.763 -0.586 . . . . 0.0 110.196 -179.161 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.479 ' OD1' ' N ' ' A' ' 62' ' ' ALA . 26.3 t-20 -125.46 158.78 33.57 Favored 'General case' 0 N--CA 1.516 2.827 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.503 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -71.66 -31.52 66.92 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 120.365 -1.459 . . . . 0.0 112.445 -177.744 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -69.88 8.57 0.68 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.499 -1.376 . . . . 0.0 109.638 -178.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.503 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 85.36 5.27 85.3 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.722 -1.351 . . . . 0.0 109.722 179.505 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 64.0 ttt180 -83.43 103.02 12.46 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.77 -1.43 . . . . 0.0 107.929 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 12.2 p -132.66 108.54 9.11 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.473 -0.767 . . . . 0.0 109.703 -178.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -94.92 130.52 41.5 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.226 -0.922 . . . . 0.0 109.933 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.5 p -108.96 107.52 17.93 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.479 -0.763 . . . . 0.0 109.407 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.706 ' HG1' ' H ' ' A' ' 57' ' ' LYS . 30.8 p -97.78 33.01 2.18 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 178.627 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 74.2 mttt -66.71 67.63 0.06 Allowed 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 179.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.48 ' N ' ' O ' ' A' ' 69' ' ' THR . 74.3 mt-10 -98.0 149.85 22.0 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.169 -0.957 . . . . 0.0 110.142 -179.05 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.6 t -129.04 117.16 43.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.442 ' O ' ' O ' ' A' ' 53' ' ' LYS . 59.4 t -114.79 126.85 72.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 CA-C-O 122.105 0.955 . . . . 0.0 109.349 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 50.8 mttp . . . . . 0 C--N 1.289 -2.041 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 179.5 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.516 HH11 ' CG ' ' A' ' 49' ' ' ARG . 0.9 OUTLIER . . . . . 0 N--CA 1.499 2.018 0 CA-C-O 121.2 0.524 . . . . 0.0 109.621 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 36.8 t -62.39 -105.01 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.266 -0.896 . . . . 0.0 109.234 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 5.6 t -49.75 146.11 4.68 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.145 -0.972 . . . . 0.0 108.818 179.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 40.3 t 50.54 87.49 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.007 -1.058 . . . . 0.0 108.342 -179.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -75.84 104.84 6.56 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.307 -0.87 . . . . 0.0 110.292 -178.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 11.7 p -115.61 113.6 43.84 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 10.1 tp -128.52 125.44 63.69 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 65.4 p -128.89 111.41 13.03 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.359 -0.838 . . . . 0.0 109.278 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.401 ' H ' ' HB ' ' A' ' 69' ' ' THR . 0.1 OUTLIER -124.55 113.59 18.28 Favored 'General case' 0 N--CA 1.51 2.561 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 178.767 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.0 p -110.95 130.22 55.65 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.467 -0.771 . . . . 0.0 109.67 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.43 ' O ' ' CG2' ' A' ' 59' ' ' VAL . 2.8 m -132.55 120.3 41.77 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.14 0 O-C-N 121.481 -0.762 . . . . 0.0 109.207 178.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 33.9 p -109.11 133.86 52.46 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 37.6 t-20 -128.37 162.33 27.36 Favored 'General case' 0 N--CA 1.514 2.769 0 O-C-N 121.46 -0.775 . . . . 0.0 109.317 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.441 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -71.91 -32.38 67.32 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 120.559 -1.338 . . . . 0.0 112.558 -177.641 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -69.21 5.59 1.21 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.372 -1.455 . . . . 0.0 109.953 -178.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.441 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 90.79 4.76 69.33 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 110.08 -1.208 . . . . 0.0 110.08 179.227 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 11.2 mpt_? -80.67 94.24 6.3 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 120.636 -1.508 . . . . 0.0 107.86 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 31.0 p -120.36 89.66 3.17 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -94.73 122.21 37.11 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.268 -0.895 . . . . 0.0 110.051 -178.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.455 ' C ' ' H ' ' A' ' 70' ' ' LYS . 40.8 p -101.19 109.18 21.01 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.329 -0.857 . . . . 0.0 109.581 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.524 ' O ' ' N ' ' A' ' 71' ' ' GLU . 5.2 m -87.4 31.19 0.75 Allowed 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 178.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.455 ' H ' ' C ' ' A' ' 68' ' ' THR . 16.5 ptmt -64.84 59.01 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.524 ' N ' ' O ' ' A' ' 69' ' ' THR . 13.7 mm-40 -96.3 136.78 36.33 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.053 -1.029 . . . . 0.0 109.481 -179.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 10.4 m -128.15 129.8 69.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 15.1 t -129.08 114.32 31.89 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 CA-C-O 122.057 0.932 . . . . 0.0 108.946 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.292 -1.928 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.604 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.475 ' O ' ' O ' ' A' ' 52' ' ' SER . 22.6 mmt180 . . . . . 0 N--CA 1.499 2.013 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.514 ' C ' ' H ' ' A' ' 52' ' ' SER . 29.5 t -78.71 -36.84 42.83 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.063 -1.023 . . . . 0.0 110.22 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 25.9 p -56.02 -4.02 0.11 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.029 -1.044 . . . . 0.0 109.744 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' SER . . . . . 0.524 ' OG ' ' N ' ' A' ' 53' ' ' LYS . 0.9 OUTLIER -166.26 -175.17 3.17 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 -179.78 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.524 ' N ' ' OG ' ' A' ' 52' ' ' SER . 44.6 tptt -103.89 101.67 11.46 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 120.95 -1.094 . . . . 0.0 108.049 179.176 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 21.7 t -127.63 114.73 37.03 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.875 0 O-C-N 121.479 -0.763 . . . . 0.0 109.975 -179.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.491 ' CG2' ' NZ ' ' A' ' 57' ' ' LYS . 35.9 mm -117.84 113.64 42.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 179.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 81.7 p -130.34 112.97 13.79 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.223 -0.923 . . . . 0.0 109.937 -179.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.57 ' N ' ' OG1' ' A' ' 69' ' ' THR . 10.9 mmtp -123.86 114.19 19.52 Favored 'General case' 0 N--CA 1.515 2.777 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 178.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 53.3 m -119.5 124.43 46.44 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.609 -0.682 . . . . 0.0 109.613 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.8 m -131.48 124.88 55.47 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.187 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.0 t -109.23 122.93 48.38 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.757 -0.589 . . . . 0.0 110.323 -179.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -110.56 144.94 38.66 Favored 'General case' 0 N--CA 1.513 2.685 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.506 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -62.82 -34.7 77.86 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 120.084 -1.635 . . . . 0.0 112.944 -177.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -66.24 5.63 0.52 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.355 -1.466 . . . . 0.0 110.045 -178.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.506 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 90.83 5.49 68.41 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 110.423 -1.071 . . . . 0.0 110.423 178.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 41.2 ttm180 -90.54 111.98 23.47 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.644 -1.504 . . . . 0.0 107.834 178.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.8 p -138.47 116.95 12.04 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.255 -0.903 . . . . 0.0 109.81 -179.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -94.35 119.51 33.21 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.281 -0.887 . . . . 0.0 109.77 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.0 p -103.46 109.0 20.49 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.431 -0.793 . . . . 0.0 109.395 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.57 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 4.6 p -111.62 26.72 10.35 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 107.383 -1.339 . . . . 0.0 107.383 178.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 36.4 pttt -65.36 65.9 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' A' ' 69' ' ' THR . 46.5 mt-10 -102.34 156.69 17.42 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.373 -0.83 . . . . 0.0 110.26 -179.121 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.3 p -127.56 136.32 60.8 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.449 ' O ' ' CB ' ' A' ' 74' ' ' LYS . 20.1 t -129.44 117.53 42.98 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.101 0 CA-C-O 121.972 0.891 . . . . 0.0 109.921 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.449 ' CB ' ' O ' ' A' ' 73' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.497 1.884 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.427 ' O ' ' O ' ' A' ' 50' ' ' SER . 32.9 ttp180 . . . . . 0 N--CA 1.496 1.849 0 CA-C-O 121.43 0.634 . . . . 0.0 110.286 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.427 ' O ' ' O ' ' A' ' 49' ' ' ARG . 11.9 m 53.45 171.36 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.338 -0.851 . . . . 0.0 110.206 179.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.448 ' SG ' ' N ' ' A' ' 52' ' ' SER . 6.2 p -58.88 -62.05 2.17 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.387 -0.821 . . . . 0.0 109.165 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' SER . . . . . 0.448 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 9.0 t -49.27 146.05 4.02 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.077 -1.015 . . . . 0.0 108.764 179.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -84.1 102.02 12.24 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 120.999 -1.063 . . . . 0.0 109.689 -179.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.415 ' CG1' ' O ' ' A' ' 54' ' ' VAL . 13.6 p -125.82 117.12 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 CA-C-O 121.576 0.703 . . . . 0.0 109.107 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 7.3 tp -128.36 138.4 54.75 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 49.0 m -128.07 113.31 15.62 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.35 -0.844 . . . . 0.0 109.518 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.427 ' O ' ' OG1' ' A' ' 69' ' ' THR . 5.5 mtmm -125.14 116.26 21.76 Favored 'General case' 0 N--CA 1.511 2.61 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 178.582 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.4 t -116.81 141.29 48.4 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.395 -0.816 . . . . 0.0 109.92 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.427 ' O ' ' CG2' ' A' ' 59' ' ' VAL . 2.8 m -132.31 120.8 44.29 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.16 0 O-C-N 121.554 -0.716 . . . . 0.0 109.311 179.067 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 32.0 p -110.16 133.36 53.3 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.836 -0.54 . . . . 0.0 109.841 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.429 ' OD1' ' N ' ' A' ' 62' ' ' ALA . 16.2 t-20 -137.55 172.18 13.36 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.367 -0.833 . . . . 0.0 109.734 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.468 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -63.32 -39.96 96.0 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.85 -1.156 . . . . 0.0 112.621 -177.357 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 35.9 m-20 -68.8 6.04 0.97 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.445 -1.409 . . . . 0.0 109.929 -178.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.519 ' O ' ' N ' ' A' ' 66' ' ' THR . . . 89.22 8.69 68.28 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.865 -1.294 . . . . 0.0 109.865 179.286 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.418 ' O ' ' O ' ' A' ' 59' ' ' VAL . 12.8 tpt180 -64.09 79.94 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.35 0 O-C-N 120.728 -1.454 . . . . 0.0 108.139 179.306 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.519 ' N ' ' O ' ' A' ' 64' ' ' GLY . 72.9 p -112.2 72.32 0.77 Allowed 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 -179.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -94.79 128.33 41.43 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.341 -0.85 . . . . 0.0 109.775 -179.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.581 ' C ' ' H ' ' A' ' 70' ' ' LYS . 31.3 p -100.01 109.8 22.12 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.323 -0.861 . . . . 0.0 109.675 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.531 ' O ' ' N ' ' A' ' 71' ' ' GLU . 5.3 m -78.7 36.39 0.26 Allowed 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 178.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.581 ' H ' ' C ' ' A' ' 68' ' ' THR . 40.7 pttt -65.07 62.65 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 179.098 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.531 ' N ' ' O ' ' A' ' 69' ' ' THR . 45.8 mt-10 -85.36 139.91 31.19 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.097 -1.002 . . . . 0.0 110.07 -179.364 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.403 ' O ' ' CG2' ' A' ' 72' ' ' VAL . 16.2 m -128.41 124.14 61.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.4 ' O ' ' OG ' ' A' ' 52' ' ' SER . 21.6 t -126.04 117.41 48.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 CA-C-O 122.16 0.981 . . . . 0.0 109.077 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 96.1 mttt . . . . . 0 C--N 1.29 -2.001 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.545 179.943 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.4 ' C ' ' HG ' ' A' ' 50' ' ' SER . 97.7 mtt180 . . . . . 0 N--CA 1.496 1.842 0 CA-C-O 121.232 0.539 . . . . 0.0 109.654 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.4 ' HG ' ' C ' ' A' ' 49' ' ' ARG . 1.2 m 67.86 169.78 0.27 Allowed 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.472 -0.767 . . . . 0.0 110.194 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.444 ' O ' ' O ' ' A' ' 52' ' ' SER . 1.6 m -56.91 -65.15 0.66 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.267 -0.895 . . . . 0.0 109.431 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' SER . . . . . 0.553 ' OG ' ' N ' ' A' ' 53' ' ' LYS . 12.7 t -58.64 -157.37 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.553 ' N ' ' OG ' ' A' ' 52' ' ' SER . 89.2 tttt -122.42 100.47 6.96 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.145 -0.972 . . . . 0.0 108.612 179.02 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.421 ' O ' ' CG1' ' A' ' 54' ' ' VAL . 11.3 p -126.65 120.37 55.92 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.709 -0.619 . . . . 0.0 109.58 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 2.3 pt -126.4 134.15 67.06 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.53 -0.731 . . . . 0.0 109.037 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 46.8 p -132.42 114.51 14.43 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.404 -0.81 . . . . 0.0 109.384 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.445 ' H ' ' HB ' ' A' ' 69' ' ' THR . 22.1 mttt -121.47 113.06 19.3 Favored 'General case' 0 N--CA 1.513 2.686 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 29.7 p -119.76 138.29 53.42 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.638 -0.664 . . . . 0.0 109.934 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.9 m -131.47 125.69 56.93 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.135 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 48.7 p -107.77 110.39 22.19 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.7 -0.625 . . . . 0.0 110.373 -179.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.44 ' N ' ' ND2' ' A' ' 61' ' ' ASN . 1.0 OUTLIER -100.24 144.08 29.68 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.354 -0.841 . . . . 0.0 108.769 179.395 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.484 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -67.03 -32.64 73.99 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 120.047 -1.658 . . . . 0.0 112.908 -177.425 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -65.74 4.28 0.63 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.291 -1.505 . . . . 0.0 110.006 -178.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.484 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 95.64 6.47 59.56 Favored Glycine 0 N--CA 1.496 2.693 0 N-CA-C 110.778 -0.929 . . . . 0.0 110.778 178.405 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 60.1 ttt180 -92.94 112.31 24.23 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.677 -1.484 . . . . 0.0 107.794 178.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.5 p -138.73 113.89 9.44 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.227 -0.921 . . . . 0.0 109.769 -178.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -99.83 130.23 46.0 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.319 -0.863 . . . . 0.0 109.993 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -107.07 108.93 20.66 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.586 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.515 ' O ' ' N ' ' A' ' 71' ' ' GLU . 4.5 m -96.31 28.7 3.14 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 107.531 -1.285 . . . . 0.0 107.531 179.087 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.1 pttp -64.81 67.74 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.515 ' N ' ' O ' ' A' ' 69' ' ' THR . 50.8 mt-10 -104.26 157.09 17.37 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.312 -0.868 . . . . 0.0 110.046 -179.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.4 p -128.16 125.42 64.34 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.437 ' O ' ' O ' ' A' ' 53' ' ' LYS . 79.0 t -107.19 135.44 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 CA-C-O 121.922 0.868 . . . . 0.0 109.434 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 65.1 tttt . . . . . 0 N--CA 1.505 2.301 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.399 179.918 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 . . . . . 0 N--CA 1.493 1.715 0 CA-C-O 121.339 0.59 . . . . 0.0 109.831 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.3 m 57.97 174.22 0.06 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.364 -0.835 . . . . 0.0 109.969 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 39.1 t -59.53 -75.4 0.06 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.347 -0.845 . . . . 0.0 109.511 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 3.0 t -47.17 141.12 4.66 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.204 -0.935 . . . . 0.0 109.191 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -73.92 103.51 4.46 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 120.998 -1.064 . . . . 0.0 109.599 -179.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.438 ' CG1' ' O ' ' A' ' 54' ' ' VAL . 10.7 p -126.57 118.08 49.99 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.776 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.401 ' O ' ' CG2' ' A' ' 55' ' ' ILE . 6.6 tt -126.99 122.45 60.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.531 -0.731 . . . . 0.0 109.125 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 17.9 m -129.21 111.86 13.33 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.437 -0.789 . . . . 0.0 109.671 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.412 ' H ' ' HB ' ' A' ' 69' ' ' THR . 31.1 mmtt -126.03 113.35 17.0 Favored 'General case' 0 N--CA 1.515 2.775 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 178.065 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 96.6 m -110.3 125.03 52.72 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.533 -0.729 . . . . 0.0 109.489 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.4 m -132.49 119.98 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.3 m -109.52 133.68 52.8 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.713 -0.617 . . . . 0.0 109.842 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -125.24 159.01 32.65 Favored 'General case' 0 N--CA 1.516 2.861 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.88 -33.96 68.78 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 120.538 -1.351 . . . . 0.0 112.477 -177.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.508 ' OD2' ' NH2' ' A' ' 65' ' ' ARG . 11.6 p30 -70.69 2.34 4.25 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.445 -1.409 . . . . 0.0 110.411 -178.417 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 98.32 1.07 58.09 Favored Glycine 0 N--CA 1.494 2.525 0 N-CA-C 109.629 -1.388 . . . . 0.0 109.629 179.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.508 ' NH2' ' OD2' ' A' ' 63' ' ' ASP . 1.3 mpp_? -76.8 85.55 3.4 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 178.543 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 93.4 m -122.18 93.35 3.96 Favored 'General case' 0 N--CA 1.492 1.665 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 -178.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -100.0 129.78 46.1 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.427 -0.796 . . . . 0.0 109.909 -179.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.416 ' C ' ' H ' ' A' ' 70' ' ' LYS . 40.1 p -106.04 109.76 21.81 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.413 -0.804 . . . . 0.0 109.609 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.488 ' O ' ' N ' ' A' ' 71' ' ' GLU . 3.5 m -88.95 30.5 0.93 Allowed 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 178.706 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.416 ' H ' ' C ' ' A' ' 68' ' ' THR . 0.3 OUTLIER -66.75 58.12 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 109.02 -0.734 . . . . 0.0 109.02 179.623 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.488 ' N ' ' O ' ' A' ' 69' ' ' THR . 79.8 mt-10 -101.07 141.45 33.94 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.221 -0.925 . . . . 0.0 109.833 -179.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.7 p -128.17 131.53 69.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 179.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 15.7 t -129.87 116.05 36.13 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.942 0 CA-C-O 122.146 0.974 . . . . 0.0 109.418 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.593 ' HZ1' ' CB ' ' A' ' 74' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.288 -2.067 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.42 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.435 ' O ' ' O ' ' A' ' 50' ' ' SER . 44.6 ttm180 . . . . . 0 N--CA 1.494 1.729 0 CA-C-O 121.261 0.553 . . . . 0.0 109.599 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.435 ' O ' ' O ' ' A' ' 49' ' ' ARG . 73.3 m -45.98 -94.48 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.337 -0.852 . . . . 0.0 109.876 -179.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.429 ' O ' ' OG ' ' A' ' 52' ' ' SER . 1.9 t -58.28 162.51 3.55 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.247 -0.908 . . . . 0.0 109.315 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' SER . . . . . 0.429 ' OG ' ' O ' ' A' ' 51' ' ' CYS . 4.5 p 61.82 152.4 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.25 -0.906 . . . . 0.0 109.492 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -95.71 112.33 24.07 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.323 -0.861 . . . . 0.0 109.08 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 96.6 t -126.94 116.4 44.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.489 -0.757 . . . . 0.0 109.358 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 2.4 pp -127.81 121.64 56.98 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 67.9 p -130.74 112.61 13.23 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.355 -0.84 . . . . 0.0 109.625 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -123.38 111.51 16.45 Favored 'General case' 0 N--CA 1.51 2.549 0 N-CA-C 108.72 -0.845 . . . . 0.0 108.72 178.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 70.4 p -120.63 126.13 49.49 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.604 -0.685 . . . . 0.0 109.198 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.452 ' O ' ' CG2' ' A' ' 59' ' ' VAL . 2.8 m -131.71 118.68 39.49 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.214 0 O-C-N 121.399 -0.813 . . . . 0.0 109.476 179.268 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 69.3 p -113.48 135.72 53.58 Favored 'General case' 0 N--CA 1.499 1.979 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.653 ' ND2' ' H ' ' A' ' 62' ' ' ALA . 4.5 t-20 -164.52 165.05 21.61 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.651 -1.281 . . . . 0.0 110.25 179.331 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.653 ' H ' ' ND2' ' A' ' 61' ' ' ASN . . . -74.81 -11.42 60.14 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 120.97 -1.081 . . . . 0.0 111.189 -179.432 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -74.71 8.95 2.05 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.122 -0.986 . . . . 0.0 109.591 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.403 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 82.42 10.08 84.0 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 108.9 -1.68 . . . . 0.0 108.9 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -91.7 97.2 10.87 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.059 -1.259 . . . . 0.0 108.705 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 48.4 p -129.79 66.12 1.48 Allowed 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 107.659 -1.238 . . . . 0.0 107.659 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -94.15 122.04 36.27 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.688 0.756 . . . . 0.0 111.195 -177.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.2 p -101.29 111.55 23.8 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 178.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.515 ' O ' ' N ' ' A' ' 71' ' ' GLU . 4.3 m -112.97 25.62 11.24 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 179.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 26.9 pttt -66.2 68.76 0.05 Allowed 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 179.179 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.515 ' N ' ' O ' ' A' ' 69' ' ' THR . 43.8 mm-40 -105.41 149.92 25.71 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.423 -0.798 . . . . 0.0 109.696 -179.455 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 24.1 m -127.43 142.99 42.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 16.5 t -128.62 119.84 51.07 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 CA-C-O 121.945 0.879 . . . . 0.0 109.012 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 62.6 tttp . . . . . 0 C--N 1.291 -1.974 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.523 -179.996 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.1 mmm180 . . . . . 0 N--CA 1.494 1.768 0 CA-C-O 121.282 0.563 . . . . 0.0 109.709 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.445 ' O ' ' O ' ' A' ' 51' ' ' CYS . 41.7 t -67.02 -67.82 0.42 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.222 -0.924 . . . . 0.0 109.668 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.445 ' O ' ' O ' ' A' ' 50' ' ' SER . 41.7 t -47.73 -93.39 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.157 -0.964 . . . . 0.0 109.235 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 48.7 m -55.47 149.79 12.9 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 22.9 tptp -95.56 100.4 12.14 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 120.959 -1.088 . . . . 0.0 108.438 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 41.2 t -128.45 116.2 40.83 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.647 -0.658 . . . . 0.0 109.562 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 17.0 tt -127.89 124.92 63.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 179.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.6 m -128.19 111.65 13.67 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.365 -0.835 . . . . 0.0 109.488 -179.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.402 ' H ' ' HB ' ' A' ' 69' ' ' THR . 10.0 mtmt -124.3 114.42 19.54 Favored 'General case' 0 N--CA 1.512 2.652 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 178.203 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.9 p -118.96 126.63 52.2 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.433 -0.792 . . . . 0.0 109.752 -179.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.6 m -132.35 122.93 49.12 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.13 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 178.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 7.9 t -107.57 120.17 41.46 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.561 -0.712 . . . . 0.0 109.98 -179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.462 ' ND2' ' O ' ' A' ' 65' ' ' ARG . 2.5 m-20 -111.82 145.45 39.41 Favored 'General case' 0 N--CA 1.51 2.553 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.479 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -69.96 -30.26 67.58 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 120.07 -1.644 . . . . 0.0 112.737 -177.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 11.5 p30 -67.07 3.99 1.0 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.249 -1.532 . . . . 0.0 109.863 -178.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.479 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 96.83 5.6 58.51 Favored Glycine 0 N--CA 1.496 2.654 0 N-CA-C 110.664 -0.974 . . . . 0.0 110.664 178.6 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.462 ' O ' ' ND2' ' A' ' 61' ' ' ASN . 11.7 mpt_? -91.68 104.82 17.24 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.568 -1.548 . . . . 0.0 108.043 178.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 28.7 p -130.1 104.53 7.38 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.536 -0.728 . . . . 0.0 109.128 -179.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -94.58 127.61 40.63 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.154 -0.966 . . . . 0.0 109.979 -179.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 73.3 m -108.68 108.37 19.2 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.546 -0.721 . . . . 0.0 109.286 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.402 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 5.8 m -102.08 27.14 6.86 Favored 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 178.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -70.09 69.04 0.33 Allowed 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 179.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -106.26 143.98 33.61 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.552 -0.718 . . . . 0.0 109.275 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 43.1 t -128.11 129.19 69.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 179.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 17.2 t -130.12 116.93 38.76 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 CA-C-O 122.072 0.939 . . . . 0.0 108.95 179.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 58.1 mttp . . . . . 0 C--N 1.287 -2.109 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.614 -179.901 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.558 HH11 ' CG ' ' A' ' 49' ' ' ARG . 0.4 OUTLIER . . . . . 0 N--CA 1.5 2.055 0 CA-C-O 121.316 0.579 . . . . 0.0 109.995 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.446 ' O ' ' O ' ' A' ' 51' ' ' CYS . 31.0 m -70.45 -55.67 8.46 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.261 -0.899 . . . . 0.0 110.217 -179.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.446 ' O ' ' O ' ' A' ' 50' ' ' SER . 45.8 t -56.69 -107.88 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.214 -0.929 . . . . 0.0 109.346 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.3 t -51.06 165.89 0.11 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.867 -1.146 . . . . 0.0 108.469 179.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 16.4 mmmt -107.53 99.68 9.16 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.268 -0.895 . . . . 0.0 109.524 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.475 ' O ' ' CG1' ' A' ' 54' ' ' VAL . 9.6 p -129.28 115.79 37.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 179.301 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.9 mm -127.11 118.43 50.16 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.0 m -129.4 112.41 13.79 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.424 -0.797 . . . . 0.0 109.068 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.54 ' N ' ' OG1' ' A' ' 69' ' ' THR . 17.3 mttp -123.1 113.39 18.93 Favored 'General case' 0 N--CA 1.514 2.759 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 178.568 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 58.1 m -114.84 127.05 55.49 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.469 -0.769 . . . . 0.0 109.521 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.405 ' O ' ' CG2' ' A' ' 59' ' ' VAL . 2.8 m -131.56 123.84 53.17 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.144 0 O-C-N 121.486 -0.759 . . . . 0.0 109.051 179.081 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 73.2 p -108.37 120.61 42.9 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.703 -0.623 . . . . 0.0 110.006 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.545 ' N ' ' OD1' ' A' ' 61' ' ' ASN . 0.7 OUTLIER -108.53 144.16 36.56 Favored 'General case' 0 N--CA 1.512 2.675 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.692 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.462 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -66.66 -31.08 71.52 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 119.949 -1.719 . . . . 0.0 112.474 -177.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.433 ' N ' ' OD1' ' A' ' 63' ' ' ASP . 16.1 p-10 -66.96 3.58 1.06 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.295 -1.503 . . . . 0.0 109.798 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.462 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 94.61 5.34 61.61 Favored Glycine 0 N--CA 1.497 2.719 0 N-CA-C 110.586 -1.006 . . . . 0.0 110.586 178.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.429 ' O ' ' OD1' ' A' ' 61' ' ' ASN . 63.0 ttt180 -92.3 109.5 20.88 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.608 -1.525 . . . . 0.0 108.086 178.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 17.6 p -134.19 112.5 11.15 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.31 -0.869 . . . . 0.0 109.48 -179.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -94.35 130.9 40.48 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.326 -0.859 . . . . 0.0 109.827 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.494 ' O ' ' CG2' ' A' ' 68' ' ' THR . 1.1 t -111.52 110.33 20.7 Favored 'General case' 0 N--CA 1.5 2.052 0 CA-C-O 122.013 0.911 . . . . 0.0 109.525 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.54 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 68.4 p -110.68 28.65 8.47 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 179.727 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 18.4 mtmm -65.68 63.28 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.527 ' N ' ' O ' ' A' ' 69' ' ' THR . 56.5 mt-10 -102.23 140.83 35.99 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.447 -0.783 . . . . 0.0 109.502 -179.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.9 m -127.78 136.29 60.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 179.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 13.2 t -129.79 116.51 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 CA-C-O 121.863 0.839 . . . . 0.0 109.077 179.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 96.1 mttt . . . . . 0 C--N 1.287 -2.115 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 -179.977 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 . . . . . 0 N--CA 1.502 2.153 0 CA-C-O 121.196 0.522 . . . . 0.0 109.721 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.444 ' O ' ' O ' ' A' ' 51' ' ' CYS . 50.7 m -63.55 -52.66 60.15 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.215 -0.928 . . . . 0.0 109.862 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.444 ' O ' ' O ' ' A' ' 50' ' ' SER . 36.8 t -48.01 -93.85 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.147 -0.971 . . . . 0.0 109.187 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 11.3 t -63.09 138.29 58.51 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.053 -1.029 . . . . 0.0 108.369 179.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -73.06 104.81 4.27 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 120.918 -1.114 . . . . 0.0 109.543 -179.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 21.1 t -125.12 116.19 46.28 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 41.5 mm -126.64 121.6 58.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 22.8 m -128.17 110.59 12.58 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.445 -0.784 . . . . 0.0 109.193 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.41 ' H ' ' HB ' ' A' ' 69' ' ' THR . 7.3 mtmt -124.9 113.91 18.48 Favored 'General case' 0 N--CA 1.511 2.624 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 178.435 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 59.0 p -114.31 132.43 56.18 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.551 -0.718 . . . . 0.0 109.776 -179.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.4 ' O ' ' CG2' ' A' ' 59' ' ' VAL . 2.8 m -131.58 122.79 50.98 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.156 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 65.2 p -107.41 122.96 47.66 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.731 -0.605 . . . . 0.0 110.015 -179.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.444 ' ND2' ' O ' ' A' ' 65' ' ' ARG . 3.4 m-20 -113.2 145.16 41.46 Favored 'General case' 0 N--CA 1.511 2.61 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 179.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.435 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -70.59 -28.33 64.78 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 119.956 -1.715 . . . . 0.0 112.319 -177.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -67.33 2.38 1.7 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.536 -1.353 . . . . 0.0 109.827 -178.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.435 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 96.25 7.27 58.4 Favored Glycine 0 N--CA 1.496 2.681 0 N-CA-C 110.519 -1.032 . . . . 0.0 110.519 178.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.444 ' O ' ' ND2' ' A' ' 61' ' ' ASN . 16.0 mmm180 -95.98 109.46 21.84 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.876 -1.367 . . . . 0.0 108.344 179.058 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.7 p -134.67 109.24 8.49 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.347 -0.846 . . . . 0.0 109.336 -179.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -96.8 132.02 42.94 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.28 -0.887 . . . . 0.0 110.221 -179.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 81.1 m -108.82 107.25 17.6 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.468 -0.77 . . . . 0.0 109.495 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.41 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 6.3 m -94.31 32.29 1.57 Allowed 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 178.626 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.0 tttm -73.54 68.83 1.19 Allowed 'General case' 0 N--CA 1.504 2.249 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -107.5 147.44 30.5 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.529 -0.732 . . . . 0.0 109.598 -179.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 38.6 t -128.08 125.99 65.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 20.5 t -128.19 116.06 40.81 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 CA-C-O 122.238 1.018 . . . . 0.0 109.351 179.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 1.1 ptpp? . . . . . 0 C--N 1.287 -2.115 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.593 -179.86 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.555 HH11 ' CG ' ' A' ' 49' ' ' ARG . 3.6 mtt-85 . . . . . 0 N--CA 1.495 1.8 0 CA-C-O 121.336 0.589 . . . . 0.0 109.806 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.4 m 54.42 175.42 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.286 -0.884 . . . . 0.0 110.151 179.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 32.3 t -62.35 -73.27 0.11 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.375 -0.828 . . . . 0.0 109.398 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 76.6 p -47.59 144.66 3.04 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.207 -0.933 . . . . 0.0 108.912 179.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.415 ' O ' ' O ' ' A' ' 73' ' ' VAL . 24.9 mtpp -75.19 102.65 5.06 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 120.895 -1.128 . . . . 0.0 109.794 -178.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.416 ' O ' ' CG1' ' A' ' 54' ' ' VAL . 11.4 p -124.67 120.51 59.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.8 tt -126.29 130.52 71.98 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 24.4 m -128.57 117.89 22.04 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.546 -0.721 . . . . 0.0 109.483 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.427 ' H ' ' HB ' ' A' ' 69' ' ' THR . 26.4 ttpt -126.52 114.33 17.98 Favored 'General case' 0 N--CA 1.519 3.015 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 177.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 54.7 m -119.13 137.51 53.54 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.547 -0.721 . . . . 0.0 109.902 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.428 ' O ' ' CG2' ' A' ' 59' ' ' VAL . 2.8 m -132.25 120.79 44.4 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 33.9 p -109.66 133.5 53.04 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.739 -0.6 . . . . 0.0 109.555 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 18.2 t30 -134.65 169.59 17.08 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 121.352 -0.843 . . . . 0.0 109.424 179.463 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.13 -42.78 99.15 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.811 -1.18 . . . . 0.0 112.552 -177.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -68.8 2.65 2.41 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.393 -1.442 . . . . 0.0 110.457 -177.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.537 ' O ' ' N ' ' A' ' 66' ' ' THR . . . 95.01 10.89 57.08 Favored Glycine 0 N--CA 1.494 2.511 0 N-CA-C 110.059 -1.217 . . . . 0.0 110.059 179.123 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.573 ' CG ' HH11 ' A' ' 65' ' ' ARG . 0.1 OUTLIER -64.34 78.64 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.42 0 O-C-N 120.785 -1.421 . . . . 0.0 107.926 179.133 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.537 ' N ' ' O ' ' A' ' 64' ' ' GLY . 71.0 p -109.68 75.85 0.96 Allowed 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 -179.209 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -93.3 115.89 28.46 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.439 -0.788 . . . . 0.0 109.097 -179.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.454 ' C ' ' H ' ' A' ' 70' ' ' LYS . 3.7 m -97.74 109.99 22.64 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.186 -0.946 . . . . 0.0 109.703 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.51 ' O ' ' N ' ' A' ' 71' ' ' GLU . 3.6 m -85.27 35.09 0.58 Allowed 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 178.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.454 ' H ' ' C ' ' A' ' 68' ' ' THR . 40.4 pttt -64.45 61.53 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 179.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 69' ' ' THR . 13.2 mm-40 -88.09 150.21 23.5 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.061 -1.025 . . . . 0.0 109.547 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 15.8 t -129.0 116.24 39.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.415 ' O ' ' O ' ' A' ' 53' ' ' LYS . 98.7 t -109.71 129.82 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 CA-C-O 122.142 0.973 . . . . 0.0 109.151 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 21.9 pttp . . . . . 0 C--N 1.29 -2.018 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.527 179.974 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 . . . . . 0 N--CA 1.494 1.728 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.425 ' O ' ' O ' ' A' ' 51' ' ' CYS . 87.8 p -66.72 163.0 20.07 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.244 -0.91 . . . . 0.0 109.308 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.425 ' O ' ' O ' ' A' ' 50' ' ' SER . 4.3 t 62.3 139.17 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.324 -0.86 . . . . 0.0 109.395 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' SER . . . . . 0.435 ' OG ' ' N ' ' A' ' 53' ' ' LYS . 10.1 t 51.61 178.25 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.283 -0.886 . . . . 0.0 109.425 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.435 ' N ' ' OG ' ' A' ' 52' ' ' SER . 56.7 mttp -113.86 111.64 22.06 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.527 -0.733 . . . . 0.0 109.536 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 91.7 t -126.68 117.17 47.34 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.452 -0.78 . . . . 0.0 109.565 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 29.1 mm -111.3 116.04 51.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.945 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 179.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.6 m -129.27 113.49 15.07 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.423 -0.798 . . . . 0.0 109.593 -179.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.53 ' N ' ' OG1' ' A' ' 69' ' ' THR . 1.5 mtmm -122.73 111.64 16.96 Favored 'General case' 0 N--CA 1.511 2.587 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 178.294 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 63.4 m -119.36 135.37 54.75 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.477 -0.765 . . . . 0.0 109.446 -179.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.447 ' O ' ' CG2' ' A' ' 59' ' ' VAL . 2.9 m -131.81 118.93 39.99 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.212 0 O-C-N 121.544 -0.722 . . . . 0.0 109.571 179.123 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 81.2 p -112.8 136.46 52.39 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 179.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.521 ' OD1' ' N ' ' A' ' 62' ' ' ALA . 7.0 t30 -163.91 163.88 23.49 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 120.586 -1.322 . . . . 0.0 110.095 179.356 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.521 ' N ' ' OD1' ' A' ' 61' ' ' ASN . . . -74.68 -10.45 59.54 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.013 -1.055 . . . . 0.0 110.898 -179.346 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.408 ' CB ' ' ND2' ' A' ' 61' ' ' ASN . 26.7 t70 -75.25 6.25 4.61 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.187 -0.946 . . . . 0.0 109.752 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.19 10.89 79.54 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 108.91 -1.676 . . . . 0.0 108.91 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -92.61 97.56 10.88 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.936 -1.332 . . . . 0.0 108.779 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 54.1 p -127.41 68.77 1.29 Allowed 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 179.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -94.24 129.46 40.86 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.523 -0.736 . . . . 0.0 111.053 -178.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -111.28 111.76 23.05 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 178.712 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.53 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 22.4 p -109.91 37.22 2.73 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 179.167 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 45.4 pttt -65.72 61.39 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.906 0 C-N-CA 120.252 -0.579 . . . . 0.0 109.46 179.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.514 ' N ' ' O ' ' A' ' 69' ' ' THR . 50.0 mt-10 -84.92 146.78 27.08 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.169 -0.957 . . . . 0.0 109.609 -179.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 22.4 m -127.44 143.23 41.31 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 12.3 t -128.55 119.17 49.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.027 0 CA-C-O 122.029 0.918 . . . . 0.0 109.064 179.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 21.0 pttp . . . . . 0 C--N 1.291 -1.954 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.542 -179.869 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.428 ' O ' ' O ' ' A' ' 50' ' ' SER . 95.5 mtt180 . . . . . 0 N--CA 1.495 1.787 0 CA-C-O 121.233 0.54 . . . . 0.0 109.614 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.428 ' O ' ' O ' ' A' ' 49' ' ' ARG . 47.1 t -59.07 -156.65 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.234 -0.916 . . . . 0.0 109.494 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.429 ' O ' ' O ' ' A' ' 52' ' ' SER . 4.8 t 50.74 -118.24 1.2 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.101 -0.999 . . . . 0.0 108.716 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' SER . . . . . 0.491 ' OG ' ' N ' ' A' ' 53' ' ' LYS . 26.6 t -56.97 -167.11 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.502 0 O-C-N 120.712 -1.242 . . . . 0.0 108.966 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.491 ' N ' ' OG ' ' A' ' 52' ' ' SER . 50.5 mttp -126.4 103.65 7.75 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.326 -0.858 . . . . 0.0 109.45 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 51.0 t -127.66 116.15 42.28 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.569 -0.707 . . . . 0.0 109.192 179.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.8 tt -128.66 125.25 63.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.564 -0.71 . . . . 0.0 109.415 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 81.0 p -127.85 113.33 15.78 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.402 -0.811 . . . . 0.0 109.323 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 41.7 tttm -127.59 113.64 16.36 Favored 'General case' 0 N--CA 1.519 3.022 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 91.5 m -108.94 125.22 51.79 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.496 -0.752 . . . . 0.0 109.436 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.5 m -132.56 119.92 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.178 0 O-C-N 121.45 -0.781 . . . . 0.0 109.071 178.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 60.8 m -109.65 134.44 51.96 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.753 -0.592 . . . . 0.0 109.655 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -127.19 162.29 26.51 Favored 'General case' 0 N--CA 1.516 2.85 0 O-C-N 121.385 -0.822 . . . . 0.0 109.347 179.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.457 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -71.59 -33.37 68.99 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.538 -1.351 . . . . 0.0 112.6 -177.531 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -69.48 7.26 0.85 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.453 -1.405 . . . . 0.0 109.813 -178.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.457 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 87.84 5.02 78.29 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.404 HH11 ' CG ' ' A' ' 65' ' ' ARG . 1.9 ttt-85 -81.15 96.55 7.24 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 120.705 -1.468 . . . . 0.0 107.865 178.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.409 ' O ' ' OG1' ' A' ' 66' ' ' THR . 18.6 p -122.08 94.89 4.45 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.607 -0.683 . . . . 0.0 109.196 -179.069 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -94.66 119.64 33.62 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.228 -0.92 . . . . 0.0 109.864 -179.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.659 ' HG1' ' NZ ' ' A' ' 70' ' ' LYS . 40.7 p -102.36 108.53 19.91 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.377 -0.827 . . . . 0.0 109.631 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.545 ' O ' ' N ' ' A' ' 71' ' ' GLU . 3.2 m -87.87 31.38 0.78 Allowed 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 178.693 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.659 ' NZ ' ' HG1' ' A' ' 68' ' ' THR . 22.0 pttm -65.13 56.7 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 179.831 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.545 ' N ' ' O ' ' A' ' 69' ' ' THR . 75.0 mt-10 -93.8 135.94 34.59 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.962 -1.086 . . . . 0.0 109.943 -179.621 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 47.8 t -128.03 129.17 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 179.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.422 ' O ' ' OG ' ' A' ' 52' ' ' SER . 16.6 t -128.61 116.2 40.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 CA-C-O 121.946 0.879 . . . . 0.0 109.236 179.677 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 45.9 mtmt . . . . . 0 C--N 1.289 -2.052 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 179.946 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 53.6 mtp180 . . . . . 0 N--CA 1.493 1.698 0 CA-C-O 121.374 0.607 . . . . 0.0 110.059 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.9 m 58.22 169.99 0.05 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.383 -0.823 . . . . 0.0 110.149 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.44 ' SG ' ' N ' ' A' ' 52' ' ' SER . 31.2 p -66.83 -38.08 85.74 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.436 -0.79 . . . . 0.0 109.397 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' SER . . . . . 0.492 ' OG ' ' N ' ' A' ' 53' ' ' LYS . 15.0 t -58.09 -161.36 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.371 -0.831 . . . . 0.0 108.984 179.807 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.492 ' N ' ' OG ' ' A' ' 52' ' ' SER . 36.1 ttpt -121.83 102.01 7.93 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.263 -0.898 . . . . 0.0 109.252 179.393 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 74.5 t -129.33 117.81 44.14 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -127.28 132.0 69.99 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 O-C-N 121.431 -0.793 . . . . 0.0 109.077 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 69.4 p -129.22 114.9 16.85 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.381 -0.824 . . . . 0.0 109.185 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.46 ' H ' ' HB ' ' A' ' 69' ' ' THR . 9.1 ttmm -127.19 113.99 17.08 Favored 'General case' 0 N--CA 1.52 3.056 0 N-CA-C 109.3 -0.629 . . . . 0.0 109.3 178.671 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 33.7 p -119.76 132.06 55.53 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.494 -0.754 . . . . 0.0 109.429 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.427 ' O ' ' CG2' ' A' ' 59' ' ' VAL . 2.8 m -132.54 120.25 41.63 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.177 0 O-C-N 121.383 -0.823 . . . . 0.0 109.534 179.133 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 35.9 p -109.77 133.01 53.62 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.781 -0.574 . . . . 0.0 109.523 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -136.3 170.23 16.37 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.263 -0.898 . . . . 0.0 109.674 179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.456 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -63.42 -40.78 98.1 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.88 -1.138 . . . . 0.0 112.766 -177.275 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.425 ' N ' ' OD1' ' A' ' 63' ' ' ASP . 18.6 p-10 -68.54 5.24 1.09 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.38 -1.45 . . . . 0.0 110.065 -178.305 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.528 ' O ' ' N ' ' A' ' 66' ' ' THR . . . 90.51 8.9 65.38 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.978 -1.249 . . . . 0.0 109.978 179.098 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 36.4 ttp180 -65.21 78.77 0.05 Allowed 'General case' 0 N--CA 1.486 1.343 0 O-C-N 120.689 -1.477 . . . . 0.0 107.915 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.528 ' N ' ' O ' ' A' ' 64' ' ' GLY . 70.3 p -110.03 77.65 1.07 Allowed 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 -179.356 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.0 tm-20 -92.78 119.81 32.52 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.418 -0.801 . . . . 0.0 109.214 -179.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 12.7 p -99.31 109.71 22.31 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.353 -0.842 . . . . 0.0 109.677 -179.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.504 ' O ' ' N ' ' A' ' 71' ' ' GLU . 4.2 m -97.02 25.41 5.41 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 107.173 -1.418 . . . . 0.0 107.173 178.561 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -65.76 70.13 0.05 Allowed 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 179.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.504 ' N ' ' O ' ' A' ' 69' ' ' THR . 81.2 mt-10 -110.13 155.04 22.46 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.538 -0.726 . . . . 0.0 110.043 -179.052 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.9 m -127.78 134.85 64.54 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 179.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 16.4 t -128.91 116.32 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 CA-C-O 121.996 0.903 . . . . 0.0 109.382 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.4 ptmm? . . . . . 0 C--N 1.289 -2.023 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 179.852 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.467 ' N ' ' CD ' ' A' ' 49' ' ' ARG . 11.1 mpt_? . . . . . 0 N--CA 1.493 1.686 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.413 ' O ' ' O ' ' A' ' 51' ' ' CYS . 98.6 p -58.24 -62.48 1.8 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.292 -0.88 . . . . 0.0 109.663 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.415 ' SG ' ' N ' ' A' ' 52' ' ' SER . 36.8 t -50.81 -97.14 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.213 -0.929 . . . . 0.0 109.703 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' SER . . . . . 0.415 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 30.8 t -51.1 150.12 3.36 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.294 -0.879 . . . . 0.0 109.721 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -85.2 105.01 15.59 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.28 -0.888 . . . . 0.0 109.106 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 99.4 t -126.55 119.68 54.3 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.517 -0.739 . . . . 0.0 110.021 -179.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 19.3 tt -127.13 128.74 70.73 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 179.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 48.7 p -130.42 120.71 24.64 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.247 -0.908 . . . . 0.0 110.357 -179.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.6 mttp -121.04 111.34 17.34 Favored 'General case' 0 N--CA 1.509 2.506 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 177.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 52.0 p -119.26 139.43 51.9 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.377 -0.827 . . . . 0.0 109.498 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.8 m -132.48 121.12 44.74 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 O-C-N 121.542 -0.724 . . . . 0.0 109.184 178.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -109.49 135.55 50.32 Favored 'General case' 0 N--CA 1.497 1.909 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 179.607 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.835 HD21 ' H ' ' A' ' 63' ' ' ASP . 0.2 OUTLIER -153.11 153.49 32.92 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 120.661 -1.274 . . . . 0.0 109.536 -179.814 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.699 ' N ' HD21 ' A' ' 61' ' ' ASN . . . -74.36 -11.9 60.38 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 120.498 -1.376 . . . . 0.0 112.091 -178.556 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.835 ' H ' HD21 ' A' ' 61' ' ' ASN . 11.7 p30 -74.32 2.19 9.87 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.043 -1.036 . . . . 0.0 109.743 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.78 11.16 62.24 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 36.9 ttm180 -96.08 99.09 10.88 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.011 -1.288 . . . . 0.0 109.123 179.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 68.4 p -125.8 83.4 2.16 Favored 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -94.99 129.76 41.92 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.348 -0.845 . . . . 0.0 111.065 -178.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.1 p -108.45 112.43 24.83 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 179.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.522 ' O ' ' N ' ' A' ' 71' ' ' GLU . 3.6 m -106.47 31.06 5.47 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 179.106 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.9 mttm -64.13 70.79 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 119.808 -0.757 . . . . 0.0 109.388 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.522 ' N ' ' O ' ' A' ' 69' ' ' THR . 51.7 mt-10 -89.55 140.18 29.8 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.242 -0.911 . . . . 0.0 109.274 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 23.6 m -127.39 136.31 60.94 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 17.2 t -128.2 117.38 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.976 0 CA-C-O 122.186 0.993 . . . . 0.0 109.122 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 94.1 mttt . . . . . 0 C--N 1.291 -1.949 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.561 -179.963 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 11.3 tpp180 . . . . . 0 N--CA 1.497 1.885 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 89.3 p -60.28 -166.33 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.162 -0.961 . . . . 0.0 109.171 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 4.4 t 48.87 -125.67 1.99 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.104 -0.997 . . . . 0.0 109.048 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 25.0 t -50.18 132.08 23.75 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.802 -1.186 . . . . 0.0 109.059 179.517 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.443 ' O ' ' O ' ' A' ' 73' ' ' VAL . 59.3 tttm -76.9 105.3 7.88 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.86 -1.15 . . . . 0.0 109.558 -179.489 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 47.5 t -123.88 116.08 46.98 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 O-C-N 121.484 -0.76 . . . . 0.0 109.454 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 43.7 mm -122.91 115.97 47.39 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 75.4 p -128.6 111.6 13.39 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.328 -0.858 . . . . 0.0 109.243 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.682 ' H ' ' HG1' ' A' ' 69' ' ' THR . 7.3 mtmt -124.67 113.46 18.03 Favored 'General case' 0 N--CA 1.515 2.775 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.793 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 58.9 p -119.4 131.84 55.73 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.549 -0.719 . . . . 0.0 109.117 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.406 ' CG2' ' OE1' ' A' ' 67' ' ' GLU . 2.8 m -133.47 126.79 52.58 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.2 0 O-C-N 121.476 -0.765 . . . . 0.0 109.605 179.421 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.6 t -108.13 134.16 51.39 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.429 -0.795 . . . . 0.0 109.34 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -125.89 162.02 26.13 Favored 'General case' 0 N--CA 1.516 2.875 0 O-C-N 121.503 -0.748 . . . . 0.0 109.304 179.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.405 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -73.05 -36.4 66.88 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.648 -1.283 . . . . 0.0 111.895 -178.238 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -72.83 7.05 2.17 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.571 -1.33 . . . . 0.0 109.874 -179.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.405 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 85.19 7.49 83.1 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.334 -1.506 . . . . 0.0 109.334 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 18.0 tpt180 -82.8 109.32 16.84 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 120.949 -1.324 . . . . 0.0 107.818 178.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.9 p -140.42 151.42 44.9 Favored 'General case' 0 C--N 1.306 -1.301 0 O-C-N 121.217 -0.927 . . . . 0.0 108.678 -178.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.406 ' OE1' ' CG2' ' A' ' 59' ' ' VAL . 24.4 mp0 -131.43 117.43 18.84 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 179.428 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.8 p -100.89 105.97 17.28 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.189 -0.944 . . . . 0.0 110.16 -179.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.682 ' HG1' ' H ' ' A' ' 57' ' ' LYS . 78.3 p -109.82 30.51 6.62 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 178.626 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.0 ptpt -66.74 66.0 0.06 Allowed 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 179.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.504 ' N ' ' O ' ' A' ' 69' ' ' THR . 63.2 mm-40 -108.17 151.59 25.71 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.425 -0.797 . . . . 0.0 110.147 -179.152 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 12.7 m -127.97 135.11 63.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.443 ' O ' ' O ' ' A' ' 53' ' ' LYS . 16.4 t -129.34 115.64 36.22 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 CA-C-O 122.235 1.017 . . . . 0.0 109.625 179.662 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 45.5 mttp . . . . . 0 C--N 1.289 -2.027 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.428 179.806 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.4 mmt180 . . . . . 0 N--CA 1.5 2.059 0 CA-C-O 121.337 0.589 . . . . 0.0 109.839 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.464 ' O ' ' O ' ' A' ' 51' ' ' CYS . 18.7 m -71.53 -61.22 1.86 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.2 -0.937 . . . . 0.0 110.52 -179.444 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.587 ' SG ' ' N ' ' A' ' 52' ' ' SER . 32.5 t -56.23 -108.74 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.194 -0.942 . . . . 0.0 109.526 -179.542 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' SER . . . . . 0.587 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 62.0 m -52.57 113.91 1.21 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 120.944 -1.097 . . . . 0.0 108.2 179.35 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.436 ' O ' ' O ' ' A' ' 73' ' ' VAL . 18.0 tptm -74.2 100.83 3.79 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.75 -1.219 . . . . 0.0 109.553 -178.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.47 ' CG1' ' O ' ' A' ' 54' ' ' VAL . 8.3 p -128.55 116.12 40.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 179.421 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -127.97 130.87 69.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 16.6 m -128.56 111.96 13.8 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.378 -0.826 . . . . 0.0 108.896 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.41 ' H ' ' HB ' ' A' ' 69' ' ' THR . 14.9 mttm -124.19 113.37 18.22 Favored 'General case' 0 N--CA 1.511 2.583 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 178.623 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 71.6 p -113.04 134.73 54.39 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.49 -0.756 . . . . 0.0 109.742 -179.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.8 m -131.49 123.98 53.67 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.047 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 178.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 42.4 p -107.2 120.39 41.98 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.683 -0.635 . . . . 0.0 110.252 -179.026 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.461 ' OD1' ' N ' ' A' ' 61' ' ' ASN . 1.2 m-20 -107.62 143.97 35.33 Favored 'General case' 0 N--CA 1.51 2.544 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 179.209 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.467 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -69.51 -28.95 66.48 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 119.976 -1.702 . . . . 0.0 112.331 -177.645 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.456 ' N ' ' OD1' ' A' ' 63' ' ' ASP . 0.6 OUTLIER -67.36 4.19 1.06 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.527 -1.358 . . . . 0.0 109.75 -178.969 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.467 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 96.52 6.16 58.64 Favored Glycine 0 N--CA 1.497 2.706 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 178.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -92.39 110.49 21.89 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.725 -1.456 . . . . 0.0 107.857 179.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 23.8 p -135.16 102.92 5.35 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.418 -0.801 . . . . 0.0 109.32 -179.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -96.91 128.64 44.07 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.21 -0.931 . . . . 0.0 110.185 -179.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.663 ' HG1' ' NZ ' ' A' ' 70' ' ' LYS . 40.0 p -106.36 108.96 20.74 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.532 -0.73 . . . . 0.0 109.489 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.499 ' O ' ' N ' ' A' ' 71' ' ' GLU . 5.6 m -88.43 33.14 0.75 Allowed 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 179.005 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.663 ' NZ ' ' HG1' ' A' ' 68' ' ' THR . 21.0 pttm -66.14 60.99 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.286 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.499 ' N ' ' O ' ' A' ' 69' ' ' THR . 86.9 mt-10 -96.13 141.93 28.92 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 120.968 -1.083 . . . . 0.0 110.079 -179.37 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.441 ' O ' ' CG2' ' A' ' 72' ' ' VAL . 5.9 m -129.16 122.39 56.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 179.115 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.436 ' O ' ' O ' ' A' ' 53' ' ' LYS . 20.6 t -128.96 115.44 36.58 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.996 0 CA-C-O 122.323 1.058 . . . . 0.0 109.47 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 66.4 tttm . . . . . 0 C--N 1.287 -2.129 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.433 179.996 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 . . . . . 0 N--CA 1.499 2.024 0 CA-C-O 121.281 0.562 . . . . 0.0 109.754 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 68.7 m -66.16 -100.08 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.186 -0.946 . . . . 0.0 109.243 179.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.429 ' O ' ' OG ' ' A' ' 52' ' ' SER . 15.3 t -49.63 135.17 19.05 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.1 -1.0 . . . . 0.0 108.826 179.581 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' SER . . . . . 0.429 ' OG ' ' O ' ' A' ' 51' ' ' CYS . 53.0 p 50.43 87.47 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.991 -1.068 . . . . 0.0 108.542 -179.158 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -75.48 104.05 5.87 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.228 -0.92 . . . . 0.0 109.824 -178.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 7.1 p -111.43 114.08 46.07 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 O-C-N 121.526 -0.734 . . . . 0.0 109.569 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.45 ' CD1' ' N ' ' A' ' 55' ' ' ILE . 1.7 mp -107.82 119.93 58.28 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 179.209 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 5.9 m -129.8 113.9 15.26 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.495 -0.753 . . . . 0.0 109.684 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.531 ' N ' ' OG1' ' A' ' 69' ' ' THR . 21.2 mttt -121.99 112.48 18.33 Favored 'General case' 0 N--CA 1.509 2.519 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 178.175 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 44.1 p -118.8 134.76 54.92 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.445 -0.784 . . . . 0.0 109.754 -179.247 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.3 m -132.17 119.69 41.03 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 178.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 42.7 p -110.93 136.54 49.79 Favored 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.523 ' OD1' ' N ' ' A' ' 62' ' ' ALA . 16.5 t30 -161.59 153.37 19.17 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 120.641 -1.287 . . . . 0.0 109.84 179.331 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.523 ' N ' ' OD1' ' A' ' 61' ' ' ASN . . . -74.3 -8.95 58.01 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.707 -1.246 . . . . 0.0 110.536 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -72.95 -1.87 18.69 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.309 -0.869 . . . . 0.0 109.851 -179.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 95.67 9.48 57.51 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 108.891 -1.684 . . . . 0.0 108.891 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 47.7 mtp180 -99.82 89.21 4.01 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.196 -1.179 . . . . 0.0 108.404 179.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.8 m -125.28 72.76 1.26 Allowed 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 73.8 mt-10 -100.87 131.82 46.57 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.454 -0.779 . . . . 0.0 111.727 -177.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.6 m -108.19 112.39 24.87 Favored 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 178.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.531 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 22.4 p -104.25 37.85 2.0 Allowed 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 179.369 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.4 pttm -65.46 61.73 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.676 -0.64 . . . . 0.0 109.463 179.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.506 ' N ' ' O ' ' A' ' 69' ' ' THR . 55.9 mt-10 -82.09 147.56 29.03 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.064 -1.022 . . . . 0.0 109.821 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 22.9 m -127.81 134.94 64.31 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 14.7 t -128.69 118.03 46.24 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 CA-C-O 122.217 1.008 . . . . 0.0 109.264 179.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 44.9 mtmt . . . . . 0 C--N 1.29 -2.007 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.512 -179.955 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 . . . . . 0 N--CA 1.497 1.879 0 CA-C-O 121.281 0.562 . . . . 0.0 109.818 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.4 m -64.54 176.75 1.03 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.215 -0.928 . . . . 0.0 109.507 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.425 ' O ' ' N ' ' A' ' 53' ' ' LYS . 64.6 m 46.84 -122.77 1.31 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.206 -0.934 . . . . 0.0 108.997 -179.724 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 43.5 t -51.87 99.81 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 178.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.425 ' N ' ' O ' ' A' ' 51' ' ' CYS . 93.7 mttt -77.87 101.43 6.79 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.11 -0.994 . . . . 0.0 110.318 -178.612 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.3 t -106.72 114.13 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 9.4 tp -127.99 126.98 67.41 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.481 -0.762 . . . . 0.0 108.998 179.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.474 ' O ' ' CG2' ' A' ' 56' ' ' THR . 0.8 OUTLIER -128.88 117.91 21.81 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.515 -0.741 . . . . 0.0 109.341 179.839 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 26.5 ttmt -127.08 114.53 17.88 Favored 'General case' 0 N--CA 1.521 3.102 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 178.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.5 m -115.66 131.42 56.94 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.624 -0.673 . . . . 0.0 109.86 -179.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.441 ' O ' ' O ' ' A' ' 65' ' ' ARG . 2.9 m -132.12 119.86 41.78 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.141 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 43.8 p -110.17 134.0 52.65 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -179.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -137.36 172.83 12.4 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.311 -0.868 . . . . 0.0 109.752 179.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.421 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -64.27 -40.33 95.75 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 120.807 -1.183 . . . . 0.0 112.566 -177.291 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.486 ' N ' ' OD1' ' A' ' 63' ' ' ASP . 2.0 m-20 -69.01 4.37 1.58 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.378 -1.451 . . . . 0.0 110.04 -178.437 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.527 ' O ' ' N ' ' A' ' 66' ' ' THR . . . 91.82 8.92 63.13 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 110.041 -1.224 . . . . 0.0 110.041 179.308 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.441 ' O ' ' O ' ' A' ' 59' ' ' VAL . 23.6 ttm180 -63.94 79.5 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.43 0 O-C-N 120.717 -1.461 . . . . 0.0 108.193 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.527 ' N ' ' O ' ' A' ' 64' ' ' GLY . 73.3 p -111.56 72.58 0.78 Allowed 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 -179.716 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -94.27 130.66 40.45 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.369 -0.832 . . . . 0.0 109.936 -178.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.469 ' C ' ' H ' ' A' ' 70' ' ' LYS . 4.0 m -108.55 109.53 20.79 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.49 -0.756 . . . . 0.0 109.656 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.481 ' O ' ' N ' ' A' ' 71' ' ' GLU . 3.8 m -82.29 39.63 0.6 Allowed 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.087 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.469 ' H ' ' C ' ' A' ' 68' ' ' THR . 13.3 ptpt -65.71 55.27 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.073 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.481 ' N ' ' O ' ' A' ' 69' ' ' THR . 54.2 mt-10 -89.28 131.97 35.12 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.091 -1.005 . . . . 0.0 109.983 -179.441 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.4 p -128.3 136.81 59.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 17.5 t -127.95 117.29 45.61 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 CA-C-O 122.012 0.911 . . . . 0.0 109.283 179.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt . . . . . 0 C--N 1.292 -1.916 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 -179.884 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 mmt . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 121.304 0.574 . . . . 0.0 109.49 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 65.69 118.17 0.01 OUTLIER Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.481 -1.448 . . . . 0.0 109.481 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.448 ' O ' ' N ' ' A' ' 5' ' ' ARG . 62.0 p -76.16 -36.51 58.7 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.285 -1.126 . . . . 0.0 109.424 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 50.93 -94.49 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.2 -0.937 . . . . 0.0 109.595 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.573 HH11 ' CG ' ' A' ' 5' ' ' ARG . 3.7 mtt-85 -149.69 19.62 0.91 Allowed 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.3 -0.875 . . . . 0.0 109.364 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.428 ' OE2' ' N ' ' A' ' 7' ' ' GLU . 3.4 tm-20 -61.55 132.7 54.18 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.316 -0.865 . . . . 0.0 109.248 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.428 ' N ' ' OE2' ' A' ' 6' ' ' GLU . 36.4 mt-10 -152.87 -25.34 0.16 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.253 -0.905 . . . . 0.0 109.382 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -178.85 -58.0 0.07 OUTLIER Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.505 ' O ' ' N ' ' A' ' 11' ' ' SER . 47.2 t -169.81 57.03 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.291 -1.123 . . . . 0.0 109.506 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.3 m -65.17 69.47 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.271 -0.893 . . . . 0.0 109.525 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.505 ' N ' ' O ' ' A' ' 9' ' ' SER . 90.2 p -159.25 -161.37 0.93 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.352 -0.842 . . . . 0.0 109.414 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.5 m -159.53 154.94 25.54 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.216 -0.927 . . . . 0.0 109.515 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 64.75 148.81 0.05 OUTLIER Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 73.4 p -53.94 -21.74 8.64 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.216 -1.167 . . . . 0.0 109.381 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 19.1 tptp -167.82 124.08 1.08 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.26 -0.9 . . . . 0.0 109.382 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -59.6 112.51 1.82 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.254 -0.904 . . . . 0.0 109.444 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.519 ' O ' ' CG ' ' A' ' 18' ' ' PHE . 84.3 mt-10 -70.69 -38.93 73.76 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.325 -0.859 . . . . 0.0 109.477 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.519 ' CG ' ' O ' ' A' ' 17' ' ' GLU . 90.0 m-85 -157.27 47.88 0.42 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.283 -0.886 . . . . 0.0 109.426 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 13.7 m170 53.82 177.69 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.212 -0.93 . . . . 0.0 109.451 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.6 t -54.53 161.53 1.42 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.238 -0.914 . . . . 0.0 109.403 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -174.15 27.62 0.08 OUTLIER Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 18.2 tptm -163.26 127.81 2.96 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.245 -1.15 . . . . 0.0 109.453 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 18.4 mt -86.68 -62.82 1.42 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.248 -0.908 . . . . 0.0 109.581 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.2 t -109.81 119.07 58.25 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.483 -0.76 . . . . 0.0 109.449 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 78.1 p -84.24 -24.32 30.04 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.222 -0.924 . . . . 0.0 109.491 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 63.4 p -63.32 -100.13 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.236 -0.915 . . . . 0.0 109.521 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 15.7 ptpt -55.64 168.57 0.4 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.295 -0.878 . . . . 0.0 109.515 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 160.96 1.92 0.06 OUTLIER Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.446 -1.461 . . . . 0.0 109.446 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.468 ' N ' ' OD1' ' A' ' 29' ' ' ASP . 25.9 p-10 -63.06 131.16 47.66 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.216 -1.167 . . . . 0.0 109.379 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -153.11 6.8 0.38 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.2 -0.937 . . . . 0.0 109.293 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -172.85 4.38 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.333 -0.854 . . . . 0.0 109.417 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.476 ' C ' ' H ' ' A' ' 34' ' ' ILE . 0.8 OUTLIER -69.25 -14.14 62.79 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.261 -0.9 . . . . 0.0 108.951 -179.921 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 14.6 mt -68.58 6.63 0.78 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.172 -0.955 . . . . 0.0 109.442 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.476 ' H ' ' C ' ' A' ' 32' ' ' LEU . 17.1 tt -48.39 153.5 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.193 -0.942 . . . . 0.0 109.563 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.97 120.37 11.25 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.256 -0.903 . . . . 0.0 109.475 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -78.59 -52.2 8.81 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.274 -0.891 . . . . 0.0 109.515 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.547 ' CD ' ' H ' ' A' ' 37' ' ' GLU . 1.5 pm0 -62.02 -27.46 68.89 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.281 -0.887 . . . . 0.0 109.542 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.409 ' O ' ' O ' ' A' ' 37' ' ' GLU . 68.1 mttm 53.23 174.28 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.307 -0.87 . . . . 0.0 109.514 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 2.9 m -74.45 79.12 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.259 -0.9 . . . . 0.0 109.555 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 4.5 m -160.77 -126.52 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.222 -0.924 . . . . 0.0 109.315 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 37.3 t -56.07 128.07 33.63 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.178 -0.951 . . . . 0.0 109.47 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.512 ' O ' ' CG ' ' A' ' 43' ' ' HIS . . . -179.35 94.15 0.09 OUTLIER Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.512 ' CG ' ' O ' ' A' ' 42' ' ' GLY . 78.2 m80 -157.76 167.27 30.51 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.357 -1.084 . . . . 0.0 109.376 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 67.5 p -84.29 154.48 22.93 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.109 -0.994 . . . . 0.0 109.438 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 79.2 p -147.34 -45.43 0.17 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.188 -0.945 . . . . 0.0 109.397 -179.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.8 p -65.8 -34.18 77.58 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.337 -0.852 . . . . 0.0 109.429 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 31.9 m -72.49 -57.52 4.1 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.307 -0.871 . . . . 0.0 109.445 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 32.5 ptt180 -145.84 143.46 29.65 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.248 -0.907 . . . . 0.0 109.364 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.565 ' CG ' HH11 ' A' ' 49' ' ' ARG . 0.3 OUTLIER -94.08 127.48 39.91 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.288 -0.882 . . . . 0.0 109.585 180.0 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.438 ' O ' ' O ' ' A' ' 49' ' ' ARG . 95.9 p -59.82 -150.69 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.341 -0.85 . . . . 0.0 109.621 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.57 ' SG ' ' N ' ' A' ' 52' ' ' SER . 10.3 t 50.84 -100.69 0.09 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.076 -1.015 . . . . 0.0 109.15 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.618 ' HG ' ' H ' ' A' ' 53' ' ' LYS . 16.3 t -71.81 -165.35 0.16 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.223 -0.923 . . . . 0.0 108.967 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.618 ' H ' ' HG ' ' A' ' 52' ' ' SER . 19.4 tptm -120.87 106.17 11.39 Favored 'General case' 0 N--CA 1.498 1.969 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 9.9 t -125.99 117.82 49.99 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.522 -0.736 . . . . 0.0 109.541 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 12.1 tt -122.77 119.64 58.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 71.1 p -131.61 113.46 13.64 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.536 -0.728 . . . . 0.0 109.157 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.551 ' N ' ' OG1' ' A' ' 69' ' ' THR . 11.9 mtpt -121.85 112.73 18.71 Favored 'General case' 0 N--CA 1.513 2.697 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 178.781 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 81.8 p -119.07 128.7 54.58 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.575 -0.703 . . . . 0.0 109.613 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.7 m -131.63 126.1 57.12 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 178.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.57 133.98 52.81 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.721 -0.612 . . . . 0.0 109.635 -179.781 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -123.42 162.45 22.78 Favored 'General case' 0 N--CA 1.518 2.944 0 O-C-N 121.186 -0.946 . . . . 0.0 109.229 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.515 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -67.22 -41.12 86.27 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.622 -1.299 . . . . 0.0 112.635 -177.383 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.508 ' OD1' ' N ' ' A' ' 63' ' ' ASP . 18.8 p-10 -68.17 8.55 0.42 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.351 -1.468 . . . . 0.0 110.201 -177.568 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.515 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 85.55 9.25 79.14 Favored Glycine 0 N--CA 1.493 2.446 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 179.218 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -83.49 100.65 10.89 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 120.912 -1.346 . . . . 0.0 107.435 178.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.4 p -131.68 113.29 13.4 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.469 -0.77 . . . . 0.0 110.068 -178.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -94.64 120.53 35.02 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.437 -0.79 . . . . 0.0 109.79 -179.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.4 p -101.36 110.58 22.61 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.396 -0.815 . . . . 0.0 109.248 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.551 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 28.0 p -111.21 29.4 7.83 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 179.02 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.4 ptmt -65.44 67.48 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 69' ' ' THR . 72.0 mm-40 -101.63 156.83 17.25 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.335 -0.853 . . . . 0.0 109.989 -179.249 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.5 p -128.35 129.78 69.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 179.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.444 ' O ' ' O ' ' A' ' 53' ' ' LYS . 96.8 t -113.75 132.18 63.45 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 CA-C-O 122.279 1.037 . . . . 0.0 109.352 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.5 mmmt -56.4 -175.47 0.01 OUTLIER 'General case' 0 C--N 1.291 -1.966 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 85.6 p -52.94 163.68 0.47 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.128 -0.982 . . . . 0.0 109.533 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -86.4 -45.51 11.11 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.263 -0.898 . . . . 0.0 109.11 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 54.4 m-20 -156.63 22.41 0.34 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.295 -0.878 . . . . 0.0 109.162 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 63.72 45.03 95.43 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.422 -1.471 . . . . 0.0 109.422 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 49.0 m -67.37 -46.23 73.95 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.318 -1.107 . . . . 0.0 109.512 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 42.5 m-20 -157.87 36.84 0.26 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.233 -0.917 . . . . 0.0 109.399 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.498 ' C ' ' H ' ' A' ' 83' ' ' ASP . 98.5 m -150.16 -71.1 0.18 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.247 -0.908 . . . . 0.0 109.388 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.05 39.43 0.81 Allowed Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.521 -1.431 . . . . 0.0 109.521 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.498 ' H ' ' C ' ' A' ' 81' ' ' CYS . 29.5 m-20 -69.33 177.19 2.93 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.289 -1.124 . . . . 0.0 109.425 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . 53.38 70.83 0.55 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.225 -0.922 . . . . 0.0 109.481 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.527 ' O ' ' N ' ' A' ' 87' ' ' ASP . 25.4 t0 -168.18 -57.17 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.208 -0.932 . . . . 0.0 109.533 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 52.0 -88.58 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.248 -0.908 . . . . 0.0 109.508 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.527 ' N ' ' O ' ' A' ' 85' ' ' ASP . 8.7 p-10 -154.09 145.23 22.83 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.206 -0.934 . . . . 0.0 109.41 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 37.7 p90 -69.0 143.68 54.3 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.329 -0.857 . . . . 0.0 109.487 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -168.95 -33.69 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.246 -0.908 . . . . 0.0 109.347 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.433 ' ND1' ' N ' ' A' ' 90' ' ' HIS . 2.1 m-70 53.03 179.35 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.334 -0.854 . . . . 0.0 109.59 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 35.5 m -161.83 138.48 8.2 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.348 -0.845 . . . . 0.0 109.205 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -69.0 149.6 97.8 Favored Pre-proline 0 N--CA 1.489 1.483 0 O-C-N 121.11 -0.994 . . . . 0.0 108.96 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -58.03 -70.23 0.04 OUTLIER 'Trans proline' 0 C--N 1.324 -0.758 0 C-N-CA 120.941 1.094 . . . . 0.0 109.762 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 14.7 t -171.54 101.82 0.19 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.292 -0.88 . . . . 0.0 109.429 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 65.1 mtm180 -65.54 176.76 1.36 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.184 -0.948 . . . . 0.0 109.559 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -69.65 -123.03 0.04 OUTLIER Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.528 ' ND2' ' H ' ' A' ' 98' ' ' LEU . 5.4 p-10 -173.6 -63.57 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.273 -1.134 . . . . 0.0 109.431 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.528 ' H ' ' ND2' ' A' ' 97' ' ' ASN . 3.9 tp 58.58 -150.79 0.43 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.278 -0.889 . . . . 0.0 109.192 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -84.93 -179.55 7.1 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.141 -0.974 . . . . 0.0 109.361 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -68.15 145.24 54.54 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.164 -0.96 . . . . 0.0 109.47 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -71.5 -31.02 66.63 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.336 -0.853 . . . . 0.0 109.434 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 82.9 t80 -167.28 -19.74 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.234 -0.916 . . . . 0.0 109.457 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.409 ' O ' ' ND1' ' A' ' 103' ' ' HIS . 5.5 t-80 -57.79 -34.69 69.87 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.276 -0.89 . . . . 0.0 109.445 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.522 HH21 ' CG ' ' A' ' 108' ' ' ASP . 15.5 tpt180 54.85 66.24 1.29 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.312 -0.867 . . . . 0.0 109.432 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.407 ' O ' ' O ' ' A' ' 104' ' ' ARG . 19.4 t70 -51.23 -95.77 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.331 -0.856 . . . . 0.0 109.437 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 65.6 tttm -73.86 117.18 15.34 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.264 -0.897 . . . . 0.0 109.398 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.527 ' CG ' ' H ' ' A' ' 108' ' ' ASP . 29.7 t70 -72.21 -171.24 0.72 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.294 -0.879 . . . . 0.0 109.352 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.527 ' H ' ' CG ' ' A' ' 107' ' ' ASP . 30.7 p-10 -158.93 156.9 30.35 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.244 -0.91 . . . . 0.0 109.335 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -69.58 -37.28 76.89 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.208 -0.932 . . . . 0.0 109.518 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 53.8 m-85 -64.71 94.1 0.12 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.217 -0.927 . . . . 0.0 109.535 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 68.4 p -75.41 -160.04 0.11 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.28 -0.887 . . . . 0.0 109.467 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.576 ' CG ' HH11 ' A' ' 112' ' ' ARG . 3.9 mtt-85 -73.22 132.76 43.57 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.242 -0.911 . . . . 0.0 109.484 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 49.9 m -75.32 69.31 2.12 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.33 -0.856 . . . . 0.0 109.545 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.422 ' C ' ' H ' ' A' ' 116' ' ' GLU . 44.2 t -73.77 116.24 14.14 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.29 -0.881 . . . . 0.0 109.525 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -72.44 46.66 0.15 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.189 -0.944 . . . . 0.0 109.483 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.422 ' H ' ' C ' ' A' ' 114' ' ' SER . 15.5 pt-20 -65.62 -148.96 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.275 -0.891 . . . . 0.0 109.338 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -151.11 70.51 0.98 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.205 -0.935 . . . . 0.0 109.257 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -73.14 4.98 3.79 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.336 -0.852 . . . . 0.0 109.448 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -62.25 157.34 36.55 Favored Glycine 0 N--CA 1.489 2.228 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.3 ptp180 -168.86 -18.13 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.289 -1.124 . . . . 0.0 109.655 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 56.3 m -73.4 150.04 42.03 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.127 -0.983 . . . . 0.0 109.337 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -163.93 64.56 0.24 Allowed Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.898 -1.281 . . . . 0.0 109.898 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 10.5 mp -52.24 136.46 30.43 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.213 -1.169 . . . . 0.0 108.946 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -89.15 161.91 39.08 Favored Pre-proline 0 N--CA 1.494 1.753 0 O-C-N 121.335 -0.853 . . . . 0.0 108.958 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -58.15 -50.72 9.25 Favored 'Trans proline' 0 C--N 1.32 -0.947 0 C-N-CA 121.238 1.292 . . . . 0.0 109.561 179.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 61.9 tt0 -165.51 134.13 3.22 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.302 -0.874 . . . . 0.0 109.358 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -59.83 97.99 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.248 -0.907 . . . . 0.0 109.522 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -78.97 84.47 4.98 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.234 -0.916 . . . . 0.0 109.467 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -167.39 -88.18 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.202 -0.936 . . . . 0.0 109.509 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.486 ' CD1' ' N ' ' A' ' 130' ' ' LEU . 8.9 mp -60.72 -70.62 0.17 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.34 -0.85 . . . . 0.0 109.286 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . 0.461 ' C ' ' H ' ' A' ' 133' ' ' SER . . . 68.84 24.04 75.68 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.466 -1.454 . . . . 0.0 109.466 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -65.22 0.91 1.18 Allowed 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.272 -1.134 . . . . 0.0 109.432 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' SER . . . . . 0.461 ' H ' ' C ' ' A' ' 131' ' ' GLY . 95.3 p -62.68 -145.86 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.282 -0.886 . . . . 0.0 109.445 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 72.49 -101.44 1.07 Allowed Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 30.3 t -169.55 46.16 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.203 -1.175 . . . . 0.0 109.504 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' SER . . . . . 0.41 ' O ' ' OG ' ' A' ' 137' ' ' SER . 25.1 p 52.21 60.71 3.63 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.249 -0.907 . . . . 0.0 109.47 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' SER . . . . . 0.41 ' OG ' ' O ' ' A' ' 136' ' ' SER . 69.6 m -166.88 138.83 3.43 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.223 -0.923 . . . . 0.0 109.387 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' SER . . . . . 0.402 ' OG ' ' O ' ' A' ' 137' ' ' SER . 67.5 m -166.39 -20.12 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.255 -0.903 . . . . 0.0 109.475 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -65.09 -25.5 67.82 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.22 -0.925 . . . . 0.0 109.465 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 7.2 t -64.13 127.38 31.2 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.254 -0.904 . . . . 0.0 109.52 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 11.6 p -175.34 -94.1 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.17 -0.957 . . . . 0.0 109.431 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 47.7 m -74.75 -15.35 60.77 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.291 -0.881 . . . . 0.0 109.376 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 26.8 m80 52.89 58.99 4.78 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.294 -0.879 . . . . 0.0 109.5 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' SER . . . . . 0.502 ' C ' ' H ' ' A' ' 146' ' ' GLN . 88.2 p -69.36 167.94 15.44 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.234 -0.916 . . . . 0.0 109.512 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 9.9 ptmm? -75.18 31.15 0.1 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.345 -0.847 . . . . 0.0 109.442 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . 0.502 ' H ' ' C ' ' A' ' 144' ' ' SER . 9.5 tp-100 -62.78 -39.5 94.4 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.155 -0.965 . . . . 0.0 109.457 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -64.04 124.13 20.81 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.233 -0.917 . . . . 0.0 109.41 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 34.2 t -72.12 141.93 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.3 -0.875 . . . . 0.0 109.452 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 42.5 t -167.66 96.56 0.46 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.177 -0.952 . . . . 0.0 109.42 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 82.9 p -171.37 -15.14 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.272 -0.892 . . . . 0.0 109.495 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 40.9 t -76.26 104.96 7.04 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.263 -0.898 . . . . 0.0 109.49 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -169.7 -37.24 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.23 -0.919 . . . . 0.0 109.53 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' THR . . . . . 0.44 ' C ' ' H ' ' A' ' 155' ' ' ASN . 60.3 p -50.72 -35.17 30.03 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.239 -0.913 . . . . 0.0 109.489 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 26.9 m -66.54 1.12 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.258 -0.901 . . . . 0.0 109.418 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . 0.44 ' H ' ' C ' ' A' ' 153' ' ' THR . 41.1 p-10 -62.02 -164.51 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.253 -0.904 . . . . 0.0 109.442 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 16.2 tpt180 -57.14 146.73 26.89 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.248 -0.907 . . . . 0.0 109.454 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -60.26 148.87 43.15 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -71.87 -5.36 61.15 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' SER . . . . . 0.401 ' OG ' ' N ' ' A' ' 160' ' ' ALA . 77.5 p -169.41 -85.35 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.264 -1.139 . . . . 0.0 109.454 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . 0.401 ' N ' ' OG ' ' A' ' 159' ' ' SER . . . -169.42 154.19 5.59 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.271 -0.893 . . . . 0.0 109.471 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 16.4 tt -69.58 144.22 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.19 -0.944 . . . . 0.0 109.488 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 50.1 tt0 -168.6 90.4 0.26 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.204 -0.935 . . . . 0.0 109.484 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 45.5 t -66.08 103.79 1.03 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.278 -0.889 . . . . 0.0 109.47 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm -67.82 -76.82 0.08 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.298 -0.876 . . . . 0.0 109.299 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -68.1 -164.1 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.223 -0.923 . . . . 0.0 109.496 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' PHE . . . . . 0.442 ' O ' ' CD1' ' A' ' 166' ' ' PHE . 61.9 t80 . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 118.029 -0.986 . . . . 0.0 109.529 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.1 mmt . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -176.69 -121.84 0.69 Allowed Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.518 ' OG1' ' CD2' ' A' ' 4' ' ' PHE . 69.6 p -67.44 -168.14 0.08 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.304 -1.115 . . . . 0.0 109.501 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.518 ' CD2' ' OG1' ' A' ' 3' ' ' THR . 33.8 m-85 56.76 -144.42 0.66 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.34 -0.85 . . . . 0.0 109.453 -179.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -164.33 75.95 0.32 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.278 -0.889 . . . . 0.0 109.552 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 46.3 mm-40 -72.72 -24.73 61.03 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.256 -0.902 . . . . 0.0 109.366 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -71.43 94.69 1.28 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.233 -0.917 . . . . 0.0 109.532 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -68.62 -152.53 0.45 Allowed Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.8 m -59.95 120.83 10.39 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.306 -1.114 . . . . 0.0 109.478 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 95.1 t -67.89 -88.92 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.266 -0.896 . . . . 0.0 109.511 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 89.5 p -171.31 -154.83 0.1 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.246 -0.909 . . . . 0.0 109.421 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 28.4 t -171.98 -102.7 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.217 -0.927 . . . . 0.0 109.445 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 56.7 82.37 0.06 OUTLIER Glycine 0 N--CA 1.489 2.232 0 N-CA-C 109.629 -1.388 . . . . 0.0 109.629 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 16.7 p 48.54 -170.14 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.324 -1.103 . . . . 0.0 109.589 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.43 ' C ' ' H ' ' A' ' 17' ' ' GLU . 54.1 pttt -171.34 -29.24 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.315 -0.865 . . . . 0.0 109.444 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 57.78 8.66 0.73 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.328 -0.857 . . . . 0.0 109.226 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.43 ' H ' ' C ' ' A' ' 15' ' ' LYS . 40.1 tt0 -59.58 -28.01 66.76 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.215 -0.928 . . . . 0.0 109.525 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -132.38 178.25 6.96 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.391 -0.818 . . . . 0.0 109.275 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -164.74 -62.77 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.307 -0.871 . . . . 0.0 109.41 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 80.5 p -70.1 -37.55 75.4 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.298 -0.876 . . . . 0.0 109.518 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -62.71 162.02 30.91 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -69.91 -164.24 0.07 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.172 -1.193 . . . . 0.0 109.237 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.551 ' CD2' ' N ' ' A' ' 23' ' ' LEU . 0.6 OUTLIER -168.18 -165.96 0.66 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.217 -0.927 . . . . 0.0 109.557 179.973 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 30.5 t -54.42 -61.47 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.267 -0.895 . . . . 0.0 109.452 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 51.1 p -72.59 -144.39 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.239 -0.913 . . . . 0.0 109.511 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.8 t -170.67 40.74 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.196 -0.94 . . . . 0.0 109.427 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -71.17 -25.25 62.46 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.305 -0.872 . . . . 0.0 109.433 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 71.22 168.25 8.52 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.464 -1.454 . . . . 0.0 109.464 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -65.68 -89.21 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.278 -1.13 . . . . 0.0 109.446 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.51 ' C ' ' H ' ' A' ' 32' ' ' LEU . 15.8 pttp -170.54 77.0 0.08 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.201 -0.937 . . . . 0.0 109.501 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 58.83 3.03 0.28 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.236 -0.915 . . . . 0.0 109.323 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.51 ' H ' ' C ' ' A' ' 30' ' ' LYS . 8.0 tp -69.4 -18.7 63.79 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.228 -0.92 . . . . 0.0 109.404 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 11.0 tp -56.33 110.61 0.79 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.256 -0.902 . . . . 0.0 109.489 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.473 ' C ' ' H ' ' A' ' 36' ' ' ASN . 4.0 pt -81.37 -105.37 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.122 -0.987 . . . . 0.0 109.299 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.8 t70 57.4 5.7 0.32 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.228 -0.92 . . . . 0.0 109.505 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.499 ' C ' ' H ' ' A' ' 38' ' ' LYS . 1.4 p-10 -80.23 120.86 24.89 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.246 -0.909 . . . . 0.0 109.393 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.428 ' O ' ' OE1' ' A' ' 37' ' ' GLU . 3.0 pp20? -73.99 18.18 0.15 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.256 -0.903 . . . . 0.0 109.683 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.499 ' H ' ' C ' ' A' ' 36' ' ' ASN . 33.2 ttmt -144.61 147.2 32.82 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.286 -0.884 . . . . 0.0 109.572 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.8 p -161.5 -37.22 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 O-C-N 121.296 -0.878 . . . . 0.0 109.474 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.632 ' HG1' ' H ' ' A' ' 41' ' ' SER . 1.6 t -70.6 173.56 6.95 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.171 -0.955 . . . . 0.0 109.453 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.632 ' H ' ' HG1' ' A' ' 40' ' ' THR . 34.8 t -170.81 -172.82 1.23 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.2 -0.937 . . . . 0.0 109.509 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -176.25 178.34 47.66 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 18.5 p80 -170.28 -162.05 0.28 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.26 -1.141 . . . . 0.0 109.448 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 69.8 p -149.87 115.83 5.65 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.212 -0.93 . . . . 0.0 109.276 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 32.8 m -59.74 -67.37 0.39 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.281 -0.887 . . . . 0.0 109.338 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.451 ' O ' ' N ' ' A' ' 48' ' ' ARG . 0.0 OUTLIER -64.12 104.09 0.69 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.274 -0.891 . . . . 0.0 109.508 -179.984 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 60.3 p -67.02 71.82 0.09 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.284 -0.885 . . . . 0.0 109.574 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.451 ' N ' ' O ' ' A' ' 46' ' ' THR . 55.1 mtp180 -144.54 142.29 30.11 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.159 -0.963 . . . . 0.0 109.242 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.429 ' O ' ' O ' ' A' ' 50' ' ' SER . 20.9 mmm180 -120.29 134.39 55.27 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.663 -0.648 . . . . 0.0 109.469 179.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.429 ' O ' ' O ' ' A' ' 49' ' ' ARG . 29.3 m -58.57 -156.81 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.278 -0.889 . . . . 0.0 109.945 -179.796 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.582 ' SG ' ' N ' ' A' ' 52' ' ' SER . 46.0 t 48.86 -119.41 1.19 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.295 -0.878 . . . . 0.0 109.346 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.582 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 42.0 m -60.64 128.09 34.91 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.058 -1.026 . . . . 0.0 108.843 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.442 ' O ' ' O ' ' A' ' 73' ' ' VAL . 0.0 OUTLIER -74.46 102.4 4.45 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.842 -1.161 . . . . 0.0 109.195 -179.419 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 10.3 p -126.01 116.02 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 17.9 tt -127.71 129.34 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 51.0 p -130.05 114.56 15.94 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.395 -0.816 . . . . 0.0 109.311 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.706 ' H ' ' HG1' ' A' ' 69' ' ' THR . 7.8 mtmt -121.4 113.5 19.97 Favored 'General case' 0 N--CA 1.514 2.771 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 178.692 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 65.9 p -116.38 136.29 53.13 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.479 -0.763 . . . . 0.0 109.886 -179.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.401 ' O ' ' CG2' ' A' ' 59' ' ' VAL . 2.7 m -131.72 124.05 53.13 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 178.538 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -108.97 133.45 52.95 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.763 -0.586 . . . . 0.0 110.196 -179.161 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.479 ' OD1' ' N ' ' A' ' 62' ' ' ALA . 26.3 t-20 -125.46 158.78 33.57 Favored 'General case' 0 N--CA 1.516 2.827 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.503 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -71.66 -31.52 66.92 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 120.365 -1.459 . . . . 0.0 112.445 -177.744 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -69.88 8.57 0.68 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.499 -1.376 . . . . 0.0 109.638 -178.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.503 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 85.36 5.27 85.3 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.722 -1.351 . . . . 0.0 109.722 179.505 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 64.0 ttt180 -83.43 103.02 12.46 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.77 -1.43 . . . . 0.0 107.929 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 12.2 p -132.66 108.54 9.11 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.473 -0.767 . . . . 0.0 109.703 -178.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -94.92 130.52 41.5 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.226 -0.922 . . . . 0.0 109.933 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.5 p -108.96 107.52 17.93 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.479 -0.763 . . . . 0.0 109.407 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.706 ' HG1' ' H ' ' A' ' 57' ' ' LYS . 30.8 p -97.78 33.01 2.18 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 178.627 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 74.2 mttt -66.71 67.63 0.06 Allowed 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 179.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.48 ' N ' ' O ' ' A' ' 69' ' ' THR . 74.3 mt-10 -98.0 149.85 22.0 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.169 -0.957 . . . . 0.0 110.142 -179.05 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.6 t -129.04 117.16 43.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.442 ' O ' ' O ' ' A' ' 53' ' ' LYS . 59.4 t -114.79 126.85 72.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 CA-C-O 122.105 0.955 . . . . 0.0 109.349 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 50.8 mttp -54.02 -95.89 0.0 OUTLIER 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 179.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 38.3 p -153.5 69.72 0.82 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.177 -0.952 . . . . 0.0 109.206 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -66.5 -28.13 68.32 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.254 -0.904 . . . . 0.0 108.87 179.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -140.46 12.74 2.35 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.35 -169.99 22.66 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 48.1 t -86.48 46.46 1.35 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.375 -1.074 . . . . 0.0 108.419 179.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.413 ' C ' ' H ' ' A' ' 82' ' ' GLY . 3.2 m-20 56.52 34.7 24.8 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 -179.272 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 2.8 t -78.06 14.59 1.1 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.281 -0.887 . . . . 0.0 109.329 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.413 ' H ' ' C ' ' A' ' 80' ' ' ASP . . . -169.78 -9.71 0.03 OUTLIER Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.407 -1.477 . . . . 0.0 109.407 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 53.17 75.87 0.23 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.284 -1.127 . . . . 0.0 109.553 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -74.67 175.91 7.46 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.268 -0.895 . . . . 0.0 109.521 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.445 ' OD1' ' N ' ' A' ' 85' ' ' ASP . 19.9 p-10 -172.21 120.39 0.43 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.191 -0.943 . . . . 0.0 109.52 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -61.13 -63.78 1.17 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.281 -0.887 . . . . 0.0 109.442 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 52.37 22.35 2.03 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.317 -0.864 . . . . 0.0 109.562 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -107.97 -71.27 0.76 Allowed 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.474 -0.766 . . . . 0.0 109.33 179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 29.2 t-80 -171.0 77.87 0.07 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.229 -0.92 . . . . 0.0 109.467 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 57.2 t-80 -170.07 -30.23 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.241 -0.912 . . . . 0.0 109.465 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 63.5 p -67.58 117.77 9.97 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.257 -0.902 . . . . 0.0 109.433 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -169.25 68.01 0.65 Allowed Pre-proline 0 N--CA 1.49 1.565 0 O-C-N 121.258 -0.901 . . . . 0.0 109.628 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.99 151.6 80.41 Favored 'Trans proline' 0 C--N 1.318 -1.047 0 C-N-CA 121.403 1.402 . . . . 0.0 109.803 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.479 ' O ' ' N ' ' A' ' 96' ' ' GLY . 41.2 t -170.82 41.94 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.343 -0.848 . . . . 0.0 109.407 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 -68.18 62.32 0.09 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.23 -0.919 . . . . 0.0 109.485 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.479 ' N ' ' O ' ' A' ' 94' ' ' SER . . . 178.41 153.15 11.0 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -168.25 -59.46 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.338 -1.095 . . . . 0.0 109.429 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 16.0 mt -68.99 -64.87 0.79 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.236 -0.915 . . . . 0.0 109.511 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -72.51 -162.42 0.1 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.297 -0.877 . . . . 0.0 109.403 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 53.01 14.91 0.51 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.223 -0.923 . . . . 0.0 109.425 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.45 ' C ' ' H ' ' A' ' 103' ' ' HIS . 79.4 t80 -64.5 -36.44 84.2 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.235 -0.915 . . . . 0.0 109.494 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 27.4 p90 -69.2 4.28 1.73 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.271 -0.893 . . . . 0.0 109.415 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.45 ' H ' ' C ' ' A' ' 101' ' ' PHE . 4.6 t60 -67.27 -43.43 81.84 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.202 -0.937 . . . . 0.0 109.464 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.524 ' NH1' ' O ' ' A' ' 106' ' ' LYS . 0.3 OUTLIER -167.92 93.46 0.38 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.269 -0.895 . . . . 0.0 108.928 179.992 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.51 ' CG ' ' H ' ' A' ' 106' ' ' LYS . 3.1 p-10 -81.72 -70.36 0.55 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.186 -0.946 . . . . 0.0 109.738 -179.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.524 ' O ' ' NH1' ' A' ' 104' ' ' ARG . 93.1 mttt -148.18 -51.88 0.18 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.125 -0.984 . . . . 0.0 109.47 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.428 ' O ' ' O ' ' A' ' 108' ' ' ASP . 6.6 p-10 -169.8 71.5 0.07 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.208 -0.933 . . . . 0.0 109.583 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.443 ' C ' ' H ' ' A' ' 110' ' ' PHE . 62.2 t0 52.59 99.11 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.254 -0.904 . . . . 0.0 109.568 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . 0.519 ' C ' ' H ' ' A' ' 111' ' ' THR . 67.2 t80 -59.94 -6.16 1.22 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.295 -0.878 . . . . 0.0 109.404 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . 0.523 ' O ' ' CD2' ' A' ' 110' ' ' PHE . 52.4 t80 -72.67 16.42 0.15 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.293 -0.88 . . . . 0.0 109.439 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' THR . . . . . 0.519 ' H ' ' C ' ' A' ' 109' ' ' PHE . 67.3 p -149.93 89.12 1.58 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.22 -0.925 . . . . 0.0 109.352 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 51.0 mtp180 -51.74 137.14 26.23 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.264 -0.897 . . . . 0.0 109.507 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 29.2 t -171.33 18.8 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.359 -0.838 . . . . 0.0 109.482 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 95.5 p -60.23 141.49 55.96 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.256 -0.902 . . . . 0.0 109.476 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 59.6 t-80 -72.22 129.22 37.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.285 -0.884 . . . . 0.0 109.428 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -167.53 145.6 4.68 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.303 -0.873 . . . . 0.0 109.515 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -74.41 83.79 1.96 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.254 -0.904 . . . . 0.0 109.475 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 52.12 -147.84 0.43 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.253 -0.904 . . . . 0.0 109.493 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -166.61 -76.2 0.03 OUTLIER Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 31.7 ptt180 -171.76 5.43 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.208 -1.172 . . . . 0.0 109.428 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 43.3 m -71.68 -10.8 60.32 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.123 -0.986 . . . . 0.0 109.427 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -62.27 -120.64 0.01 OUTLIER Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 16.0 mt -64.71 128.93 37.84 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.345 -1.091 . . . . 0.0 109.365 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -76.64 161.56 73.79 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.227 -0.921 . . . . 0.0 108.764 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . 0.482 ' O ' ' N ' ' A' ' 127' ' ' PHE . 1.6 Cg_endo -57.8 -69.76 0.04 OUTLIER 'Trans proline' 0 C--N 1.319 -0.985 0 C-N-CA 121.331 1.354 . . . . 0.0 109.926 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.543 ' CD ' ' H ' ' A' ' 126' ' ' GLU . 1.1 pm0 -58.03 85.26 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.273 -0.892 . . . . 0.0 109.699 -179.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . 0.482 ' N ' ' O ' ' A' ' 125' ' ' PRO . 95.7 m-85 -53.89 -81.61 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.225 -0.922 . . . . 0.0 109.328 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -165.72 -149.28 0.11 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.213 -0.929 . . . . 0.0 109.368 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -164.9 115.41 1.14 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.265 -0.897 . . . . 0.0 109.43 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.514 ' CD1' ' N ' ' A' ' 130' ' ' LEU . 7.9 mp -72.92 -55.94 5.88 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.196 -0.94 . . . . 0.0 109.388 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 76.86 -82.34 1.1 Allowed Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -170.53 139.94 1.7 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.316 -1.108 . . . . 0.0 109.451 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 50.5 m -77.94 -44.56 26.5 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.217 -0.927 . . . . 0.0 109.491 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 75.3 43.44 25.37 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 94.3 p -72.84 149.51 43.49 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.25 -1.147 . . . . 0.0 109.48 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 38.6 t -74.51 79.89 1.95 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.201 -0.937 . . . . 0.0 109.449 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' SER . . . . . 0.416 ' O ' ' OG ' ' A' ' 138' ' ' SER . 41.1 p -172.33 -119.68 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.26 -0.9 . . . . 0.0 109.416 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' SER . . . . . 0.416 ' OG ' ' O ' ' A' ' 137' ' ' SER . 22.2 p 53.72 -161.72 0.12 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.139 -0.976 . . . . 0.0 109.512 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.44 ' NZ ' ' CB ' ' A' ' 139' ' ' LYS . 2.7 ttmp? -64.88 146.55 54.76 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.3 -0.875 . . . . 0.0 109.53 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' THR . . . . . 0.463 ' OG1' ' N ' ' A' ' 141' ' ' SER . 1.6 t -162.36 -175.18 4.4 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.24 -0.912 . . . . 0.0 109.517 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' SER . . . . . 0.463 ' N ' ' OG1' ' A' ' 140' ' ' THR . 12.4 t 53.11 -142.14 0.81 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.278 -0.889 . . . . 0.0 109.478 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' THR . . . . . 0.494 ' C ' ' H ' ' A' ' 144' ' ' SER . 24.3 m 53.75 88.6 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.285 -0.884 . . . . 0.0 109.436 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 64.9 m-70 -76.01 24.73 0.13 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.202 -0.936 . . . . 0.0 109.433 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' SER . . . . . 0.494 ' H ' ' C ' ' A' ' 142' ' ' THR . 41.4 t -167.26 94.4 0.45 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.244 -0.91 . . . . 0.0 109.493 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 56.1 pttt -70.9 159.75 34.08 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.295 -0.878 . . . . 0.0 109.437 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 52.39 -132.12 2.0 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.247 -0.908 . . . . 0.0 109.456 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -160.56 119.41 2.63 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.264 -0.898 . . . . 0.0 109.418 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 28.8 m -149.07 -151.53 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.273 -0.892 . . . . 0.0 109.328 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 10.3 m 53.83 32.69 15.47 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.139 -0.976 . . . . 0.0 109.476 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 48.8 m -59.59 116.77 4.24 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.27 -0.894 . . . . 0.0 109.51 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 70.5 m -164.59 98.64 0.79 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.309 -0.869 . . . . 0.0 109.391 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 73.9 p -150.29 82.94 1.37 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.331 -0.856 . . . . 0.0 109.358 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 75.7 p -150.63 40.03 0.74 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.231 -0.918 . . . . 0.0 109.295 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 28.2 m -59.57 144.18 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.226 -0.921 . . . . 0.0 109.598 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 52.0 t-20 -66.83 125.43 25.87 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.263 -0.898 . . . . 0.0 109.425 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 89.8 mtm180 -64.21 -65.25 0.7 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.323 -0.86 . . . . 0.0 109.398 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 63.67 109.49 0.01 OUTLIER Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -66.37 -145.5 0.06 OUTLIER Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 11.9 m 53.18 26.71 5.24 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.248 -1.148 . . . . 0.0 109.367 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -63.47 -68.11 0.37 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.367 -0.833 . . . . 0.0 109.467 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 75.9 mt -64.75 -75.96 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.285 -0.884 . . . . 0.0 109.541 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 47.5 tt0 -68.27 142.88 55.46 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.3 -0.875 . . . . 0.0 109.46 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 31.2 t -171.21 66.8 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.329 -0.857 . . . . 0.0 109.424 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.428 ' O ' ' O ' ' A' ' 165' ' ' HIS . 63.4 mttm 52.54 -117.77 1.22 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.205 -0.934 . . . . 0.0 109.365 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . 0.428 ' O ' ' O ' ' A' ' 164' ' ' LYS . 0.8 OUTLIER 54.89 103.11 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.157 -0.964 . . . . 0.0 109.547 -179.958 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 52.2 p90 . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 117.923 -1.037 . . . . 0.0 109.483 179.959 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 73.19 129.57 0.13 Allowed Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.519 ' O ' ' CD2' ' A' ' 4' ' ' PHE . 0.1 OUTLIER -79.03 132.16 36.53 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.199 -1.177 . . . . 0.0 109.413 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.519 ' CD2' ' O ' ' A' ' 3' ' ' THR . 65.8 m-85 -160.34 35.37 0.17 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.258 -0.901 . . . . 0.0 109.488 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 80.3 mtm180 -60.44 -11.67 7.46 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.311 -0.868 . . . . 0.0 109.471 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.497 ' N ' ' CD ' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -168.92 169.23 9.84 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.256 -0.902 . . . . 0.0 109.512 179.938 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -170.36 145.18 2.64 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.301 -0.874 . . . . 0.0 109.533 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.414 ' C ' ' H ' ' A' ' 10' ' ' VAL . . . 173.45 -79.26 0.08 OUTLIER Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.5 m 53.92 12.27 0.42 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.207 -1.172 . . . . 0.0 109.463 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.414 ' H ' ' C ' ' A' ' 8' ' ' GLY . 23.9 t -62.28 -11.37 6.27 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.227 -0.921 . . . . 0.0 109.403 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 29.4 t -158.76 -80.17 0.06 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.271 -0.893 . . . . 0.0 109.362 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.3 t -62.69 130.58 45.6 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.209 -0.932 . . . . 0.0 109.486 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -173.06 -11.7 0.02 OUTLIER Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.423 ' O ' ' O ' ' A' ' 15' ' ' LYS . 41.1 p -152.88 87.68 1.3 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.28 -1.13 . . . . 0.0 109.278 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.423 ' O ' ' O ' ' A' ' 14' ' ' THR . 31.1 ttmt 59.39 154.69 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.415 -0.803 . . . . 0.0 109.482 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -72.61 116.12 12.7 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.224 -0.922 . . . . 0.0 109.611 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 50.7 tt0 -62.6 -27.18 69.02 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.278 -0.889 . . . . 0.0 109.405 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 40.5 p90 -163.46 176.17 10.04 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.407 -0.808 . . . . 0.0 109.218 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.427 ' O ' ' OG1' ' A' ' 20' ' ' THR . 2.1 t60 -168.32 -59.36 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.108 -0.995 . . . . 0.0 109.695 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.47 ' OG1' ' N ' ' A' ' 21' ' ' GLY . 45.4 p 48.58 -103.27 0.1 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.165 -0.959 . . . . 0.0 109.482 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.47 ' N ' ' OG1' ' A' ' 20' ' ' THR . . . -151.56 32.07 0.92 Allowed Glycine 0 N--CA 1.494 2.541 0 N-CA-C 109.496 -1.441 . . . . 0.0 109.496 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 18.8 mmmt -82.59 97.1 8.3 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.203 -1.175 . . . . 0.0 109.407 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.445 ' CD1' ' N ' ' A' ' 23' ' ' LEU . 10.0 mp -79.43 85.01 5.26 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.249 -0.907 . . . . 0.0 109.199 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 8.3 p -64.79 145.58 13.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.169 -0.957 . . . . 0.0 109.571 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.8 t -50.36 158.78 0.55 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.285 -0.884 . . . . 0.0 109.52 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.5 t -172.59 3.72 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.372 -0.83 . . . . 0.0 109.472 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 57.0 mttp 52.75 -174.84 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.217 -0.927 . . . . 0.0 109.526 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 174.49 -68.27 0.1 OUTLIER Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -171.01 81.29 0.08 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.26 -1.141 . . . . 0.0 109.493 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.4 tttm -69.93 73.98 0.44 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.306 -0.871 . . . . 0.0 109.505 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.484 ' C ' ' H ' ' A' ' 33' ' ' LEU . 31.8 tt0 -65.61 165.2 12.81 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.249 -0.907 . . . . 0.0 109.33 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.4 ' O ' ' O ' ' A' ' 33' ' ' LEU . 18.1 mt -56.24 -6.52 0.27 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.215 -0.928 . . . . 0.0 109.314 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.484 ' H ' ' C ' ' A' ' 31' ' ' GLU . 50.4 tp 50.58 94.02 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.329 -0.857 . . . . 0.0 109.305 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 79.0 mt -67.82 155.93 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.239 -0.913 . . . . 0.0 109.413 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -167.71 -101.22 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.237 -0.915 . . . . 0.0 109.418 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 -157.18 -6.73 0.09 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.323 -0.86 . . . . 0.0 109.412 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 55.53 -127.38 2.14 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.198 -0.939 . . . . 0.0 109.344 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.9 mmtm -53.75 -84.92 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.203 -0.936 . . . . 0.0 109.406 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.437 ' O ' ' C ' ' A' ' 40' ' ' THR . 3.6 p -167.81 88.84 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.207 -0.933 . . . . 0.0 109.583 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.48 ' OG1' ' N ' ' A' ' 41' ' ' SER . 6.0 t 35.02 -153.35 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.122 0 CA-C-O 121.219 0.533 . . . . 0.0 110.954 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.48 ' N ' ' OG1' ' A' ' 40' ' ' THR . 32.5 m -166.28 -139.05 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.324 -0.86 . . . . 0.0 109.529 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 168.99 -136.64 4.15 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.417 -1.473 . . . . 0.0 109.417 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.65 ' CG ' ' H ' ' A' ' 44' ' ' THR . 0.0 OUTLIER -59.5 -103.28 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.184 -1.186 . . . . 0.0 109.368 179.947 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.65 ' H ' ' CG ' ' A' ' 43' ' ' HIS . 3.9 p 58.74 117.81 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.451 -0.781 . . . . 0.0 109.862 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.491 ' C ' ' H ' ' A' ' 47' ' ' THR . 12.1 p 52.56 72.39 0.41 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.171 -0.955 . . . . 0.0 109.475 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 81.4 p -76.07 33.34 0.12 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.201 -0.937 . . . . 0.0 109.466 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.491 ' H ' ' C ' ' A' ' 45' ' ' THR . 3.0 m 59.31 10.66 1.84 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.241 -0.912 . . . . 0.0 109.366 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 42.9 ttp180 -146.05 148.18 32.41 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.206 -0.934 . . . . 0.0 109.142 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.516 ' CG ' HH11 ' A' ' 49' ' ' ARG . 0.9 OUTLIER -97.19 139.18 33.55 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.145 -0.972 . . . . 0.0 109.621 179.888 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 36.8 t -62.39 -105.01 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.266 -0.896 . . . . 0.0 109.234 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.49 ' SG ' ' O ' ' A' ' 81' ' ' CYS . 5.6 t -49.75 146.11 4.68 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.145 -0.972 . . . . 0.0 108.818 179.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 40.3 t 50.54 87.49 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.007 -1.058 . . . . 0.0 108.342 -179.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -75.84 104.84 6.56 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.307 -0.87 . . . . 0.0 110.292 -178.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 11.7 p -115.61 113.6 43.84 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 10.1 tp -128.52 125.44 63.69 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 65.4 p -128.89 111.41 13.03 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.359 -0.838 . . . . 0.0 109.278 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.401 ' H ' ' HB ' ' A' ' 69' ' ' THR . 0.1 OUTLIER -124.55 113.59 18.28 Favored 'General case' 0 N--CA 1.51 2.561 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 178.767 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.0 p -110.95 130.22 55.65 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.467 -0.771 . . . . 0.0 109.67 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.43 ' O ' ' CG2' ' A' ' 59' ' ' VAL . 2.8 m -132.55 120.3 41.77 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.14 0 O-C-N 121.481 -0.762 . . . . 0.0 109.207 178.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 33.9 p -109.11 133.86 52.46 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 37.6 t-20 -128.37 162.33 27.36 Favored 'General case' 0 N--CA 1.514 2.769 0 O-C-N 121.46 -0.775 . . . . 0.0 109.317 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.441 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -71.91 -32.38 67.32 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 120.559 -1.338 . . . . 0.0 112.558 -177.641 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -69.21 5.59 1.21 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.372 -1.455 . . . . 0.0 109.953 -178.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.441 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 90.79 4.76 69.33 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 110.08 -1.208 . . . . 0.0 110.08 179.227 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 11.2 mpt_? -80.67 94.24 6.3 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 120.636 -1.508 . . . . 0.0 107.86 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 31.0 p -120.36 89.66 3.17 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -94.73 122.21 37.11 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.268 -0.895 . . . . 0.0 110.051 -178.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.455 ' C ' ' H ' ' A' ' 70' ' ' LYS . 40.8 p -101.19 109.18 21.01 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.329 -0.857 . . . . 0.0 109.581 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.524 ' O ' ' N ' ' A' ' 71' ' ' GLU . 5.2 m -87.4 31.19 0.75 Allowed 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 178.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.455 ' H ' ' C ' ' A' ' 68' ' ' THR . 16.5 ptmt -64.84 59.01 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.524 ' N ' ' O ' ' A' ' 69' ' ' THR . 13.7 mm-40 -96.3 136.78 36.33 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.053 -1.029 . . . . 0.0 109.481 -179.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 10.4 m -128.15 129.8 69.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 15.1 t -129.08 114.32 31.89 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 CA-C-O 122.057 0.932 . . . . 0.0 108.946 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -97.38 -16.04 20.42 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.604 -179.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.406 ' C ' ' N ' ' A' ' 77' ' ' ASP . 50.8 m -158.92 -127.33 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.146 -0.971 . . . . 0.0 109.533 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.454 ' N ' ' CD ' ' A' ' 76' ' ' GLU . 19.4 mp0 51.56 15.67 0.37 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.285 -0.884 . . . . 0.0 109.325 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.406 ' N ' ' C ' ' A' ' 75' ' ' SER . 25.5 t70 -166.4 27.54 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.241 -0.912 . . . . 0.0 109.386 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.515 ' C ' ' H ' ' A' ' 80' ' ' ASP . . . -153.38 -52.15 0.01 OUTLIER Glycine 0 N--CA 1.493 2.458 0 N-CA-C 109.453 -1.459 . . . . 0.0 109.453 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 13.9 m 50.34 11.19 0.07 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.309 -1.113 . . . . 0.0 109.272 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.515 ' H ' ' C ' ' A' ' 78' ' ' GLY . 3.5 p30 -169.78 32.96 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.308 -0.87 . . . . 0.0 109.464 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.49 ' O ' ' SG ' ' A' ' 51' ' ' CYS . 8.5 t -113.35 29.6 7.86 Favored 'General case' 0 N--CA 1.499 1.99 0 N-CA-C 108.976 -0.749 . . . . 0.0 108.976 179.542 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.521 ' C ' ' H ' ' A' ' 84' ' ' ALA . . . -177.67 -32.36 0.05 OUTLIER Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -68.81 42.76 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.221 -1.164 . . . . 0.0 109.407 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.521 ' H ' ' C ' ' A' ' 82' ' ' GLY . . . -68.16 -177.77 0.92 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.287 -0.883 . . . . 0.0 109.506 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 46.0 t0 53.43 58.59 5.06 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.224 -0.922 . . . . 0.0 109.451 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.434 ' C ' ' H ' ' A' ' 88' ' ' TRP . 50.7 t80 -170.84 -25.42 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.269 -0.895 . . . . 0.0 109.472 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -79.0 24.53 0.31 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.198 -0.939 . . . . 0.0 109.5 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . 0.434 ' H ' ' C ' ' A' ' 86' ' ' PHE . 43.8 m95 -75.98 9.19 2.57 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.263 -0.898 . . . . 0.0 109.501 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.663 ' H ' ' HD1' ' A' ' 89' ' ' HIS . 0.7 OUTLIER -76.41 117.91 18.55 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.25 -0.906 . . . . 0.0 109.504 -179.887 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.524 ' CG ' ' O ' ' A' ' 89' ' ' HIS . 42.2 m80 -158.13 -48.32 0.06 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.298 -0.876 . . . . 0.0 109.337 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 4.5 p 57.5 25.76 11.86 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.319 -0.863 . . . . 0.0 109.773 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 57.3 t80 52.71 75.35 0.65 Allowed Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 121.191 -0.943 . . . . 0.0 109.674 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -63.48 -172.03 0.14 Allowed 'Trans proline' 0 C--N 1.317 -1.114 0 C-N-CA 121.449 1.433 . . . . 0.0 109.741 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.429 ' O ' ' N ' ' A' ' 96' ' ' GLY . 30.4 t -164.45 -176.4 4.35 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.207 -0.933 . . . . 0.0 109.531 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.498 ' H ' ' NE ' ' A' ' 95' ' ' ARG . 0.1 OUTLIER -65.98 76.95 0.09 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.158 -0.964 . . . . 0.0 109.164 179.952 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.429 ' N ' ' O ' ' A' ' 94' ' ' SER . . . 166.89 55.61 0.03 OUTLIER Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -67.89 -56.26 9.75 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.268 -1.136 . . . . 0.0 109.457 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.406 ' O ' ' O ' ' A' ' 99' ' ' ASP . 16.4 mt -69.22 176.57 3.21 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.18 -0.95 . . . . 0.0 109.446 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.406 ' O ' ' O ' ' A' ' 98' ' ' LEU . 20.7 m-20 54.73 101.08 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.258 -0.901 . . . . 0.0 109.449 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.43 ' N ' ' OD1' ' A' ' 100' ' ' ASP . 23.4 p-10 -161.8 -12.13 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.272 -0.892 . . . . 0.0 109.566 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -68.14 -20.65 64.92 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.21 -0.931 . . . . 0.0 109.479 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 66.3 t80 46.3 64.84 1.35 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.281 -0.887 . . . . 0.0 109.63 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.45 ' O ' ' N ' ' A' ' 105' ' ' ASP . 21.6 p80 -76.25 -23.08 54.48 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.303 -0.873 . . . . 0.0 109.501 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 75.9 mtm180 -68.04 62.38 0.08 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.263 -0.898 . . . . 0.0 109.37 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.45 ' N ' ' O ' ' A' ' 103' ' ' HIS . 19.1 p-10 -79.17 10.05 3.94 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.249 -0.907 . . . . 0.0 109.35 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -72.06 52.03 0.24 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.324 -0.86 . . . . 0.0 109.358 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -69.75 163.56 25.47 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.26 -0.9 . . . . 0.0 109.443 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -169.31 73.88 0.09 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.264 -0.898 . . . . 0.0 109.519 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -72.69 -49.61 30.3 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.211 -0.931 . . . . 0.0 109.415 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -70.82 114.48 8.94 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.292 -0.88 . . . . 0.0 109.452 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 74.9 p -67.38 -25.72 66.11 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.276 -0.89 . . . . 0.0 109.42 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 54.5 mtp180 -68.35 147.95 51.4 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.231 -0.918 . . . . 0.0 109.472 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 91.5 p -72.79 -5.9 41.11 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.244 -0.91 . . . . 0.0 109.51 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 50.4 m 51.63 -106.84 0.28 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.285 -0.885 . . . . 0.0 109.517 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -170.97 103.06 0.22 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.246 -0.909 . . . . 0.0 109.48 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.453 ' CD ' ' N ' ' A' ' 116' ' ' GLU . 2.0 mp0 -76.47 83.17 3.18 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.316 -0.865 . . . . 0.0 109.538 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -74.68 128.67 36.12 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.25 -0.906 . . . . 0.0 109.496 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.444 ' OD1' ' N ' ' A' ' 118' ' ' ASP . 20.3 p-10 -170.45 163.09 8.47 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.262 -0.899 . . . . 0.0 109.514 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -72.32 84.07 0.53 Allowed Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.57 ' CG ' HH11 ' A' ' 120' ' ' ARG . 0.3 OUTLIER -169.19 89.37 0.2 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.199 -1.177 . . . . 0.0 109.434 179.929 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 52.4 p -66.61 129.16 38.95 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.301 -0.874 . . . . 0.0 109.537 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -68.19 -127.4 0.03 OUTLIER Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.443 -1.463 . . . . 0.0 109.443 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.497 ' CD1' ' N ' ' A' ' 123' ' ' LEU . 8.5 mp -64.08 126.53 27.99 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.181 -1.188 . . . . 0.0 109.09 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -67.31 162.05 58.93 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.108 -0.995 . . . . 0.0 108.924 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -58.11 -15.26 22.24 Favored 'Trans proline' 0 C--N 1.32 -0.962 0 C-N-CA 121.404 1.403 . . . . 0.0 109.854 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 67.8 mm-40 50.94 25.63 2.3 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.251 -0.906 . . . . 0.0 109.362 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 55.58 58.46 4.53 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.348 -0.845 . . . . 0.0 109.388 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.91 -161.29 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.311 -0.868 . . . . 0.0 109.471 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -171.37 -167.21 0.51 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.157 -0.964 . . . . 0.0 109.441 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.497 ' CD1' ' N ' ' A' ' 130' ' ' LEU . 8.5 mp -75.79 164.44 26.24 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.2 -0.938 . . . . 0.0 109.248 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -65.75 -67.65 1.94 Allowed Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 52.37 92.09 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.217 -1.166 . . . . 0.0 109.528 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 98.6 p -67.87 -26.66 66.13 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.263 -0.898 . . . . 0.0 109.456 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 68.56 -97.65 0.49 Allowed Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 49.2 m -60.57 152.33 26.43 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.286 -1.126 . . . . 0.0 109.444 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 68.9 m -166.4 157.58 12.98 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.3 -0.875 . . . . 0.0 109.467 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' SER . . . . . 0.405 ' O ' ' OG ' ' A' ' 138' ' ' SER . 55.7 m -64.53 -68.21 0.37 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.272 -0.893 . . . . 0.0 109.474 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' SER . . . . . 0.496 ' OG ' ' N ' ' A' ' 139' ' ' LYS . 24.3 p 52.95 -134.86 1.61 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.282 -0.886 . . . . 0.0 109.463 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.496 ' N ' ' OG ' ' A' ' 138' ' ' SER . 55.2 pttt -161.6 -6.88 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.202 -0.937 . . . . 0.0 109.457 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 43.8 m -64.43 132.43 50.01 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.21 -0.931 . . . . 0.0 109.431 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' SER . . . . . 0.426 ' O ' ' O ' ' A' ' 142' ' ' THR . 42.6 t -166.86 162.88 16.18 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.164 -0.96 . . . . 0.0 109.434 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' THR . . . . . 0.426 ' O ' ' O ' ' A' ' 141' ' ' SER . 19.4 m 53.98 100.96 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.234 -0.916 . . . . 0.0 109.496 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 -159.65 82.54 0.74 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.204 -0.935 . . . . 0.0 109.468 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' SER . . . . . 0.515 ' O ' ' N ' ' A' ' 146' ' ' GLN . 78.5 p -167.28 123.5 1.13 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.269 -0.894 . . . . 0.0 109.515 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . 0.446 ' C ' ' H ' ' A' ' 147' ' ' PHE . 16.2 pttp -62.12 76.66 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.222 -0.924 . . . . 0.0 109.388 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . 0.515 ' N ' ' O ' ' A' ' 144' ' ' SER . 76.3 mt-30 -53.75 -10.63 0.31 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.256 -0.902 . . . . 0.0 109.497 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . 0.446 ' H ' ' C ' ' A' ' 145' ' ' LYS . 60.3 t80 -67.83 -34.44 76.73 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.233 -0.917 . . . . 0.0 109.457 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 23.0 t 52.44 95.19 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.226 -0.921 . . . . 0.0 109.475 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 49.0 m -67.63 -62.04 1.6 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.234 -0.917 . . . . 0.0 109.397 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 49.3 m -58.51 115.46 3.02 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.293 -0.879 . . . . 0.0 109.49 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 90.6 p -169.95 -56.52 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.295 -0.878 . . . . 0.0 109.496 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' THR . . . . . 0.523 ' HG1' ' H ' ' A' ' 153' ' ' THR . 1.8 t -172.98 174.56 3.47 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.289 -0.882 . . . . 0.0 109.499 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' THR . . . . . 0.523 ' H ' ' HG1' ' A' ' 152' ' ' THR . 0.0 OUTLIER -53.37 124.17 14.0 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.183 -0.948 . . . . 0.0 109.52 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.419 ' O ' ' O ' ' A' ' 155' ' ' ASN . 27.6 m -71.61 145.54 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.194 -0.941 . . . . 0.0 109.504 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . 0.419 ' O ' ' O ' ' A' ' 154' ' ' VAL . 6.1 m120 50.88 -179.7 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.228 -0.92 . . . . 0.0 109.559 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 54.6 mtp180 -77.03 -12.78 59.98 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.225 -0.922 . . . . 0.0 109.472 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 68.05 24.24 74.54 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 66.61 -149.74 51.53 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 88.6 p -171.37 22.69 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.255 -1.144 . . . . 0.0 109.428 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -71.9 -54.15 10.94 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.269 -0.895 . . . . 0.0 109.465 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 13.8 tt -74.0 118.13 19.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.207 -0.933 . . . . 0.0 109.577 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 6.1 tm-20 -165.33 115.8 1.09 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.194 -0.941 . . . . 0.0 109.284 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.478 ' O ' ' N ' ' A' ' 165' ' ' HIS . 30.0 t -165.57 -31.87 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.302 -0.874 . . . . 0.0 109.46 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 48.5 mtmt 51.31 -92.47 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.281 -0.887 . . . . 0.0 109.424 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . 0.478 ' N ' ' O ' ' A' ' 163' ' ' SER . 0.0 OUTLIER -169.34 69.3 0.06 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.298 -0.876 . . . . 0.0 109.432 -179.984 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 48.7 p90 . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 118.012 -0.995 . . . . 0.0 109.462 179.955 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.0 ptt? . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 164.55 166.1 22.92 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.0 t -65.68 146.67 54.51 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.211 -1.17 . . . . 0.0 109.459 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -167.56 71.61 0.1 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.236 -0.915 . . . . 0.0 109.397 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 59.8 mtm180 -149.9 142.97 24.96 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.314 -0.866 . . . . 0.0 109.375 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -170.64 -29.06 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.232 -0.917 . . . . 0.0 109.429 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -170.63 85.22 0.1 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.298 -0.876 . . . . 0.0 109.415 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.422 ' O ' ' O ' ' A' ' 9' ' ' SER . . . 152.24 48.28 0.02 OUTLIER Glycine 0 N--CA 1.493 2.45 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.422 ' O ' ' O ' ' A' ' 8' ' ' GLY . 29.7 t -55.68 -103.78 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.253 -1.145 . . . . 0.0 109.513 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 43.5 t -74.92 -76.07 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.188 -0.945 . . . . 0.0 109.496 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 89.4 p -75.27 125.54 29.17 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.18 -0.95 . . . . 0.0 109.547 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.0 m -60.59 -158.35 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.232 -0.917 . . . . 0.0 109.465 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -60.24 -165.89 0.23 Allowed Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 37.6 m -61.02 132.83 55.1 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.213 -1.169 . . . . 0.0 109.519 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -59.23 -71.12 0.13 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.323 -0.86 . . . . 0.0 109.535 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -66.03 111.07 3.18 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.239 -0.913 . . . . 0.0 109.473 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -59.77 -41.84 91.98 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.183 -0.948 . . . . 0.0 109.479 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -67.44 -156.87 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.298 -0.877 . . . . 0.0 109.498 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.408 ' O ' ' OG1' ' A' ' 20' ' ' THR . 1.2 p-80 -174.62 10.65 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.253 -0.905 . . . . 0.0 109.508 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.408 ' OG1' ' O ' ' A' ' 19' ' ' HIS . 91.3 m -166.38 -64.82 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.204 -0.935 . . . . 0.0 109.465 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 165.28 -161.77 35.14 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.541 -1.423 . . . . 0.0 109.541 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 22.7 pttm -166.47 132.8 2.44 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.183 -1.187 . . . . 0.0 109.474 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.498 ' CD1' ' N ' ' A' ' 23' ' ' LEU . 8.9 mp 50.0 76.29 0.14 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.204 -0.935 . . . . 0.0 109.266 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.0 t -56.46 -47.71 81.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.314 -0.866 . . . . 0.0 109.44 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 68.6 p -76.37 112.46 12.89 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.24 -0.913 . . . . 0.0 109.415 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 4.2 t -167.28 137.13 2.87 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.269 -0.895 . . . . 0.0 109.466 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -80.71 -87.97 0.08 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.23 -0.919 . . . . 0.0 109.429 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 171.02 69.88 0.04 OUTLIER Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -169.3 79.26 0.12 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.323 -1.104 . . . . 0.0 109.412 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.433 ' C ' ' H ' ' A' ' 32' ' ' LEU . 61.8 mttp -75.55 96.89 3.6 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.296 -0.877 . . . . 0.0 109.464 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 82.9 mt-10 -69.48 48.62 0.08 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.21 -0.931 . . . . 0.0 109.389 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.5 ' C ' ' H ' ' A' ' 34' ' ' ILE . 0.2 OUTLIER -65.01 -36.25 83.79 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.271 -0.893 . . . . 0.0 109.063 -179.962 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.428 ' O ' ' O ' ' A' ' 34' ' ' ILE . 15.1 mt -67.22 5.82 0.66 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.197 -0.939 . . . . 0.0 109.517 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.5 ' H ' ' C ' ' A' ' 32' ' ' LEU . 88.2 mt 51.65 98.01 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.254 -0.904 . . . . 0.0 109.53 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.41 ' O ' ' O ' ' A' ' 34' ' ' ILE . 15.4 p-10 -62.79 -123.66 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.251 -0.906 . . . . 0.0 109.404 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.402 ' H ' ' CG ' ' A' ' 35' ' ' ASP . 59.1 t30 53.01 38.27 26.84 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.184 -0.947 . . . . 0.0 109.426 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -68.21 116.26 8.61 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.214 -0.929 . . . . 0.0 109.441 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -68.51 -145.48 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.28 -0.888 . . . . 0.0 109.436 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 28.1 m -56.87 147.93 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.204 -0.935 . . . . 0.0 109.439 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 48.4 m -165.31 -53.42 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.237 -0.915 . . . . 0.0 109.47 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 40.7 t -61.64 -59.66 4.85 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.228 -0.92 . . . . 0.0 109.444 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -178.16 116.36 0.53 Allowed Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.432 ' O ' ' ND1' ' A' ' 43' ' ' HIS . 14.3 p80 -60.78 100.56 0.11 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.218 -1.166 . . . . 0.0 109.532 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.1 m -165.16 154.45 12.64 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.273 -0.892 . . . . 0.0 109.394 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -173.02 139.67 0.84 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.167 -0.958 . . . . 0.0 109.508 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 36.6 m -66.99 124.52 23.25 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.15 -0.969 . . . . 0.0 109.329 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 74.2 p -152.98 -136.9 0.06 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.315 -0.866 . . . . 0.0 108.833 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -146.6 142.36 27.88 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.188 -0.945 . . . . 0.0 108.958 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.475 ' O ' ' O ' ' A' ' 52' ' ' SER . 22.6 mmt180 -99.79 122.25 42.48 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.232 -0.917 . . . . 0.0 109.488 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.514 ' C ' ' H ' ' A' ' 52' ' ' SER . 29.5 t -78.71 -36.84 42.83 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.063 -1.023 . . . . 0.0 110.22 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 25.9 p -56.02 -4.02 0.11 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.029 -1.044 . . . . 0.0 109.744 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.524 ' OG ' ' N ' ' A' ' 53' ' ' LYS . 0.9 OUTLIER -166.26 -175.17 3.17 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 -179.78 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.524 ' N ' ' OG ' ' A' ' 52' ' ' SER . 44.6 tptt -103.89 101.67 11.46 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 120.95 -1.094 . . . . 0.0 108.049 179.176 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 21.7 t -127.63 114.73 37.03 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.875 0 O-C-N 121.479 -0.763 . . . . 0.0 109.975 -179.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.491 ' CG2' ' NZ ' ' A' ' 57' ' ' LYS . 35.9 mm -117.84 113.64 42.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 179.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 81.7 p -130.34 112.97 13.79 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.223 -0.923 . . . . 0.0 109.937 -179.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.57 ' N ' ' OG1' ' A' ' 69' ' ' THR . 10.9 mmtp -123.86 114.19 19.52 Favored 'General case' 0 N--CA 1.515 2.777 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 178.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 53.3 m -119.5 124.43 46.44 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.609 -0.682 . . . . 0.0 109.613 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.8 m -131.48 124.88 55.47 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.187 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.0 t -109.23 122.93 48.38 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.757 -0.589 . . . . 0.0 110.323 -179.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -110.56 144.94 38.66 Favored 'General case' 0 N--CA 1.513 2.685 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.506 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -62.82 -34.7 77.86 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 120.084 -1.635 . . . . 0.0 112.944 -177.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -66.24 5.63 0.52 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.355 -1.466 . . . . 0.0 110.045 -178.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.506 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 90.83 5.49 68.41 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 110.423 -1.071 . . . . 0.0 110.423 178.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 41.2 ttm180 -90.54 111.98 23.47 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.644 -1.504 . . . . 0.0 107.834 178.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.8 p -138.47 116.95 12.04 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.255 -0.903 . . . . 0.0 109.81 -179.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -94.35 119.51 33.21 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.281 -0.887 . . . . 0.0 109.77 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.0 p -103.46 109.0 20.49 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.431 -0.793 . . . . 0.0 109.395 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.57 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 4.6 p -111.62 26.72 10.35 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 107.383 -1.339 . . . . 0.0 107.383 178.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 36.4 pttt -65.36 65.9 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' A' ' 69' ' ' THR . 46.5 mt-10 -102.34 156.69 17.42 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.373 -0.83 . . . . 0.0 110.26 -179.121 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.3 p -127.56 136.32 60.8 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.449 ' O ' ' CB ' ' A' ' 74' ' ' LYS . 20.1 t -129.44 117.53 42.98 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.101 0 CA-C-O 121.972 0.891 . . . . 0.0 109.921 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.449 ' CB ' ' O ' ' A' ' 73' ' ' VAL . 0.1 OUTLIER 161.44 -68.02 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 179.627 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 97.1 p -160.94 -137.89 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.402 -0.812 . . . . 0.0 109.307 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -66.45 -50.33 63.72 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.185 -0.947 . . . . 0.0 109.282 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.411 ' OD1' ' O ' ' A' ' 77' ' ' ASP . 60.7 t0 -166.19 47.82 0.08 Allowed 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.313 -0.867 . . . . 0.0 109.198 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.527 ' C ' ' H ' ' A' ' 80' ' ' ASP . . . 89.82 83.06 1.34 Allowed Glycine 0 N--CA 1.494 2.529 0 N-CA-C 109.396 -1.482 . . . . 0.0 109.396 -179.732 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 49.5 m -61.15 -0.01 0.29 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.301 -1.117 . . . . 0.0 109.464 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.527 ' H ' ' C ' ' A' ' 78' ' ' GLY . 39.2 m-20 -151.79 45.57 0.77 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.262 -0.899 . . . . 0.0 109.354 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.408 ' SG ' ' C ' ' A' ' 80' ' ' ASP . 25.6 m -150.84 -58.86 0.17 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.299 -0.875 . . . . 0.0 109.284 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -145.72 42.69 0.96 Allowed Glycine 0 N--CA 1.496 2.641 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.518 ' CG ' ' H ' ' A' ' 84' ' ' ALA . 13.5 t70 -171.05 -170.09 0.82 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.259 -1.142 . . . . 0.0 109.518 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.518 ' H ' ' CG ' ' A' ' 83' ' ' ASP . . . -160.79 146.88 14.9 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.269 -0.895 . . . . 0.0 109.34 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.483 ' OD1' ' N ' ' A' ' 86' ' ' PHE . 57.4 t0 -167.35 137.97 2.98 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.229 -0.92 . . . . 0.0 109.345 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.483 ' N ' ' OD1' ' A' ' 85' ' ' ASP . 47.7 m-85 -60.25 93.32 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.235 -0.915 . . . . 0.0 109.437 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -68.83 -41.51 78.47 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.256 -0.903 . . . . 0.0 109.48 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 -85.07 56.43 3.94 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.193 -0.942 . . . . 0.0 109.352 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.447 ' HD1' ' C ' ' A' ' 89' ' ' HIS . 0.2 OUTLIER -69.51 158.4 35.29 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.298 -0.876 . . . . 0.0 109.443 -179.952 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 30.4 p80 -168.05 137.37 2.5 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.251 -0.906 . . . . 0.0 109.319 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 80.5 p -76.38 -163.4 0.31 Allowed 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.177 -0.952 . . . . 0.0 109.547 -179.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.437 ' O ' ' CD2' ' A' ' 92' ' ' PHE . 82.2 t80 -168.6 67.95 0.72 Allowed Pre-proline 0 N--CA 1.49 1.545 0 O-C-N 121.3 -0.875 . . . . 0.0 109.594 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -61.59 131.78 37.37 Favored 'Trans proline' 0 C--N 1.317 -1.08 0 C-N-CA 121.367 1.378 . . . . 0.0 109.815 -179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 92.1 p -93.48 130.22 39.4 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.333 -0.854 . . . . 0.0 109.356 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.529 HH11 ' CG ' ' A' ' 95' ' ' ARG . 4.1 mtt-85 -68.3 -60.3 2.56 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.209 -0.932 . . . . 0.0 109.307 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 74.08 -154.81 48.51 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.417 -1.473 . . . . 0.0 109.417 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 17.8 p-10 -172.24 166.64 5.94 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.226 -1.161 . . . . 0.0 109.583 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -154.6 167.85 28.75 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.289 -0.882 . . . . 0.0 109.317 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.494 ' C ' ' H ' ' A' ' 101' ' ' PHE . 26.4 t70 -168.21 30.31 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.248 -0.908 . . . . 0.0 109.508 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -75.85 31.65 0.11 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.246 -0.909 . . . . 0.0 109.35 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.494 ' H ' ' C ' ' A' ' 99' ' ' ASP . 67.2 t80 -70.83 -32.48 69.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.276 -0.89 . . . . 0.0 109.406 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -61.94 -36.03 80.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.267 -0.896 . . . . 0.0 109.465 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.493 ' HD1' ' H ' ' A' ' 103' ' ' HIS . 6.7 m80 -60.89 -47.93 84.14 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.214 -0.929 . . . . 0.0 109.439 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 38.9 ttp180 -86.28 110.35 19.58 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.317 -0.864 . . . . 0.0 109.393 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.96 1.58 20.29 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.331 -0.855 . . . . 0.0 109.457 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.403 ' O ' ' C ' ' A' ' 107' ' ' ASP . 85.5 tttt 51.8 70.9 0.5 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.283 -0.886 . . . . 0.0 109.48 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.403 ' C ' ' O ' ' A' ' 106' ' ' LYS . 2.7 p30 41.94 -158.99 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.667 -0.645 . . . . 0.0 110.173 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.403 ' N ' ' OD1' ' A' ' 107' ' ' ASP . 18.3 t70 -167.9 -31.99 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.267 -0.896 . . . . 0.0 109.509 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -66.28 -19.48 65.83 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.243 -0.911 . . . . 0.0 109.466 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . 0.511 ' O ' ' CD2' ' A' ' 110' ' ' PHE . 75.1 t80 -70.57 52.27 0.14 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.311 -0.868 . . . . 0.0 109.465 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 42.9 m -165.11 81.42 0.35 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.258 -0.901 . . . . 0.0 109.475 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -64.05 130.96 46.08 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.327 -0.858 . . . . 0.0 109.465 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 93.5 p -70.14 -65.01 0.78 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.219 -0.925 . . . . 0.0 109.453 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 49.7 m -62.48 147.02 50.07 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.255 -0.903 . . . . 0.0 109.5 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 7.1 m-70 -67.41 174.59 3.25 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.245 -0.91 . . . . 0.0 109.515 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -67.23 -73.51 0.14 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.247 -0.908 . . . . 0.0 109.475 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -68.04 75.71 0.22 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.258 -0.902 . . . . 0.0 109.478 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -74.08 -21.26 59.99 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.238 -0.914 . . . . 0.0 109.504 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 69.23 94.87 0.05 OUTLIER Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -67.46 118.89 11.4 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.283 -1.128 . . . . 0.0 109.459 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 69.9 p -68.18 -158.23 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.233 -0.917 . . . . 0.0 109.479 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -175.87 -45.27 0.06 OUTLIER Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.522 ' CD1' ' N ' ' A' ' 123' ' ' LEU . 7.7 mp -76.3 129.59 36.87 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.213 -1.169 . . . . 0.0 109.264 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -70.05 162.37 69.31 Favored Pre-proline 0 N--CA 1.49 1.535 0 O-C-N 121.172 -0.955 . . . . 0.0 108.759 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -56.47 114.16 1.78 Allowed 'Trans proline' 0 C--N 1.32 -0.963 0 C-N-CA 121.344 1.363 . . . . 0.0 109.763 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -66.41 148.82 51.32 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.223 -0.923 . . . . 0.0 109.468 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -81.55 10.61 5.63 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.227 -0.921 . . . . 0.0 109.408 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -76.41 -71.67 0.38 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.242 -0.911 . . . . 0.0 109.46 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -67.31 -166.53 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.239 -0.913 . . . . 0.0 109.436 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 13.9 mt 54.37 -177.37 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.269 -0.894 . . . . 0.0 109.438 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 171.04 88.83 0.07 OUTLIER Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.581 -1.407 . . . . 0.0 109.581 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 22.6 tp10 -168.82 -75.05 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.222 -1.164 . . . . 0.0 109.49 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 45.6 t -72.72 139.31 47.12 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.208 -0.933 . . . . 0.0 109.452 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 177.34 138.44 3.0 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' SER . . . . . 0.418 ' O ' ' N ' ' A' ' 137' ' ' SER . 87.6 p -170.0 33.26 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.272 -1.134 . . . . 0.0 109.45 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 88.5 p -69.99 54.3 0.13 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.283 -0.886 . . . . 0.0 109.478 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' SER . . . . . 0.418 ' N ' ' O ' ' A' ' 135' ' ' SER . 52.5 m -69.61 55.61 0.12 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.283 -0.886 . . . . 0.0 109.526 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 92.1 p -66.95 114.77 6.01 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.323 -0.86 . . . . 0.0 109.537 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 61.8 mttm -70.47 58.37 0.19 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.247 -0.908 . . . . 0.0 109.45 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 2.8 t -61.99 159.04 15.0 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.2 -0.937 . . . . 0.0 109.474 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' SER . . . . . 0.402 ' O ' ' OG1' ' A' ' 142' ' ' THR . 60.3 m -74.62 -39.32 62.2 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.273 -0.892 . . . . 0.0 109.444 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' THR . . . . . 0.519 ' O ' ' CG ' ' A' ' 143' ' ' HIS . 90.0 m -165.58 -77.62 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.287 -0.883 . . . . 0.0 109.449 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . 0.519 ' CG ' ' O ' ' A' ' 142' ' ' THR . 43.6 m80 -158.22 149.98 21.52 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.242 -0.911 . . . . 0.0 109.472 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 50.8 m -71.14 79.19 0.69 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.25 -0.906 . . . . 0.0 109.492 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -67.53 82.26 0.17 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.259 -0.9 . . . . 0.0 109.479 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . 0.489 ' C ' ' H ' ' A' ' 148' ' ' VAL . 49.4 tt0 -168.44 -65.44 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.19 -0.943 . . . . 0.0 109.439 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . 0.519 ' O ' ' CD2' ' A' ' 147' ' ' PHE . 80.9 t80 -72.49 14.0 0.29 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.294 -0.879 . . . . 0.0 109.364 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . 0.489 ' H ' ' C ' ' A' ' 146' ' ' GLN . 44.0 t -148.07 -75.97 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.219 -0.925 . . . . 0.0 109.363 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 47.5 t -76.79 -178.94 5.1 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.269 -0.894 . . . . 0.0 109.509 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 13.3 t 51.86 17.19 0.6 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.269 -0.894 . . . . 0.0 109.477 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 78.6 p -71.35 -100.93 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.24 -0.913 . . . . 0.0 109.542 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 47.5 m -78.5 105.97 10.13 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.246 -0.909 . . . . 0.0 109.566 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 70.6 p -144.55 -12.6 0.59 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.311 -0.868 . . . . 0.0 109.39 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 21.7 t 51.08 80.68 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.182 -0.949 . . . . 0.0 109.47 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 44.2 m-20 50.87 -146.48 0.44 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.221 -0.925 . . . . 0.0 109.452 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 69.6 ttt180 -166.05 149.61 7.64 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.248 -0.907 . . . . 0.0 109.454 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 73.49 176.79 33.31 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -69.25 -106.43 0.03 OUTLIER Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 73.2 p -169.01 0.56 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.265 -1.138 . . . . 0.0 109.452 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -159.69 78.71 0.7 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.296 -0.878 . . . . 0.0 109.461 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . 0.487 ' C ' ' H ' ' A' ' 163' ' ' SER . 75.8 mt -72.97 -40.57 59.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.259 -0.901 . . . . 0.0 109.461 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -68.9 44.39 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.163 -0.961 . . . . 0.0 109.494 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.487 ' H ' ' C ' ' A' ' 161' ' ' ILE . 54.2 m -72.12 65.23 0.57 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.225 -0.922 . . . . 0.0 109.368 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.407 ' O ' ' O ' ' A' ' 163' ' ' SER . 62.5 mmtt 53.24 176.6 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.256 -0.903 . . . . 0.0 109.448 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 11.9 m170 -64.87 -58.64 5.64 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.261 -0.899 . . . . 0.0 109.548 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 117.901 -1.047 . . . . 0.0 109.419 -179.985 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.4 ptt? . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 178.1 16.24 0.03 OUTLIER Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 25.7 m -165.37 98.39 0.71 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.321 -1.105 . . . . 0.0 109.453 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.513 ' O ' ' CD2' ' A' ' 4' ' ' PHE . 12.2 p90 -70.18 102.92 2.2 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.309 -0.87 . . . . 0.0 109.525 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 69.5 mtm180 -83.68 7.15 18.45 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.244 -0.91 . . . . 0.0 109.522 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -60.64 143.0 55.0 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.209 -0.932 . . . . 0.0 109.44 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.438 ' N ' ' CD ' ' A' ' 7' ' ' GLU . 21.0 mp0 -72.82 141.73 48.01 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.217 -0.927 . . . . 0.0 109.489 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -66.1 142.4 43.02 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.8 m 50.57 81.71 0.06 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.296 -1.12 . . . . 0.0 109.388 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.3 m -71.68 121.88 22.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.27 -0.894 . . . . 0.0 109.639 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.7 m -161.08 126.86 3.8 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.177 -0.952 . . . . 0.0 109.45 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.1 t 54.17 -168.66 0.07 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.315 -0.866 . . . . 0.0 109.443 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 176.42 -67.61 0.09 OUTLIER Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.6 t -170.04 37.97 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.224 -1.162 . . . . 0.0 109.527 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.495 ' C ' ' H ' ' A' ' 17' ' ' GLU . 19.8 tptp -83.79 -24.07 31.2 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.282 -0.886 . . . . 0.0 109.441 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -66.95 5.96 0.58 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.235 -0.916 . . . . 0.0 109.488 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.495 ' H ' ' C ' ' A' ' 15' ' ' LYS . 58.1 mm-40 -62.89 -42.51 99.8 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.269 -0.895 . . . . 0.0 109.392 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -67.58 81.06 0.17 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.208 -0.932 . . . . 0.0 109.372 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.627 ' N ' ' HD1' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -76.74 -168.33 1.01 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.226 -0.921 . . . . 0.0 109.42 -179.923 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 85.4 m -71.36 105.28 3.46 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.205 -0.935 . . . . 0.0 109.494 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -82.91 -15.34 72.98 Favored Glycine 0 N--CA 1.492 2.382 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -45.86 142.1 2.73 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.277 -1.131 . . . . 0.0 109.724 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.496 ' CD1' ' N ' ' A' ' 23' ' ' LEU . 8.8 mp -80.98 72.95 8.03 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.315 -0.866 . . . . 0.0 109.15 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 29.7 m -74.04 141.32 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.262 -0.899 . . . . 0.0 109.465 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 70.4 p -149.98 89.34 1.59 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.235 -0.916 . . . . 0.0 109.289 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 47.0 m -78.46 149.21 33.27 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.283 -0.885 . . . . 0.0 109.47 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.419 ' NZ ' ' CB ' ' A' ' 27' ' ' LYS . 7.0 ttpm? -149.84 165.27 33.02 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.265 -0.897 . . . . 0.0 109.316 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 167.3 107.4 0.2 Allowed Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -79.31 124.17 28.15 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.168 -1.195 . . . . 0.0 109.301 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -90.73 148.86 22.3 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.241 -0.912 . . . . 0.0 109.652 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 53.05 86.34 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.375 -0.828 . . . . 0.0 109.807 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.511 ' C ' ' H ' ' A' ' 34' ' ' ILE . 9.7 mp -84.18 -17.78 38.83 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.244 -0.91 . . . . 0.0 109.158 179.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 14.3 mt 50.3 11.07 0.06 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.31 -0.869 . . . . 0.0 109.548 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.511 ' H ' ' C ' ' A' ' 32' ' ' LEU . 96.5 mt -135.35 116.64 19.82 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.013 0 O-C-N 121.441 -0.787 . . . . 0.0 109.073 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -74.26 74.87 1.83 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.233 -0.917 . . . . 0.0 109.619 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.517 ' O ' ' N ' ' A' ' 38' ' ' LYS . 27.6 m120 -71.84 -179.55 2.73 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.279 -0.888 . . . . 0.0 109.39 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 80.3 mt-10 -62.69 75.78 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.262 -0.899 . . . . 0.0 109.43 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.517 ' N ' ' O ' ' A' ' 36' ' ' ASN . 7.3 tppt? -69.91 -28.95 66.03 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.315 -0.865 . . . . 0.0 109.472 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.43 ' O ' ' OG1' ' A' ' 40' ' ' THR . 7.2 p -60.48 128.18 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 121.183 -0.948 . . . . 0.0 109.407 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.43 ' OG1' ' O ' ' A' ' 39' ' ' VAL . 42.0 m -166.74 117.29 0.92 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.259 -0.901 . . . . 0.0 109.4 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.403 ' OG ' ' O ' ' A' ' 40' ' ' THR . 69.0 m -166.06 -12.38 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.292 -0.88 . . . . 0.0 109.431 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 62.08 -134.42 46.03 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.426 ' O ' ' OG1' ' A' ' 44' ' ' THR . 67.1 t60 -171.33 -35.47 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.257 -1.143 . . . . 0.0 109.263 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.433 ' O ' ' O ' ' A' ' 45' ' ' THR . 20.0 p 50.79 -143.12 0.64 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.405 -0.809 . . . . 0.0 109.341 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.513 ' O ' ' N ' ' A' ' 47' ' ' THR . 30.9 p 49.3 95.62 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.22 -0.925 . . . . 0.0 109.486 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.06 68.47 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.222 -0.924 . . . . 0.0 109.565 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.513 ' N ' ' O ' ' A' ' 45' ' ' THR . 65.8 p -68.16 -58.25 4.76 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.251 -0.906 . . . . 0.0 109.276 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 15.9 ptm180 -145.72 141.86 28.43 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.277 -0.89 . . . . 0.0 109.194 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.427 ' O ' ' O ' ' A' ' 50' ' ' SER . 32.9 ttp180 -95.83 140.87 29.99 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.165 -0.959 . . . . 0.0 110.286 -179.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.427 ' O ' ' O ' ' A' ' 49' ' ' ARG . 11.9 m 53.45 171.36 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.338 -0.851 . . . . 0.0 110.206 179.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.448 ' SG ' ' N ' ' A' ' 52' ' ' SER . 6.2 p -58.88 -62.05 2.17 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.387 -0.821 . . . . 0.0 109.165 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.448 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 9.0 t -49.27 146.05 4.02 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.077 -1.015 . . . . 0.0 108.764 179.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -84.1 102.02 12.24 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 120.999 -1.063 . . . . 0.0 109.689 -179.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.415 ' CG1' ' O ' ' A' ' 54' ' ' VAL . 13.6 p -125.82 117.12 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 CA-C-O 121.576 0.703 . . . . 0.0 109.107 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 7.3 tp -128.36 138.4 54.75 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 49.0 m -128.07 113.31 15.62 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.35 -0.844 . . . . 0.0 109.518 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.427 ' O ' ' OG1' ' A' ' 69' ' ' THR . 5.5 mtmm -125.14 116.26 21.76 Favored 'General case' 0 N--CA 1.511 2.61 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 178.582 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.4 t -116.81 141.29 48.4 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.395 -0.816 . . . . 0.0 109.92 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.427 ' O ' ' CG2' ' A' ' 59' ' ' VAL . 2.8 m -132.31 120.8 44.29 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.16 0 O-C-N 121.554 -0.716 . . . . 0.0 109.311 179.067 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 32.0 p -110.16 133.36 53.3 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.836 -0.54 . . . . 0.0 109.841 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.429 ' OD1' ' N ' ' A' ' 62' ' ' ALA . 16.2 t-20 -137.55 172.18 13.36 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.367 -0.833 . . . . 0.0 109.734 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.468 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -63.32 -39.96 96.0 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.85 -1.156 . . . . 0.0 112.621 -177.357 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 35.9 m-20 -68.8 6.04 0.97 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.445 -1.409 . . . . 0.0 109.929 -178.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.519 ' O ' ' N ' ' A' ' 66' ' ' THR . . . 89.22 8.69 68.28 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.865 -1.294 . . . . 0.0 109.865 179.286 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.418 ' O ' ' O ' ' A' ' 59' ' ' VAL . 12.8 tpt180 -64.09 79.94 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.35 0 O-C-N 120.728 -1.454 . . . . 0.0 108.139 179.306 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.519 ' N ' ' O ' ' A' ' 64' ' ' GLY . 72.9 p -112.2 72.32 0.77 Allowed 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 -179.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -94.79 128.33 41.43 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.341 -0.85 . . . . 0.0 109.775 -179.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.581 ' C ' ' H ' ' A' ' 70' ' ' LYS . 31.3 p -100.01 109.8 22.12 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.323 -0.861 . . . . 0.0 109.675 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.531 ' O ' ' N ' ' A' ' 71' ' ' GLU . 5.3 m -78.7 36.39 0.26 Allowed 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 178.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.581 ' H ' ' C ' ' A' ' 68' ' ' THR . 40.7 pttt -65.07 62.65 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 179.098 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.531 ' N ' ' O ' ' A' ' 69' ' ' THR . 45.8 mt-10 -85.36 139.91 31.19 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.097 -1.002 . . . . 0.0 110.07 -179.364 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.403 ' O ' ' CG2' ' A' ' 72' ' ' VAL . 16.2 m -128.41 124.14 61.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.4 ' O ' ' OG ' ' A' ' 52' ' ' SER . 21.6 t -126.04 117.41 48.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 CA-C-O 122.16 0.981 . . . . 0.0 109.077 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.419 ' O ' ' O ' ' A' ' 75' ' ' SER . 96.1 mttt -86.85 51.76 2.33 Favored 'General case' 0 C--N 1.29 -2.001 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.545 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.419 ' O ' ' O ' ' A' ' 74' ' ' LYS . 2.3 m 60.32 149.6 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.324 -0.86 . . . . 0.0 109.648 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -79.63 9.13 5.35 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.41 -0.806 . . . . 0.0 109.338 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -165.3 -36.07 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.21 -0.931 . . . . 0.0 109.854 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 69.56 55.81 9.4 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 42.7 t -65.65 -17.78 64.84 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.245 -1.15 . . . . 0.0 109.434 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -162.82 24.19 0.09 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.324 -0.86 . . . . 0.0 109.493 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.404 ' SG ' ' N ' ' A' ' 52' ' ' SER . 12.1 t -162.53 133.71 5.04 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.368 -0.833 . . . . 0.0 109.415 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 83.2 -24.16 5.65 Favored Glycine 0 N--CA 1.492 2.429 0 N-CA-C 109.469 -1.452 . . . . 0.0 109.469 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 29.3 t70 51.35 21.29 1.13 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.196 -1.179 . . . . 0.0 109.432 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -71.57 55.16 0.24 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.264 -0.898 . . . . 0.0 109.447 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -61.03 137.91 58.21 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.274 -0.891 . . . . 0.0 109.537 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -69.16 161.14 29.76 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.195 -0.94 . . . . 0.0 109.447 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.436 ' O ' ' O ' ' A' ' 88' ' ' TRP . 6.9 p-10 -169.9 91.99 0.21 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.228 -0.92 . . . . 0.0 109.406 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . 0.436 ' O ' ' O ' ' A' ' 87' ' ' ASP . 1.7 m0 61.26 137.48 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.431 -0.793 . . . . 0.0 109.7 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -168.28 -70.83 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.215 -0.928 . . . . 0.0 109.376 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -66.78 -95.74 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.279 -0.888 . . . . 0.0 109.424 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.1 m -159.03 51.65 0.38 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.181 -0.95 . . . . 0.0 109.305 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.568 ' N ' ' CD ' ' A' ' 93' ' ' PRO . 0.2 OUTLIER -79.26 -44.77 1.69 Allowed Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.291 -0.88 . . . . 0.0 110.658 -179.932 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.568 ' CD ' ' N ' ' A' ' 92' ' ' PHE . 6.3 Cg_exo -64.54 130.17 25.82 Favored 'Trans proline' 0 C--N 1.32 -0.954 0 C-N-CA 121.075 1.183 . . . . 0.0 110.164 -178.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 79.4 p -167.38 130.5 1.73 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.409 -0.807 . . . . 0.0 109.295 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.43 ' O ' ' O ' ' A' ' 96' ' ' GLY . 38.3 ttm180 -58.18 -91.84 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.24 -0.912 . . . . 0.0 109.537 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.43 ' O ' ' O ' ' A' ' 95' ' ' ARG . . . 51.45 97.71 0.01 OUTLIER Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.616 -1.394 . . . . 0.0 109.616 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 31.6 p-10 -170.84 121.22 0.56 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.217 -1.167 . . . . 0.0 109.605 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.493 ' CD1' ' N ' ' A' ' 98' ' ' LEU . 8.7 mp 50.07 70.38 0.51 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.178 -0.951 . . . . 0.0 109.353 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -158.5 121.28 3.74 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.233 -0.917 . . . . 0.0 109.466 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 -57.77 128.82 39.01 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.246 -0.909 . . . . 0.0 109.428 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -61.92 -17.26 56.16 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.181 -0.95 . . . . 0.0 109.494 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -70.32 143.97 51.85 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.17 -0.956 . . . . 0.0 108.915 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -60.72 -48.78 80.24 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.162 -0.961 . . . . 0.0 109.782 -179.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -168.54 110.15 0.54 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.221 -0.924 . . . . 0.0 109.425 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -169.34 71.3 0.07 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.262 -0.899 . . . . 0.0 109.312 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -68.04 -89.2 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.208 -0.933 . . . . 0.0 109.414 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -168.7 -140.7 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.245 -0.91 . . . . 0.0 109.413 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 22.4 p30 -171.71 63.91 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.119 -0.988 . . . . 0.0 109.5 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -66.43 -50.58 62.93 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.256 -0.902 . . . . 0.0 109.429 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -82.48 105.02 13.19 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.215 -0.928 . . . . 0.0 109.481 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 40.8 m -77.36 109.46 11.29 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.198 -0.939 . . . . 0.0 109.469 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.575 ' CG ' HH11 ' A' ' 112' ' ' ARG . 4.0 mtt-85 -72.92 111.57 8.16 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.233 -0.917 . . . . 0.0 109.492 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 95.2 p -67.46 102.16 1.09 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.264 -0.897 . . . . 0.0 109.486 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.525 ' O ' ' CG ' ' A' ' 115' ' ' HIS . 29.6 t -171.76 124.64 0.56 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.269 -0.894 . . . . 0.0 109.45 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . 0.525 ' CG ' ' O ' ' A' ' 114' ' ' SER . 88.8 m-70 -158.2 161.7 37.84 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.224 -0.923 . . . . 0.0 109.445 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -63.42 124.19 20.67 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.277 -0.89 . . . . 0.0 109.411 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -67.38 -28.42 67.92 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.219 -0.925 . . . . 0.0 109.539 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -62.19 -175.83 0.08 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.273 -0.892 . . . . 0.0 109.433 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.423 ' O ' ' N ' ' A' ' 121' ' ' THR . . . 71.7 3.07 53.67 Favored Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 50.35 -96.66 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.289 -1.124 . . . . 0.0 109.401 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.423 ' N ' ' O ' ' A' ' 119' ' ' GLY . 5.4 m 58.39 162.4 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.318 -0.864 . . . . 0.0 109.644 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 64.93 112.11 0.01 OUTLIER Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.678 -1.369 . . . . 0.0 109.678 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 14.8 mt -70.35 135.65 49.01 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.298 -1.119 . . . . 0.0 109.18 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -77.0 151.73 82.05 Favored Pre-proline 0 N--CA 1.49 1.534 0 O-C-N 121.109 -0.994 . . . . 0.0 108.985 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -59.85 -9.29 9.32 Favored 'Trans proline' 0 C--N 1.323 -0.798 0 C-N-CA 121.012 1.142 . . . . 0.0 109.675 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -49.17 165.01 0.06 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.238 -0.914 . . . . 0.0 109.841 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 36.8 p90 -171.93 165.29 6.38 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.496 -0.753 . . . . 0.0 109.511 179.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.37 100.21 1.32 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.261 -0.899 . . . . 0.0 109.438 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -77.82 147.91 34.99 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.294 -0.879 . . . . 0.0 109.396 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.496 ' CD1' ' N ' ' A' ' 130' ' ' LEU . 8.4 mp -64.81 -5.43 5.92 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.298 -0.876 . . . . 0.0 109.266 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -173.22 130.71 1.93 Allowed Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.611 -1.395 . . . . 0.0 109.611 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -63.13 162.39 11.8 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.295 -1.121 . . . . 0.0 109.419 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' SER . . . . . 0.463 ' C ' ' H ' ' A' ' 135' ' ' SER . 31.4 t -170.63 153.01 3.99 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.168 -0.957 . . . . 0.0 109.473 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . 0.42 ' N ' ' HG ' ' A' ' 133' ' ' SER . . . 67.1 -3.41 4.19 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' SER . . . . . 0.463 ' H ' ' C ' ' A' ' 133' ' ' SER . 48.9 m -67.11 147.16 53.48 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.198 -1.178 . . . . 0.0 109.371 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 50.9 m -65.46 118.79 9.93 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.128 -0.982 . . . . 0.0 109.45 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 69.0 m -166.05 73.36 0.17 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.321 -0.862 . . . . 0.0 109.432 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 87.4 p -70.62 69.61 0.43 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.313 -0.867 . . . . 0.0 109.494 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 67.7 mmtt -68.66 99.23 0.97 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.223 -0.923 . . . . 0.0 109.318 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 74.6 p -68.31 -177.51 0.91 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.261 -0.9 . . . . 0.0 109.402 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 74.9 m -166.32 49.87 0.08 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.245 -0.909 . . . . 0.0 109.446 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 2.3 t -60.04 163.4 4.79 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.25 -0.906 . . . . 0.0 109.443 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 56.5 t-80 -66.49 99.24 0.55 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.221 -0.924 . . . . 0.0 109.465 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 43.5 t -65.48 114.43 4.86 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.291 -0.881 . . . . 0.0 109.492 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -65.79 137.8 57.49 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.214 -0.929 . . . . 0.0 109.455 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 53.18 86.5 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.258 -0.901 . . . . 0.0 109.452 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 44.3 p90 -61.12 164.64 4.97 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.137 -0.977 . . . . 0.0 109.473 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 43.1 t -148.2 116.36 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.289 -0.882 . . . . 0.0 109.284 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' SER . . . . . 0.449 ' O ' ' N ' ' A' ' 151' ' ' SER . 30.3 t -170.04 150.66 3.82 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.256 -0.902 . . . . 0.0 109.44 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 48.2 t -66.05 74.0 0.08 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.268 -0.895 . . . . 0.0 109.498 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' SER . . . . . 0.449 ' N ' ' O ' ' A' ' 149' ' ' SER . 67.4 m -165.95 64.16 0.11 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.269 -0.894 . . . . 0.0 109.514 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' THR . . . . . 0.427 ' O ' ' OG1' ' A' ' 153' ' ' THR . 62.5 p -75.26 -13.99 60.48 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.18 -0.95 . . . . 0.0 109.414 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' THR . . . . . 0.427 ' OG1' ' O ' ' A' ' 152' ' ' THR . 30.5 p 49.22 85.47 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.156 -0.965 . . . . 0.0 109.52 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 30.4 t -66.01 -12.27 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.281 -0.887 . . . . 0.0 109.425 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -157.44 127.0 6.04 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.284 -0.885 . . . . 0.0 109.329 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -65.05 -75.29 0.09 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.166 -0.959 . . . . 0.0 109.371 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 172.26 16.68 0.02 OUTLIER Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -171.71 -83.78 0.06 OUTLIER Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.606 -1.397 . . . . 0.0 109.606 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' SER . . . . . 0.532 ' O ' ' N ' ' A' ' 161' ' ' ILE . 9.4 m 52.84 53.16 12.56 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.303 -1.116 . . . . 0.0 109.407 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . 0.447 ' O ' ' O ' ' A' ' 161' ' ' ILE . . . -57.29 82.08 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.394 -0.816 . . . . 0.0 109.881 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . 0.532 ' N ' ' O ' ' A' ' 159' ' ' SER . 77.9 mt -42.66 167.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.58 -0.7 . . . . 0.0 110.251 -179.581 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.43 ' N ' ' CG2' ' A' ' 161' ' ' ILE . 66.0 mt-10 -149.81 126.56 11.04 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.229 -0.919 . . . . 0.0 109.435 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 94.2 p -69.97 142.73 52.81 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.268 -0.895 . . . . 0.0 109.456 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 17.2 ttmm -68.56 -38.46 80.77 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.28 -0.887 . . . . 0.0 109.403 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . 0.601 ' ND1' ' N ' ' A' ' 166' ' ' PHE . 50.1 t-80 51.37 -102.59 0.12 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.242 -0.911 . . . . 0.0 109.399 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' PHE . . . . . 0.601 ' N ' ' ND1' ' A' ' 165' ' ' HIS . 51.7 p90 . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 118.003 -0.999 . . . . 0.0 109.409 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.412 ' H1 ' ' H ' ' A' ' 2' ' ' GLY . 68.5 mtp . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.499 ' C ' ' H ' ' A' ' 4' ' ' PHE . . . -179.44 161.65 27.83 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 72.0 p -76.04 27.38 0.12 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.232 -1.158 . . . . 0.0 109.41 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.499 ' H ' ' C ' ' A' ' 2' ' ' GLY . 62.2 t80 -75.45 104.17 5.9 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.228 -0.92 . . . . 0.0 109.46 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -167.87 152.31 6.52 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.209 -0.932 . . . . 0.0 109.488 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -90.79 84.5 5.84 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.322 -0.861 . . . . 0.0 109.342 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -67.32 -76.45 0.08 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.18 -0.95 . . . . 0.0 109.457 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 159.62 167.01 19.66 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.405 ' O ' ' N ' ' A' ' 11' ' ' SER . 78.0 p -171.71 -6.95 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.257 -1.143 . . . . 0.0 109.492 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 15.6 m -69.8 51.98 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.236 -0.915 . . . . 0.0 109.419 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.405 ' N ' ' O ' ' A' ' 9' ' ' SER . 92.1 p -166.04 -157.5 0.3 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.193 -0.942 . . . . 0.0 109.47 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.2 t -168.32 -63.64 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.224 -0.922 . . . . 0.0 109.469 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -171.92 151.41 14.89 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 49.4 m -57.33 -18.99 19.7 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.274 -1.133 . . . . 0.0 109.514 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 20.9 pttp -55.55 147.7 17.37 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.308 -0.87 . . . . 0.0 109.485 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 27.1 mm100 -63.32 152.49 37.74 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.271 -0.893 . . . . 0.0 109.469 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -72.53 -32.29 65.99 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.227 -0.921 . . . . 0.0 109.472 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.452 ' CD2' ' O ' ' A' ' 19' ' ' HIS . 81.0 t80 -169.35 137.04 1.82 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.3 -0.875 . . . . 0.0 109.435 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.452 ' O ' ' CD2' ' A' ' 18' ' ' PHE . 55.8 m80 -59.95 146.56 41.99 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.311 -0.868 . . . . 0.0 109.405 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.9 m 53.08 92.94 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.237 -0.914 . . . . 0.0 109.453 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 175.51 124.88 0.83 Allowed Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -152.26 147.07 25.93 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.197 -1.178 . . . . 0.0 109.528 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.9 tt 57.47 83.83 0.1 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.33 -0.856 . . . . 0.0 109.149 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.4 t -149.85 90.94 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.144 -0.972 . . . . 0.0 109.271 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.8 t -56.9 159.84 3.86 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.29 -0.881 . . . . 0.0 109.434 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 50.8 m -163.5 -12.53 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.204 -0.935 . . . . 0.0 109.481 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.419 ' O ' ' N ' ' A' ' 29' ' ' ASP . 24.6 mtpp -51.21 123.12 8.83 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.215 -0.928 . . . . 0.0 109.545 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -68.71 68.77 0.42 Allowed Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 27' ' ' LYS . 2.0 p30 -79.85 -163.95 0.6 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.308 -1.113 . . . . 0.0 109.45 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.423 ' O ' ' OE2' ' A' ' 31' ' ' GLU . 60.5 tttp -170.46 76.87 0.08 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.31 -0.869 . . . . 0.0 109.439 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.423 ' OE2' ' O ' ' A' ' 30' ' ' LYS . 57.8 mm-40 -137.93 -41.65 0.53 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.409 -0.807 . . . . 0.0 109.206 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.5 ' CD1' ' N ' ' A' ' 32' ' ' LEU . 8.4 mp -75.79 -24.41 55.96 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.277 -0.89 . . . . 0.0 109.346 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.504 ' CD1' ' N ' ' A' ' 33' ' ' LEU . 8.4 mp -84.93 85.39 7.48 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.209 -0.932 . . . . 0.0 109.115 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 19.8 pt -75.2 155.66 6.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.241 -0.912 . . . . 0.0 109.524 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.476 ' O ' ' ND2' ' A' ' 36' ' ' ASN . 17.1 p-10 -159.7 65.35 0.37 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.228 -0.92 . . . . 0.0 109.485 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.476 ' ND2' ' O ' ' A' ' 35' ' ' ASP . 32.9 m120 -157.95 -83.79 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.275 -0.89 . . . . 0.0 109.42 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.434 ' O ' ' O ' ' A' ' 38' ' ' LYS . 24.5 tt0 59.92 19.56 8.57 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.343 -0.848 . . . . 0.0 109.36 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.434 ' O ' ' O ' ' A' ' 37' ' ' GLU . 69.6 mttt 58.38 113.7 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.288 -0.882 . . . . 0.0 109.742 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 26.8 m -53.51 176.43 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.238 -0.914 . . . . 0.0 109.446 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 53.8 m -69.4 165.42 20.84 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.26 -0.9 . . . . 0.0 109.42 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 51.6 m -157.33 -51.9 0.07 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.213 -0.93 . . . . 0.0 109.382 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 179.17 68.08 0.07 OUTLIER Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.421 ' O ' ' OG1' ' A' ' 44' ' ' THR . 59.3 t-80 -74.66 81.53 2.04 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.252 -1.146 . . . . 0.0 109.508 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.421 ' OG1' ' O ' ' A' ' 43' ' ' HIS . 14.6 p 51.37 -167.93 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.18 -0.95 . . . . 0.0 109.488 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 77.4 p -68.93 99.64 1.09 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.259 -0.9 . . . . 0.0 109.428 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 57.4 p -65.98 -124.58 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.148 -0.97 . . . . 0.0 109.505 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 67.3 p -101.27 57.52 0.86 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.372 -0.83 . . . . 0.0 109.447 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -146.07 142.79 28.9 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.181 -0.949 . . . . 0.0 109.495 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.4 ' C ' ' HG ' ' A' ' 50' ' ' SER . 97.7 mtt180 -94.87 144.42 25.67 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.235 -0.916 . . . . 0.0 109.654 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.4 ' HG ' ' C ' ' A' ' 49' ' ' ARG . 1.2 m 67.86 169.78 0.27 Allowed 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.472 -0.767 . . . . 0.0 110.194 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.444 ' O ' ' O ' ' A' ' 52' ' ' SER . 1.6 m -56.91 -65.15 0.66 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.267 -0.895 . . . . 0.0 109.431 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.668 ' HG ' ' N ' ' A' ' 75' ' ' SER . 12.7 t -58.64 -157.37 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.553 ' N ' ' OG ' ' A' ' 52' ' ' SER . 89.2 tttt -122.42 100.47 6.96 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.145 -0.972 . . . . 0.0 108.612 179.02 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.421 ' O ' ' CG1' ' A' ' 54' ' ' VAL . 11.3 p -126.65 120.37 55.92 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.709 -0.619 . . . . 0.0 109.58 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 2.3 pt -126.4 134.15 67.06 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.53 -0.731 . . . . 0.0 109.037 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 46.8 p -132.42 114.51 14.43 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.404 -0.81 . . . . 0.0 109.384 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.445 ' H ' ' HB ' ' A' ' 69' ' ' THR . 22.1 mttt -121.47 113.06 19.3 Favored 'General case' 0 N--CA 1.513 2.686 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 29.7 p -119.76 138.29 53.42 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.638 -0.664 . . . . 0.0 109.934 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.9 m -131.47 125.69 56.93 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.135 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 48.7 p -107.77 110.39 22.19 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.7 -0.625 . . . . 0.0 110.373 -179.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.44 ' ND2' ' N ' ' A' ' 61' ' ' ASN . 1.0 OUTLIER -100.24 144.08 29.68 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.354 -0.841 . . . . 0.0 108.769 179.395 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.484 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -67.03 -32.64 73.99 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 120.047 -1.658 . . . . 0.0 112.908 -177.425 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -65.74 4.28 0.63 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.291 -1.505 . . . . 0.0 110.006 -178.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.484 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 95.64 6.47 59.56 Favored Glycine 0 N--CA 1.496 2.693 0 N-CA-C 110.778 -0.929 . . . . 0.0 110.778 178.405 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 60.1 ttt180 -92.94 112.31 24.23 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.677 -1.484 . . . . 0.0 107.794 178.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.5 p -138.73 113.89 9.44 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.227 -0.921 . . . . 0.0 109.769 -178.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -99.83 130.23 46.0 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.319 -0.863 . . . . 0.0 109.993 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -107.07 108.93 20.66 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.586 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.515 ' O ' ' N ' ' A' ' 71' ' ' GLU . 4.5 m -96.31 28.7 3.14 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 107.531 -1.285 . . . . 0.0 107.531 179.087 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.1 pttp -64.81 67.74 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.515 ' N ' ' O ' ' A' ' 69' ' ' THR . 50.8 mt-10 -104.26 157.09 17.37 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.312 -0.868 . . . . 0.0 110.046 -179.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.4 p -128.16 125.42 64.34 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.437 ' O ' ' O ' ' A' ' 53' ' ' LYS . 79.0 t -107.19 135.44 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 CA-C-O 121.922 0.868 . . . . 0.0 109.434 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 65.1 tttt 69.9 -137.27 0.06 Allowed 'General case' 0 N--CA 1.505 2.301 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.399 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.668 ' N ' ' HG ' ' A' ' 52' ' ' SER . 2.7 t 52.28 71.36 0.47 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.284 -0.885 . . . . 0.0 109.28 -179.744 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 62.5 mm-40 -121.06 18.02 11.65 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.58 -0.7 . . . . 0.0 109.201 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -171.22 29.04 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.257 -0.902 . . . . 0.0 109.437 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.549 ' O ' ' N ' ' A' ' 80' ' ' ASP . . . -150.47 -42.25 0.03 OUTLIER Glycine 0 N--CA 1.492 2.43 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 70.8 m 51.67 -89.48 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.38 -1.071 . . . . 0.0 108.899 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.549 ' N ' ' O ' ' A' ' 78' ' ' GLY . 59.6 t0 -83.68 42.73 0.86 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.294 -0.879 . . . . 0.0 109.085 179.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.543 ' C ' ' H ' ' A' ' 83' ' ' ASP . 6.8 m 50.1 60.89 3.5 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.138 -0.976 . . . . 0.0 108.845 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 49.8 8.06 0.12 Allowed Glycine 0 N--CA 1.49 2.291 0 N-CA-C 110.131 -1.188 . . . . 0.0 110.131 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.543 ' H ' ' C ' ' A' ' 81' ' ' CYS . 8.3 m-20 -105.97 -156.92 0.59 Allowed 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.213 -1.169 . . . . 0.0 109.435 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -171.13 -156.39 0.12 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.371 -0.83 . . . . 0.0 109.31 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -169.43 126.55 0.92 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.306 -0.871 . . . . 0.0 109.455 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 66.9 t80 52.28 92.72 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.27 -0.894 . . . . 0.0 109.399 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -51.34 143.42 11.52 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.248 -0.908 . . . . 0.0 109.513 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 6.2 m-90 -58.9 -56.41 22.64 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.196 -0.94 . . . . 0.0 109.467 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.605 ' CG ' ' H ' ' A' ' 90' ' ' HIS . 54.9 t-80 -58.54 179.12 0.09 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.297 -0.877 . . . . 0.0 109.345 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.605 ' H ' ' CG ' ' A' ' 89' ' ' HIS . 2.1 p80 -166.64 143.93 4.97 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.205 -0.934 . . . . 0.0 109.636 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.658 ' HG1' ' H ' ' A' ' 92' ' ' PHE . 82.7 p -48.59 -84.23 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.251 -0.906 . . . . 0.0 109.505 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.658 ' H ' ' HG1' ' A' ' 91' ' ' THR . 84.6 t80 51.43 68.12 3.58 Favored Pre-proline 0 N--CA 1.491 1.594 0 O-C-N 121.239 -0.913 . . . . 0.0 109.607 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -62.14 146.18 96.14 Favored 'Trans proline' 0 C--N 1.317 -1.121 0 C-N-CA 121.429 1.42 . . . . 0.0 109.805 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 31.0 t -172.26 67.96 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.267 -0.896 . . . . 0.0 109.409 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 20.9 tpt180 -61.18 -19.79 61.99 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.338 -0.851 . . . . 0.0 109.289 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.464 ' O ' ' N ' ' A' ' 98' ' ' LEU . . . -165.05 -59.29 0.02 OUTLIER Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.584 -1.407 . . . . 0.0 109.584 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.538 ' N ' HD21 ' A' ' 97' ' ' ASN . 1.5 m120 51.01 -93.91 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.267 -1.137 . . . . 0.0 109.509 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.464 ' N ' ' O ' ' A' ' 96' ' ' GLY . 55.5 tp -63.82 78.69 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.256 -0.903 . . . . 0.0 109.286 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.469 ' N ' ' O ' ' A' ' 97' ' ' ASN . 22.5 m-20 -74.85 53.72 0.6 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.301 -0.874 . . . . 0.0 109.45 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -78.74 -3.67 45.46 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.301 -0.874 . . . . 0.0 109.352 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.419 ' O ' ' N ' ' A' ' 103' ' ' HIS . 57.0 t80 -66.36 -55.72 14.55 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.279 -0.888 . . . . 0.0 109.525 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -59.03 88.91 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.174 -0.954 . . . . 0.0 109.432 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.465 ' ND1' ' O ' ' A' ' 103' ' ' HIS . 0.8 OUTLIER -71.22 -26.09 62.78 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.162 -0.961 . . . . 0.0 109.284 179.981 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.416 ' O ' ' O ' ' A' ' 103' ' ' HIS . 44.3 mtp180 50.99 -178.96 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.304 -0.872 . . . . 0.0 109.495 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -157.98 4.63 0.12 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.289 -0.882 . . . . 0.0 109.384 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.468 ' C ' ' H ' ' A' ' 108' ' ' ASP . 58.8 mttp -59.53 -21.43 60.21 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.26 -0.9 . . . . 0.0 109.472 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -66.65 3.17 1.07 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.234 -0.916 . . . . 0.0 109.438 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.468 ' H ' ' C ' ' A' ' 106' ' ' LYS . 15.2 t70 -64.32 125.87 25.97 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.168 -0.957 . . . . 0.0 109.491 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -74.28 0.71 13.4 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.26 -0.9 . . . . 0.0 109.496 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . 0.467 ' N ' ' OD1' ' A' ' 108' ' ' ASP . 75.6 t80 51.57 91.57 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.235 -0.915 . . . . 0.0 109.431 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 67.1 p -72.84 165.56 24.66 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.216 -0.928 . . . . 0.0 109.502 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.568 ' CG ' HH11 ' A' ' 112' ' ' ARG . 0.0 OUTLIER -169.38 138.77 2.04 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.274 -0.891 . . . . 0.0 109.506 -179.995 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 61.2 p -168.69 81.22 0.15 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.296 -0.877 . . . . 0.0 109.505 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 50.7 m -62.09 162.28 9.67 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.242 -0.911 . . . . 0.0 109.384 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 25.1 m-70 -60.19 108.87 0.85 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.253 -0.904 . . . . 0.0 109.434 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -56.36 -58.74 6.73 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.319 -0.863 . . . . 0.0 109.43 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -61.15 -74.22 0.08 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.232 -0.918 . . . . 0.0 109.521 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.455 ' OD1' ' N ' ' A' ' 118' ' ' ASP . 1.5 m-20 -72.52 -137.51 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.182 -0.949 . . . . 0.0 109.485 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 69.49 138.9 0.11 Allowed Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -71.53 -179.51 2.57 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.237 -1.155 . . . . 0.0 109.461 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.424 ' O ' ' N ' ' A' ' 123' ' ' LEU . 71.4 p -73.98 2.48 8.6 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.279 -0.888 . . . . 0.0 109.571 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 61.49 -85.57 0.03 OUTLIER Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.384 -1.486 . . . . 0.0 109.384 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.424 ' N ' ' O ' ' A' ' 121' ' ' THR . 24.7 mt -64.03 143.09 58.13 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.187 -1.184 . . . . 0.0 109.076 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.528 ' C ' ' H ' ' A' ' 126' ' ' GLU . . . -81.14 163.0 57.29 Favored Pre-proline 0 N--CA 1.492 1.626 0 O-C-N 121.17 -0.956 . . . . 0.0 108.87 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -58.28 1.67 0.24 Allowed 'Trans proline' 0 C--N 1.319 -0.986 0 C-N-CA 121.414 1.409 . . . . 0.0 110.203 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.532 ' O ' ' CG ' ' A' ' 127' ' ' PHE . 74.4 mt-10 52.4 -100.56 0.1 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.183 -0.948 . . . . 0.0 109.489 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . 0.532 ' CG ' ' O ' ' A' ' 126' ' ' GLU . 97.4 m-85 -157.9 75.47 0.76 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.199 -0.938 . . . . 0.0 109.347 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -168.67 -156.99 0.18 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.241 -0.912 . . . . 0.0 109.511 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -167.96 -11.89 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.298 -0.876 . . . . 0.0 109.399 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 10.8 tp 53.41 95.48 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.187 -0.945 . . . . 0.0 109.381 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -177.11 -45.53 0.06 OUTLIER Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 53.92 67.76 0.96 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.228 -1.16 . . . . 0.0 109.453 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 40.0 t -70.81 166.17 21.59 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.2 -0.937 . . . . 0.0 109.538 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 64.14 89.08 0.04 OUTLIER Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.566 -1.413 . . . . 0.0 109.566 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' SER . . . . . 0.412 ' OG ' ' N ' ' A' ' 136' ' ' SER . 41.2 t -68.16 -149.89 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.302 -1.116 . . . . 0.0 109.444 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' SER . . . . . 0.427 ' O ' ' N ' ' A' ' 138' ' ' SER . 87.7 p -169.66 -28.82 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.236 -0.915 . . . . 0.0 109.508 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 51.8 m -68.71 68.76 0.15 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.263 -0.898 . . . . 0.0 109.476 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' SER . . . . . 0.427 ' N ' ' O ' ' A' ' 136' ' ' SER . 72.9 m -166.47 -99.54 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.299 -0.876 . . . . 0.0 109.477 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -170.35 142.77 2.22 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.266 -0.896 . . . . 0.0 109.496 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 13.4 m -165.35 63.13 0.12 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.205 -0.934 . . . . 0.0 109.401 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 48.2 t -76.55 -28.22 56.2 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.237 -0.914 . . . . 0.0 109.536 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 1.4 t -170.12 158.41 6.93 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.242 -0.911 . . . . 0.0 109.376 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 75.8 m80 -65.92 -33.03 74.89 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.287 -0.883 . . . . 0.0 109.482 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 45.0 t -62.06 146.28 50.77 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.203 -0.935 . . . . 0.0 109.468 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -170.38 -13.39 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.257 -0.902 . . . . 0.0 109.418 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -67.95 78.78 0.22 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.254 -0.904 . . . . 0.0 109.431 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . 0.476 ' CD1' ' O ' ' A' ' 147' ' ' PHE . 40.6 p90 -73.32 134.37 44.13 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.328 -0.858 . . . . 0.0 109.427 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 33.2 t -76.17 138.99 19.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.256 -0.903 . . . . 0.0 109.494 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 26.1 t -172.4 22.59 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.263 -0.898 . . . . 0.0 109.413 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 49.9 m -71.18 -58.78 3.22 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.307 -0.87 . . . . 0.0 109.465 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 48.3 t -64.12 134.92 55.81 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.216 -0.927 . . . . 0.0 109.501 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 47.1 p -69.67 -145.54 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.181 -0.95 . . . . 0.0 109.488 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 61.3 p -98.74 -141.68 0.31 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.293 -0.879 . . . . 0.0 109.15 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 23.0 t -65.91 -63.39 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.25 -0.907 . . . . 0.0 109.261 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 2.0 m120 56.2 -114.36 0.84 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.423 -0.798 . . . . 0.0 109.462 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -74.91 -103.35 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.13 -0.981 . . . . 0.0 109.446 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -172.01 -93.59 0.09 OUTLIER Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -169.82 85.52 0.09 OUTLIER Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 44.9 t 50.88 -104.22 0.16 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.321 -1.105 . . . . 0.0 109.498 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . 53.29 53.14 12.25 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.283 -0.886 . . . . 0.0 109.426 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 6.8 tp -72.12 -35.32 52.92 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.268 -0.895 . . . . 0.0 109.248 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.404 ' O ' ' OG ' ' A' ' 163' ' ' SER . 65.1 mm-40 51.7 76.58 0.17 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.285 -0.884 . . . . 0.0 109.447 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.404 ' OG ' ' O ' ' A' ' 162' ' ' GLU . 52.0 m -165.69 113.1 0.94 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.26 -0.9 . . . . 0.0 109.397 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 15.3 tptp -69.1 -46.38 67.85 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.218 -0.926 . . . . 0.0 109.388 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . 0.524 ' O ' ' CG ' ' A' ' 166' ' ' PHE . 3.5 m-70 -62.7 -80.0 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.247 -0.908 . . . . 0.0 109.509 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' PHE . . . . . 0.524 ' CG ' ' O ' ' A' ' 165' ' ' HIS . 97.8 m-85 . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 118.034 -0.984 . . . . 0.0 109.397 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.7 mtt . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.424 ' O ' ' O ' ' A' ' 3' ' ' THR . . . 178.42 -135.71 2.73 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.424 ' O ' ' O ' ' A' ' 2' ' ' GLY . 11.9 m 55.29 103.47 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.249 -1.148 . . . . 0.0 109.53 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -158.33 -4.74 0.08 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.278 -0.889 . . . . 0.0 109.518 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 27.3 ttm-85 -65.75 -19.31 65.85 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.338 -0.851 . . . . 0.0 109.415 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -74.46 79.34 1.92 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.313 -0.867 . . . . 0.0 109.372 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -59.92 -38.62 82.85 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.258 -0.901 . . . . 0.0 109.462 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 64.69 53.49 34.52 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.6 t -171.28 146.4 2.33 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.258 -1.142 . . . . 0.0 109.474 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.8 p -168.62 136.49 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.301 -0.875 . . . . 0.0 109.48 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 43.6 t -77.54 133.15 38.58 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.197 -0.939 . . . . 0.0 109.473 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.3 t -71.64 -8.02 51.45 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.24 -0.912 . . . . 0.0 109.46 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 69.08 17.84 72.28 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.445 -1.462 . . . . 0.0 109.445 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.9 t -66.42 -177.13 0.51 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.244 -1.151 . . . . 0.0 109.406 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 77.5 tttt 56.37 -124.38 1.89 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.192 -0.943 . . . . 0.0 109.262 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 51.4 52.6 14.43 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.086 -1.009 . . . . 0.0 109.436 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.427 ' O ' ' O ' ' A' ' 18' ' ' PHE . 72.2 mm-40 -72.06 -27.77 62.9 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.283 -0.885 . . . . 0.0 109.565 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.427 ' O ' ' O ' ' A' ' 17' ' ' GLU . 40.8 t80 59.33 150.01 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.556 -0.715 . . . . 0.0 109.739 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 51.8 m80 -78.83 163.92 24.92 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.275 -0.89 . . . . 0.0 109.51 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 6.3 t -73.32 -11.12 60.38 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.225 -0.922 . . . . 0.0 109.427 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -170.15 173.89 44.2 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -70.91 153.6 42.55 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.231 -1.158 . . . . 0.0 109.46 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 18.0 mt -140.35 -172.25 3.39 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.391 -0.818 . . . . 0.0 109.156 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 34.6 t -64.19 101.94 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.269 -0.894 . . . . 0.0 109.481 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 37.8 m -165.33 111.02 0.91 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.253 -0.904 . . . . 0.0 109.52 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.461 ' C ' ' H ' ' A' ' 28' ' ' GLY . 76.9 p -81.11 116.54 21.08 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.27 -0.894 . . . . 0.0 109.389 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -75.43 36.6 0.13 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.333 -0.854 . . . . 0.0 109.636 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.496 ' C ' ' H ' ' A' ' 30' ' ' LYS . . . 76.89 150.92 3.85 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.537 -1.425 . . . . 0.0 109.537 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.27 28.35 0.12 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.177 -1.19 . . . . 0.0 109.457 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.496 ' H ' ' C ' ' A' ' 28' ' ' GLY . 96.1 mttt -62.26 127.22 30.34 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.287 -0.883 . . . . 0.0 109.403 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -167.59 -153.16 0.13 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.195 -0.941 . . . . 0.0 109.095 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.427 ' O ' ' O ' ' A' ' 33' ' ' LEU . 11.0 mp -86.21 8.67 20.22 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.093 -1.004 . . . . 0.0 109.168 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.48 ' CD1' ' N ' ' A' ' 33' ' ' LEU . 8.8 mp 52.07 99.86 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.269 -0.894 . . . . 0.0 109.376 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.426 ' O ' ' O ' ' A' ' 33' ' ' LEU . 20.3 pt -51.8 -178.46 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.193 -0.942 . . . . 0.0 109.424 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -157.33 -9.92 0.09 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.253 -0.904 . . . . 0.0 109.47 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.687 HD21 ' H ' ' A' ' 37' ' ' GLU . 0.0 OUTLIER -58.29 -18.82 29.68 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.218 -0.926 . . . . 0.0 109.426 -179.955 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.687 ' H ' HD21 ' A' ' 36' ' ' ASN . 18.2 tp10 49.01 65.13 1.46 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.302 -0.874 . . . . 0.0 109.603 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 59.9 mttm -75.0 162.43 28.58 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.227 -0.921 . . . . 0.0 109.453 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 30.2 m -58.94 139.17 19.03 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.154 -0.966 . . . . 0.0 109.505 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 4.6 m -69.46 -126.58 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.222 -0.924 . . . . 0.0 109.284 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 42.3 t -62.18 173.0 1.24 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.124 -0.985 . . . . 0.0 109.397 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -179.83 -17.14 0.03 OUTLIER Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.447 ' CG ' ' O ' ' A' ' 43' ' ' HIS . 26.6 p-80 -171.08 102.59 0.21 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.235 -1.156 . . . . 0.0 109.509 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 58.5 m -154.79 129.66 9.4 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.289 -0.882 . . . . 0.0 109.388 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 26.6 m 52.5 87.72 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.206 -0.934 . . . . 0.0 109.401 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 82.1 p -149.54 72.69 1.15 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.271 -0.893 . . . . 0.0 109.336 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 50.5 p -81.78 110.83 17.46 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.232 -0.917 . . . . 0.0 109.358 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 79.2 mtt180 -142.67 142.53 32.06 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.31 -0.869 . . . . 0.0 109.345 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -89.69 138.69 31.26 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.338 -0.851 . . . . 0.0 109.831 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.3 m 57.97 174.22 0.06 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.364 -0.835 . . . . 0.0 109.969 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 39.1 t -59.53 -75.4 0.06 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.347 -0.845 . . . . 0.0 109.511 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 3.0 t -47.17 141.12 4.66 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.204 -0.935 . . . . 0.0 109.191 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -73.92 103.51 4.46 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 120.998 -1.064 . . . . 0.0 109.599 -179.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.438 ' CG1' ' O ' ' A' ' 54' ' ' VAL . 10.7 p -126.57 118.08 49.99 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.776 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.401 ' O ' ' CG2' ' A' ' 55' ' ' ILE . 6.6 tt -126.99 122.45 60.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.531 -0.731 . . . . 0.0 109.125 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 17.9 m -129.21 111.86 13.33 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.437 -0.789 . . . . 0.0 109.671 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.412 ' H ' ' HB ' ' A' ' 69' ' ' THR . 31.1 mmtt -126.03 113.35 17.0 Favored 'General case' 0 N--CA 1.515 2.775 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 178.065 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 96.6 m -110.3 125.03 52.72 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.533 -0.729 . . . . 0.0 109.489 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.4 m -132.49 119.98 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.3 m -109.52 133.68 52.8 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.713 -0.617 . . . . 0.0 109.842 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -125.24 159.01 32.65 Favored 'General case' 0 N--CA 1.516 2.861 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.88 -33.96 68.78 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 120.538 -1.351 . . . . 0.0 112.477 -177.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.508 ' OD2' ' NH2' ' A' ' 65' ' ' ARG . 11.6 p30 -70.69 2.34 4.25 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.445 -1.409 . . . . 0.0 110.411 -178.417 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 98.32 1.07 58.09 Favored Glycine 0 N--CA 1.494 2.525 0 N-CA-C 109.629 -1.388 . . . . 0.0 109.629 179.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.508 ' NH2' ' OD2' ' A' ' 63' ' ' ASP . 1.3 mpp_? -76.8 85.55 3.4 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 178.543 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 93.4 m -122.18 93.35 3.96 Favored 'General case' 0 N--CA 1.492 1.665 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 -178.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -100.0 129.78 46.1 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.427 -0.796 . . . . 0.0 109.909 -179.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.416 ' C ' ' H ' ' A' ' 70' ' ' LYS . 40.1 p -106.04 109.76 21.81 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.413 -0.804 . . . . 0.0 109.609 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.488 ' O ' ' N ' ' A' ' 71' ' ' GLU . 3.5 m -88.95 30.5 0.93 Allowed 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 178.706 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.416 ' H ' ' C ' ' A' ' 68' ' ' THR . 0.3 OUTLIER -66.75 58.12 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 109.02 -0.734 . . . . 0.0 109.02 179.623 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.488 ' N ' ' O ' ' A' ' 69' ' ' THR . 79.8 mt-10 -101.07 141.45 33.94 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.221 -0.925 . . . . 0.0 109.833 -179.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.7 p -128.17 131.53 69.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 179.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 15.7 t -129.87 116.05 36.13 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.942 0 CA-C-O 122.146 0.974 . . . . 0.0 109.418 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.593 ' HZ1' ' CB ' ' A' ' 74' ' ' LYS . 0.2 OUTLIER -66.39 174.72 2.55 Favored 'General case' 0 C--N 1.288 -2.067 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.42 180.0 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 75.8 m -64.91 -174.67 0.15 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.306 -0.871 . . . . 0.0 109.421 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -61.81 -62.98 1.42 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.275 -0.891 . . . . 0.0 109.306 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 18.3 p-10 -159.1 22.96 0.2 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.273 -0.892 . . . . 0.0 109.511 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 83.07 29.91 32.82 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.308 -1.517 . . . . 0.0 109.308 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 39.2 t -77.24 -25.0 51.12 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.317 -1.108 . . . . 0.0 109.388 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 44.5 m-20 -157.51 60.94 0.49 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.354 -0.841 . . . . 0.0 109.398 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 39.1 t -170.93 66.82 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.18 -0.95 . . . . 0.0 109.08 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 83.21 43.67 7.39 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.319 -1.513 . . . . 0.0 109.319 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.417 ' O ' ' OD1' ' A' ' 83' ' ' ASP . 19.6 p30 -66.3 81.34 0.09 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.281 -1.129 . . . . 0.0 109.535 -179.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -172.46 -174.04 1.13 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.295 -0.878 . . . . 0.0 109.435 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -59.47 141.07 55.57 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.312 -0.867 . . . . 0.0 109.34 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -168.83 -49.54 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.233 -0.917 . . . . 0.0 109.422 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 42.7 t0 52.49 -120.17 1.63 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.222 -0.924 . . . . 0.0 109.361 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . 0.411 ' C ' ' H ' ' A' ' 90' ' ' HIS . 64.1 t-105 53.71 55.25 8.74 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.175 -0.953 . . . . 0.0 109.453 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.524 ' C ' ' H ' ' A' ' 91' ' ' THR . 15.8 t-160 -72.92 46.39 0.16 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.22 -0.925 . . . . 0.0 109.44 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.448 ' ND1' ' O ' ' A' ' 90' ' ' HIS . 0.8 OUTLIER 56.7 2.32 0.1 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.372 -0.83 . . . . 0.0 109.741 -179.875 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.524 ' H ' ' C ' ' A' ' 89' ' ' HIS . 2.6 m -52.61 164.37 0.35 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.228 -0.92 . . . . 0.0 109.217 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.501 ' CD1' ' N ' ' A' ' 92' ' ' PHE . 10.4 p90 -150.6 70.09 8.79 Favored Pre-proline 0 N--CA 1.494 1.756 0 O-C-N 121.206 -0.934 . . . . 0.0 109.559 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -63.97 120.56 7.96 Favored 'Trans proline' 0 C--N 1.316 -1.132 0 C-N-CA 121.519 1.479 . . . . 0.0 109.85 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 30.9 t -171.86 18.59 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.209 -0.932 . . . . 0.0 109.599 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 31.8 ptt180 -72.02 136.92 46.86 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.168 -0.958 . . . . 0.0 109.406 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.502 ' C ' ' H ' ' A' ' 98' ' ' LEU . . . 162.46 34.04 0.02 OUTLIER Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.381 -1.488 . . . . 0.0 109.381 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.643 HD21 ' H ' ' A' ' 97' ' ' ASN . 0.8 OUTLIER -69.58 8.49 0.64 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.36 -1.082 . . . . 0.0 109.314 179.931 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.502 ' H ' ' C ' ' A' ' 96' ' ' GLY . 0.3 OUTLIER -68.13 114.22 6.45 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.389 -0.819 . . . . 0.0 109.177 -179.964 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.411 ' OD1' ' N ' ' A' ' 99' ' ' ASP . 0.8 OUTLIER -49.1 -68.27 0.19 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.238 -0.914 . . . . 0.0 109.489 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.425 ' N ' ' OD1' ' A' ' 100' ' ' ASP . 26.1 p-10 -165.11 126.82 2.08 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.242 -0.911 . . . . 0.0 109.485 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.548 ' CD2' ' N ' ' A' ' 102' ' ' PHE . 24.3 p90 -77.35 -47.53 19.67 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.284 -0.885 . . . . 0.0 109.505 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.548 ' N ' ' CD2' ' A' ' 101' ' ' PHE . 65.0 t80 48.76 73.7 0.21 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.253 -0.905 . . . . 0.0 109.569 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 37.4 m80 -74.26 -23.23 59.1 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.165 -0.959 . . . . 0.0 109.361 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.422 ' O ' ' CE2' ' A' ' 102' ' ' PHE . 67.6 ttt180 -61.04 155.2 20.8 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.289 -0.882 . . . . 0.0 109.49 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -166.56 79.24 0.23 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.288 -0.882 . . . . 0.0 109.392 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -72.4 98.31 2.22 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.285 -0.884 . . . . 0.0 109.453 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.469 ' N ' ' OD1' ' A' ' 107' ' ' ASP . 1.4 m-20 51.68 -128.31 2.37 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.242 -0.911 . . . . 0.0 109.462 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -157.18 138.55 13.8 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.255 -0.903 . . . . 0.0 109.36 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -73.47 -29.9 62.82 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.317 -0.864 . . . . 0.0 109.532 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -56.13 108.62 0.48 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.287 -0.883 . . . . 0.0 109.51 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 76.6 p -69.5 -10.27 57.38 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.252 -0.905 . . . . 0.0 109.425 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.57 ' CG ' HH11 ' A' ' 112' ' ' ARG . 0.3 OUTLIER -56.85 -37.47 71.31 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.205 -0.934 . . . . 0.0 109.458 179.984 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.408 ' O ' ' OG ' ' A' ' 114' ' ' SER . 65.2 m -71.79 164.01 26.77 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.284 -0.885 . . . . 0.0 109.455 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.408 ' OG ' ' O ' ' A' ' 113' ' ' SER . 26.1 p 52.32 61.87 2.98 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.216 -0.928 . . . . 0.0 109.497 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . 0.488 ' C ' ' H ' ' A' ' 117' ' ' PHE . 2.3 t60 -168.49 -38.4 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.275 -0.89 . . . . 0.0 109.459 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.519 ' O ' ' CG ' ' A' ' 117' ' ' PHE . 19.7 mm-40 -75.77 28.16 0.11 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.323 -0.861 . . . . 0.0 109.467 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.519 ' CG ' ' O ' ' A' ' 116' ' ' GLU . 97.2 m-85 -158.19 114.2 2.75 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.192 -0.943 . . . . 0.0 109.462 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -68.51 62.63 0.1 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.243 -0.911 . . . . 0.0 109.365 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.448 ' N ' ' O ' ' A' ' 117' ' ' PHE . . . -70.78 -160.35 3.44 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.449 -1.46 . . . . 0.0 109.449 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 37.8 ttp180 52.43 85.92 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.274 -1.133 . . . . 0.0 109.416 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 82.6 p -68.75 86.12 0.32 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.219 -0.926 . . . . 0.0 109.557 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -63.82 -112.42 0.01 OUTLIER Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.506 ' CD1' ' N ' ' A' ' 123' ' ' LEU . 8.1 mp -67.02 127.46 32.65 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.249 -1.148 . . . . 0.0 109.265 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -73.69 162.49 73.94 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.208 -0.933 . . . . 0.0 108.764 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -55.88 148.64 55.67 Favored 'Trans proline' 0 C--N 1.319 -0.989 0 C-N-CA 121.287 1.325 . . . . 0.0 109.707 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -139.9 110.22 6.6 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.303 -0.873 . . . . 0.0 109.421 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -135.92 110.77 8.75 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.42 -0.8 . . . . 0.0 109.389 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -71.28 95.41 1.3 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.268 -0.895 . . . . 0.0 109.367 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -68.02 117.68 10.2 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.228 -0.92 . . . . 0.0 109.534 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 13.5 mt 53.12 -160.37 0.12 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.314 -0.867 . . . . 0.0 109.587 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -176.09 164.48 34.49 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.589 -1.405 . . . . 0.0 109.589 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . 0.413 ' O ' ' OG ' ' A' ' 133' ' ' SER . 64.3 mm-40 -62.91 -55.46 25.79 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.216 -1.167 . . . . 0.0 109.492 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' SER . . . . . 0.413 ' OG ' ' O ' ' A' ' 132' ' ' GLU . 27.6 p 52.13 62.8 2.51 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.227 -0.92 . . . . 0.0 109.488 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -175.53 67.34 0.09 OUTLIER Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 41.6 t -65.86 104.9 1.17 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.279 -1.13 . . . . 0.0 109.437 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' SER . . . . . 0.488 ' C ' ' H ' ' A' ' 138' ' ' SER . 41.7 t -65.11 -30.11 71.03 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.267 -0.895 . . . . 0.0 109.413 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 94.0 p -75.66 22.15 0.14 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.229 -0.919 . . . . 0.0 109.433 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' SER . . . . . 0.488 ' H ' ' C ' ' A' ' 136' ' ' SER . 69.2 m -165.57 82.85 0.33 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.243 -0.911 . . . . 0.0 109.469 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -170.46 76.88 0.08 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.269 -0.894 . . . . 0.0 109.455 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 73.3 p -67.89 85.86 0.23 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.259 -0.901 . . . . 0.0 109.479 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' SER . . . . . 0.423 ' O ' ' O ' ' A' ' 142' ' ' THR . 41.1 t -68.29 -70.85 0.24 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.295 -0.878 . . . . 0.0 109.476 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' THR . . . . . 0.423 ' O ' ' O ' ' A' ' 141' ' ' SER . 6.0 m 57.5 162.0 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.339 -0.85 . . . . 0.0 109.513 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 25.2 p80 -170.23 21.12 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.279 -0.888 . . . . 0.0 109.464 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 49.2 m -72.53 -0.35 12.51 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.298 -0.876 . . . . 0.0 109.418 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 91.3 mttt 52.49 55.47 9.05 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.265 -0.897 . . . . 0.0 109.418 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -65.08 -31.27 72.39 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.276 -0.89 . . . . 0.0 109.434 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -65.47 133.79 52.03 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.322 -0.861 . . . . 0.0 109.505 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 8.6 p -170.03 150.34 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.299 -0.876 . . . . 0.0 109.414 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 31.4 t -171.43 -106.87 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.23 -0.919 . . . . 0.0 109.391 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 26.8 p 50.6 34.87 10.36 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.224 -0.922 . . . . 0.0 109.533 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 30.6 t -169.23 86.24 0.15 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.314 -0.866 . . . . 0.0 109.289 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 26.9 m -62.0 -54.71 37.73 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.294 -0.879 . . . . 0.0 109.458 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' THR . . . . . 0.507 ' OG1' ' N ' ' A' ' 154' ' ' VAL . 4.3 t -172.98 -140.34 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.272 -0.892 . . . . 0.0 109.512 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.507 ' N ' ' OG1' ' A' ' 153' ' ' THR . 11.5 m -145.53 161.01 12.44 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 O-C-N 121.303 -0.873 . . . . 0.0 109.035 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . 0.419 ' OD1' ' O ' ' A' ' 154' ' ' VAL . 15.5 p30 40.28 63.15 1.15 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.719 -0.613 . . . . 0.0 110.09 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 94.0 mtt180 42.55 -125.64 0.71 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.554 -0.716 . . . . 0.0 110.044 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -148.5 -137.15 2.81 Favored Glycine 0 N--CA 1.494 2.533 0 N-CA-C 109.414 -1.475 . . . . 0.0 109.414 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 76.9 -133.51 13.59 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 33.8 t -165.45 -29.62 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.271 -1.135 . . . . 0.0 109.469 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -151.87 -19.91 0.19 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.284 -0.885 . . . . 0.0 109.37 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 18.8 tt -60.11 -8.08 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.222 -0.924 . . . . 0.0 109.373 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 55.4 tt0 -47.71 -70.75 0.08 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.29 -0.881 . . . . 0.0 109.679 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 87.8 p -168.49 -40.49 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.291 -0.88 . . . . 0.0 109.483 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -53.08 107.77 0.26 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.202 -0.936 . . . . 0.0 109.522 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 47.0 m80 -67.04 -48.28 68.82 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.205 -0.934 . . . . 0.0 109.491 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 52.1 t80 . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 118.041 -0.981 . . . . 0.0 109.492 -179.977 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.3 mtt . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 121.28 0.562 . . . . 0.0 109.525 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -67.0 143.19 42.9 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 61.6 p -67.59 -161.78 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.225 -1.162 . . . . 0.0 109.437 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -69.71 -109.64 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.227 -0.92 . . . . 0.0 109.483 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -170.99 -53.15 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.269 -0.895 . . . . 0.0 109.476 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.485 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 13.5 mp0 -58.68 -41.79 87.02 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.242 -0.911 . . . . 0.0 109.514 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 57.4 mt-10 -66.13 158.91 27.39 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.286 -0.884 . . . . 0.0 109.412 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 70.89 121.83 0.05 OUTLIER Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.5 m 52.85 80.57 0.1 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.141 -1.211 . . . . 0.0 109.52 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.7 p -71.49 149.3 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.31 -0.869 . . . . 0.0 109.503 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 29.4 t -169.46 49.73 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.181 -0.95 . . . . 0.0 109.39 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 21.8 m -65.99 -144.64 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.221 -0.924 . . . . 0.0 109.317 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -169.09 -121.26 0.57 Allowed Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.8 t -60.88 142.65 56.08 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.266 -1.138 . . . . 0.0 109.46 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.429 ' O ' ' O ' ' A' ' 16' ' ' GLN . 92.6 mttt -75.19 -142.36 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.23 -0.919 . . . . 0.0 109.452 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.429 ' O ' ' O ' ' A' ' 15' ' ' LYS . 4.1 pt20 -60.85 -151.29 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.362 -0.836 . . . . 0.0 109.289 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -59.16 -38.74 80.47 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.023 -1.048 . . . . 0.0 109.646 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.405 ' CE2' ' CE1' ' A' ' 19' ' ' HIS . 9.9 t80 62.18 -146.3 0.39 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.341 -0.849 . . . . 0.0 109.275 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.538 ' N ' ' HD1' ' A' ' 19' ' ' HIS . 0.4 OUTLIER -63.8 -45.36 90.02 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.213 -0.93 . . . . 0.0 109.45 -179.879 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.422 ' O ' ' O ' ' A' ' 21' ' ' GLY . 37.1 m -165.29 -23.89 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.257 -0.902 . . . . 0.0 109.541 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.422 ' O ' ' O ' ' A' ' 20' ' ' THR . . . 62.3 132.02 0.01 OUTLIER Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.5 ttmt -166.86 -32.7 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.249 -1.148 . . . . 0.0 109.528 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 16.8 mt -85.09 111.65 19.95 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.263 -0.898 . . . . 0.0 109.225 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 30.1 m -75.9 -176.84 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.251 -0.906 . . . . 0.0 109.824 -179.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 60.1 p -44.33 106.42 0.07 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.524 -0.735 . . . . 0.0 109.906 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 47.5 m -78.42 104.07 8.77 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.322 -0.861 . . . . 0.0 109.502 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.5 mmtm -76.75 -177.75 4.46 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.243 -0.911 . . . . 0.0 109.44 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 175.91 49.22 0.06 OUTLIER Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.329 -1.508 . . . . 0.0 109.329 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -79.14 122.6 26.46 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.32 -1.106 . . . . 0.0 109.703 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 31.9 mttm -151.75 -170.89 3.78 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.38 -0.825 . . . . 0.0 108.982 179.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -160.2 -15.75 0.05 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.397 -0.814 . . . . 0.0 109.091 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.7 mt -57.64 -41.11 80.73 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.31 -0.869 . . . . 0.0 109.437 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 18.5 mt -69.87 -51.24 34.99 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.247 -0.908 . . . . 0.0 109.467 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.532 ' CD1' ' N ' ' A' ' 34' ' ' ILE . 1.5 mp -72.86 150.01 8.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.26 -0.9 . . . . 0.0 108.805 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.7 t70 53.75 90.45 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.239 -0.913 . . . . 0.0 109.455 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -70.57 -81.02 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.262 -0.899 . . . . 0.0 109.494 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 65.7 tt0 -170.19 -13.38 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.239 -0.913 . . . . 0.0 109.511 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 53.4 pttt -52.87 165.86 0.26 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.238 -0.914 . . . . 0.0 109.515 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 20.9 m -153.42 -164.99 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.253 -0.904 . . . . 0.0 109.306 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 63.5 p -65.93 -175.89 0.34 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.186 -0.946 . . . . 0.0 109.535 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.49 ' C ' ' H ' ' A' ' 43' ' ' HIS . 67.5 p -169.68 14.84 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.254 -0.904 . . . . 0.0 109.507 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -75.06 20.89 1.8 Allowed Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.49 ' H ' ' C ' ' A' ' 41' ' ' SER . 67.9 m-70 -72.83 -30.88 64.38 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.239 -1.154 . . . . 0.0 109.347 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 26.8 m -72.48 110.74 7.09 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.276 -0.89 . . . . 0.0 109.47 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.472 ' OG1' ' N ' ' A' ' 46' ' ' THR . 0.1 OUTLIER -68.91 -90.48 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.303 -0.873 . . . . 0.0 109.448 -179.974 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.472 ' N ' ' OG1' ' A' ' 45' ' ' THR . 5.3 t -77.03 150.68 35.78 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.232 -0.917 . . . . 0.0 109.375 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.412 ' N ' ' HG1' ' A' ' 46' ' ' THR . 67.7 p -77.56 146.63 36.16 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.172 -0.955 . . . . 0.0 109.594 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -145.8 164.85 30.59 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.254 -0.904 . . . . 0.0 109.156 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.435 ' O ' ' O ' ' A' ' 50' ' ' SER . 44.6 ttm180 -87.86 132.08 34.32 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.185 -0.947 . . . . 0.0 109.599 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.435 ' O ' ' O ' ' A' ' 49' ' ' ARG . 73.3 m -45.98 -94.48 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.337 -0.852 . . . . 0.0 109.876 -179.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.429 ' O ' ' OG ' ' A' ' 52' ' ' SER . 1.9 t -58.28 162.51 3.55 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.247 -0.908 . . . . 0.0 109.315 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.59 ' N ' ' SG ' ' A' ' 81' ' ' CYS . 4.5 p 61.82 152.4 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.25 -0.906 . . . . 0.0 109.492 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -95.71 112.33 24.07 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.323 -0.861 . . . . 0.0 109.08 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 96.6 t -126.94 116.4 44.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.489 -0.757 . . . . 0.0 109.358 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 2.4 pp -127.81 121.64 56.98 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 67.9 p -130.74 112.61 13.23 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.355 -0.84 . . . . 0.0 109.625 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -123.38 111.51 16.45 Favored 'General case' 0 N--CA 1.51 2.549 0 N-CA-C 108.72 -0.845 . . . . 0.0 108.72 178.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 70.4 p -120.63 126.13 49.49 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.604 -0.685 . . . . 0.0 109.198 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.452 ' O ' ' CG2' ' A' ' 59' ' ' VAL . 2.8 m -131.71 118.68 39.49 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.214 0 O-C-N 121.399 -0.813 . . . . 0.0 109.476 179.268 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 69.3 p -113.48 135.72 53.58 Favored 'General case' 0 N--CA 1.499 1.979 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.653 ' ND2' ' H ' ' A' ' 62' ' ' ALA . 4.5 t-20 -164.52 165.05 21.61 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.651 -1.281 . . . . 0.0 110.25 179.331 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.653 ' H ' ' ND2' ' A' ' 61' ' ' ASN . . . -74.81 -11.42 60.14 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 120.97 -1.081 . . . . 0.0 111.189 -179.432 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -74.71 8.95 2.05 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.122 -0.986 . . . . 0.0 109.591 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.403 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 82.42 10.08 84.0 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 108.9 -1.68 . . . . 0.0 108.9 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -91.7 97.2 10.87 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.059 -1.259 . . . . 0.0 108.705 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 48.4 p -129.79 66.12 1.48 Allowed 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 107.659 -1.238 . . . . 0.0 107.659 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -94.15 122.04 36.27 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.688 0.756 . . . . 0.0 111.195 -177.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.2 p -101.29 111.55 23.8 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 178.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.515 ' O ' ' N ' ' A' ' 71' ' ' GLU . 4.3 m -112.97 25.62 11.24 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 179.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 26.9 pttt -66.2 68.76 0.05 Allowed 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 179.179 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.515 ' N ' ' O ' ' A' ' 69' ' ' THR . 43.8 mm-40 -105.41 149.92 25.71 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.423 -0.798 . . . . 0.0 109.696 -179.455 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 24.1 m -127.43 142.99 42.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 16.5 t -128.62 119.84 51.07 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 CA-C-O 121.945 0.879 . . . . 0.0 109.012 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -58.46 -73.29 0.08 Allowed 'General case' 0 C--N 1.291 -1.974 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.523 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.53 ' C ' ' H ' ' A' ' 77' ' ' ASP . 79.6 p -161.47 71.56 0.38 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.259 -0.901 . . . . 0.0 109.495 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -68.28 43.41 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.225 -0.922 . . . . 0.0 109.351 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.53 ' H ' ' C ' ' A' ' 75' ' ' SER . 23.4 t0 -171.84 -37.03 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.294 -0.878 . . . . 0.0 109.174 -179.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.469 ' O ' ' N ' ' A' ' 80' ' ' ASP . . . 88.34 43.58 5.53 Favored Glycine 0 N--CA 1.493 2.481 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 48.7 m -68.51 50.66 0.07 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.339 -1.095 . . . . 0.0 109.297 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.514 ' N ' ' OD1' ' A' ' 80' ' ' ASP . 0.4 OUTLIER 54.84 25.87 7.14 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.343 -0.848 . . . . 0.0 109.512 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.59 ' SG ' ' N ' ' A' ' 52' ' ' SER . 12.3 t -108.0 -71.83 0.74 Allowed 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.45 -0.781 . . . . 0.0 109.275 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.504 ' O ' ' N ' ' A' ' 84' ' ' ALA . . . -72.77 -34.05 59.76 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 17.3 t70 51.07 -90.99 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.217 -1.167 . . . . 0.0 109.497 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.504 ' N ' ' O ' ' A' ' 82' ' ' GLY . . . -64.38 173.95 1.86 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.287 -0.883 . . . . 0.0 109.406 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -157.64 -110.9 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.303 -0.873 . . . . 0.0 109.368 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -70.58 113.16 7.41 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.13 -0.981 . . . . 0.0 109.577 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -64.08 -145.25 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.256 -0.902 . . . . 0.0 109.253 179.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . 0.444 ' O ' ' N ' ' A' ' 90' ' ' HIS . 18.5 m-90 -152.23 137.01 17.05 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.215 -0.928 . . . . 0.0 109.382 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 34.3 t60 -68.53 66.8 0.12 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.283 -0.886 . . . . 0.0 109.527 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.446 ' CG ' ' O ' ' A' ' 90' ' ' HIS . 18.9 t-80 52.81 43.88 30.95 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.281 -0.887 . . . . 0.0 109.614 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 11.5 p -142.13 119.03 11.2 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.221 -0.924 . . . . 0.0 109.297 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.534 ' N ' ' CD ' ' A' ' 93' ' ' PRO . 0.2 OUTLIER -69.19 -47.32 28.78 Favored Pre-proline 0 N--CA 1.487 1.421 0 O-C-N 121.273 -0.892 . . . . 0.0 110.385 -179.973 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.534 ' CD ' ' N ' ' A' ' 92' ' ' PHE . 5.2 Cg_exo -64.45 143.06 81.05 Favored 'Trans proline' 0 C--N 1.322 -0.851 0 C-N-CA 120.914 1.076 . . . . 0.0 109.877 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 43.7 m -60.99 -52.84 63.31 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.321 -0.862 . . . . 0.0 109.54 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 32.6 ptt180 -164.63 141.12 6.07 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.188 -0.945 . . . . 0.0 109.492 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 161.79 -170.91 37.61 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 57.7 t-20 -167.87 -78.11 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.26 -1.141 . . . . 0.0 109.588 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 55.8 mt -75.2 -92.43 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.247 -0.908 . . . . 0.0 109.526 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 49.0 35.31 6.61 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.99 -1.069 . . . . 0.0 109.551 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.505 ' CG ' ' H ' ' A' ' 101' ' ' PHE . 7.7 p-10 -67.35 -114.86 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.24 -0.912 . . . . 0.0 109.443 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.505 ' H ' ' CG ' ' A' ' 100' ' ' ASP . 64.9 t80 -66.38 -31.36 72.09 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.192 -0.943 . . . . 0.0 109.417 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -169.95 161.44 8.83 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.282 -0.886 . . . . 0.0 109.439 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.421 ' O ' ' O ' ' A' ' 104' ' ' ARG . 59.2 t-80 -63.23 -47.65 81.6 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.168 -0.958 . . . . 0.0 109.576 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.421 ' O ' ' O ' ' A' ' 103' ' ' HIS . 42.0 ttm180 51.81 98.24 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.26 -0.9 . . . . 0.0 109.56 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.405 ' O ' ' O ' ' A' ' 104' ' ' ARG . 47.3 m-20 -60.77 -154.55 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.238 -0.914 . . . . 0.0 109.496 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.467 ' NZ ' ' CB ' ' A' ' 106' ' ' LYS . 6.4 ttpm? -163.97 160.59 22.08 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.293 -0.88 . . . . 0.0 109.443 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -171.36 76.56 0.06 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.192 -0.943 . . . . 0.0 109.548 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 31.3 t70 51.29 77.44 0.13 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.238 -0.914 . . . . 0.0 109.515 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . 0.508 ' O ' ' CD2' ' A' ' 109' ' ' PHE . 81.8 t80 -83.43 0.1 47.68 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.28 -0.887 . . . . 0.0 109.52 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -73.2 -20.83 60.79 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.222 -0.924 . . . . 0.0 109.434 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -177.32 145.23 0.44 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.268 -0.895 . . . . 0.0 109.53 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 30.1 mmt180 -76.04 -113.67 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.187 -0.946 . . . . 0.0 109.264 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.46 ' C ' ' H ' ' A' ' 115' ' ' HIS . 46.3 t -71.16 120.51 16.84 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.232 -0.917 . . . . 0.0 109.435 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.409 ' O ' ' OE1' ' A' ' 116' ' ' GLU . 36.7 t -66.69 2.23 1.44 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.25 -0.906 . . . . 0.0 109.485 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . 0.46 ' H ' ' C ' ' A' ' 113' ' ' SER . 20.5 m170 -80.22 65.58 5.43 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.219 -0.925 . . . . 0.0 109.385 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.422 ' OE2' ' O ' ' A' ' 113' ' ' SER . 4.9 mp0 -68.42 -179.69 1.4 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.293 -0.88 . . . . 0.0 109.432 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -66.87 115.29 6.48 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.235 -0.915 . . . . 0.0 109.344 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -64.68 -38.02 89.58 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.245 -0.91 . . . . 0.0 109.412 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -178.08 139.68 4.29 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 51.3 mtp180 -63.56 166.43 6.77 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.255 -1.144 . . . . 0.0 109.388 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 7.5 t -80.99 -32.14 34.39 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.148 -0.97 . . . . 0.0 109.352 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 167.94 172.7 35.24 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.453 -1.459 . . . . 0.0 109.453 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 14.0 mt -68.31 128.45 36.62 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.232 -1.157 . . . . 0.0 109.344 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -72.25 153.74 92.24 Favored Pre-proline 0 N--CA 1.49 1.535 0 O-C-N 121.187 -0.946 . . . . 0.0 108.831 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -56.79 130.72 41.42 Favored 'Trans proline' 0 C--N 1.322 -0.829 0 C-N-CA 121.024 1.149 . . . . 0.0 109.786 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.516 ' O ' ' CG ' ' A' ' 127' ' ' PHE . 69.1 mm-40 -72.49 -49.65 31.5 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.208 -0.933 . . . . 0.0 109.359 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . 0.516 ' CG ' ' O ' ' A' ' 126' ' ' GLU . 97.9 m-85 -158.12 90.23 1.04 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.339 -0.851 . . . . 0.0 109.395 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . 54.59 -139.83 0.98 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.285 -0.885 . . . . 0.0 109.444 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -166.6 91.28 0.43 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.189 -0.944 . . . . 0.0 109.415 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.527 ' N ' ' CD2' ' A' ' 130' ' ' LEU . 3.5 mm? -70.78 73.45 0.57 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.176 -0.953 . . . . 0.0 109.182 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 178.26 74.86 0.06 OUTLIER Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . 0.442 ' O ' ' N ' ' A' ' 134' ' ' GLY . 72.6 mt-10 -60.2 100.26 0.09 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.228 -1.16 . . . . 0.0 109.428 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 93.0 p -67.2 71.66 0.11 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.216 -0.928 . . . . 0.0 109.474 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . 0.489 ' C ' ' H ' ' A' ' 136' ' ' SER . . . -169.67 -55.29 0.03 OUTLIER Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 92.3 p -69.91 43.84 0.06 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.246 -1.149 . . . . 0.0 109.53 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' SER . . . . . 0.489 ' H ' ' C ' ' A' ' 134' ' ' GLY . 85.7 p -63.21 145.56 55.26 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.213 -0.93 . . . . 0.0 109.388 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 79.1 p -169.41 119.4 0.67 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.265 -0.897 . . . . 0.0 109.428 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 70.6 m -163.6 98.42 0.89 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.176 -0.953 . . . . 0.0 109.436 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 32.5 mtmm -62.73 -166.99 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.253 -0.904 . . . . 0.0 109.483 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 37.7 m -164.42 -46.74 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.296 -0.877 . . . . 0.0 109.408 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 14.6 t 53.14 78.99 0.13 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.21 -0.931 . . . . 0.0 109.46 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' THR . . . . . 0.436 ' OG1' ' ND1' ' A' ' 143' ' ' HIS . 78.5 p -67.11 -31.97 72.79 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.214 -0.929 . . . . 0.0 109.492 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . 0.622 ' N ' ' HD1' ' A' ' 143' ' ' HIS . 1.0 OUTLIER -171.77 -33.02 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.201 -0.937 . . . . 0.0 109.432 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 72.6 m -167.7 104.8 0.51 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.251 -0.906 . . . . 0.0 109.43 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -61.46 -65.61 0.66 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.299 -0.876 . . . . 0.0 109.484 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 37.2 tt0 -168.34 -22.85 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.25 -0.906 . . . . 0.0 109.469 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -57.64 176.16 0.15 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.258 -0.901 . . . . 0.0 109.439 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . 0.488 ' C ' ' H ' ' A' ' 150' ' ' SER . 27.5 m -150.94 160.19 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.205 -0.935 . . . . 0.0 109.393 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 47.7 t -68.99 7.24 0.73 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.194 -0.941 . . . . 0.0 109.515 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' SER . . . . . 0.488 ' H ' ' C ' ' A' ' 148' ' ' VAL . 15.0 t 52.79 -175.16 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.27 -0.894 . . . . 0.0 109.431 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 88.3 p -170.54 70.24 0.05 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.269 -0.894 . . . . 0.0 109.483 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 1.5 t -170.22 -25.95 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.275 -0.89 . . . . 0.0 109.505 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' THR . . . . . 0.422 ' OG1' ' N ' ' A' ' 154' ' ' VAL . 82.8 p -69.47 -83.47 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.269 -0.894 . . . . 0.0 109.45 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.422 ' N ' ' OG1' ' A' ' 153' ' ' THR . 22.7 t 52.51 84.41 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.184 -0.948 . . . . 0.0 109.447 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . 0.415 ' O ' ' O ' ' A' ' 156' ' ' ARG . 7.1 m120 -64.69 -21.31 66.71 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.311 -0.868 . . . . 0.0 109.478 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . 0.415 ' O ' ' O ' ' A' ' 155' ' ' ASN . 62.6 mtm180 -57.6 -162.29 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.313 -0.867 . . . . 0.0 109.526 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -64.55 175.12 12.6 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -163.92 10.69 0.09 OUTLIER Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.708 -1.357 . . . . 0.0 109.708 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 12.6 m 52.08 -166.18 0.05 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.235 -1.156 . . . . 0.0 109.437 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -171.25 -1.66 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.184 -0.948 . . . . 0.0 109.52 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 78.4 mt -79.32 89.17 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.235 -0.915 . . . . 0.0 109.468 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 74.2 mt-10 -63.73 -102.3 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.27 -0.893 . . . . 0.0 109.488 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 29.0 t -171.99 0.64 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.224 -0.922 . . . . 0.0 109.435 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 53.3 pttt -168.76 144.06 3.37 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.212 -0.93 . . . . 0.0 109.452 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 5.0 m-70 -69.05 -78.78 0.06 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.302 -0.874 . . . . 0.0 109.412 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 . . . . . 0 N--CA 1.489 1.519 0 CA-C-O 118.038 -0.982 . . . . 0.0 109.485 179.969 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.5 ttt . . . . . 0 N--CA 1.491 1.595 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 171.24 78.62 0.05 OUTLIER Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 70.8 p -65.36 94.82 0.18 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.187 -1.184 . . . . 0.0 109.506 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.541 ' CD2' ' N ' ' A' ' 5' ' ' ARG . 72.1 t80 -69.52 175.9 3.81 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.27 -0.894 . . . . 0.0 109.406 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.575 HH11 ' CG ' ' A' ' 5' ' ' ARG . 3.5 mtt-85 -63.12 -64.59 0.87 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.281 -0.887 . . . . 0.0 109.493 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 48.6 tt0 53.41 90.64 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.198 -0.939 . . . . 0.0 109.502 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -65.61 -125.96 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.241 -0.912 . . . . 0.0 109.375 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -178.38 36.24 0.08 OUTLIER Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.576 -1.409 . . . . 0.0 109.576 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.477 ' C ' ' H ' ' A' ' 11' ' ' SER . 69.2 m -166.04 93.37 0.53 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.262 -1.14 . . . . 0.0 109.551 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.4 m -74.7 18.9 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.224 -0.922 . . . . 0.0 109.434 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.477 ' H ' ' C ' ' A' ' 9' ' ' SER . 12.4 m 52.66 39.25 28.04 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.335 -0.853 . . . . 0.0 109.438 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.7 t 48.2 -140.6 0.62 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.298 -0.876 . . . . 0.0 109.529 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -168.04 69.0 0.17 Allowed Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 59.9 p -63.15 -46.9 85.02 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.339 -1.095 . . . . 0.0 109.552 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.481 ' C ' ' H ' ' A' ' 17' ' ' GLU . 91.8 mttt 52.5 64.86 1.69 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.156 -0.965 . . . . 0.0 109.374 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -70.97 10.17 0.58 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.249 -0.907 . . . . 0.0 109.42 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.481 ' H ' ' C ' ' A' ' 15' ' ' LYS . 48.7 mt-10 -80.19 -41.49 25.14 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.306 -0.871 . . . . 0.0 109.604 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 50.91 13.88 0.16 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.193 -0.942 . . . . 0.0 109.275 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.449 ' H ' ' C ' ' A' ' 17' ' ' GLU . 6.4 m-70 -75.42 -24.38 57.09 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.278 -0.889 . . . . 0.0 109.484 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 71.5 p -69.01 92.97 0.54 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.213 -0.929 . . . . 0.0 109.485 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -70.35 -149.14 0.47 Allowed Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -90.75 128.2 36.6 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.289 -1.124 . . . . 0.0 109.244 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.493 ' CD1' ' N ' ' A' ' 23' ' ' LEU . 8.6 mp 51.01 87.24 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.134 -0.979 . . . . 0.0 109.199 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 25.5 t -60.35 -40.98 85.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.28 -0.888 . . . . 0.0 109.48 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.97 128.63 36.55 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.279 -0.888 . . . . 0.0 109.487 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 49.3 m -156.81 -12.96 0.09 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.299 -0.875 . . . . 0.0 109.479 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 58.7 mttp -55.23 112.58 1.12 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.195 -0.941 . . . . 0.0 109.472 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 179.71 -155.13 14.87 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.421 ' O ' ' O ' ' A' ' 30' ' ' LYS . 1.2 m-20 -72.28 3.94 4.17 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.281 -1.129 . . . . 0.0 109.384 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.421 ' O ' ' O ' ' A' ' 29' ' ' ASP . 49.9 mtpt 52.56 175.66 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.403 -0.81 . . . . 0.0 109.568 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.46 ' N ' ' CD ' ' A' ' 31' ' ' GLU . 17.8 mp0 -84.43 114.39 21.87 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.247 -0.908 . . . . 0.0 109.526 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 15.8 mt -72.44 -6.84 46.42 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.207 -0.933 . . . . 0.0 109.361 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 11.0 tp -168.47 139.41 2.61 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.277 -0.889 . . . . 0.0 109.281 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 21.1 pt -67.94 164.79 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.215 -0.928 . . . . 0.0 109.522 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.421 ' CG ' ' H ' ' A' ' 36' ' ' ASN . 35.3 t0 53.03 178.33 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.291 -0.88 . . . . 0.0 109.557 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.542 ' N ' HD21 ' A' ' 36' ' ' ASN . 1.8 m120 -55.96 156.68 5.07 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.256 -0.902 . . . . 0.0 109.498 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -73.89 -67.72 0.58 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.22 -0.925 . . . . 0.0 109.24 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -72.56 93.8 1.63 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.248 -0.908 . . . . 0.0 109.447 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.5 m -75.42 -158.93 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.244 -0.91 . . . . 0.0 109.427 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 79.6 p -59.24 132.02 52.75 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.236 -0.915 . . . . 0.0 109.433 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 50.9 m -69.72 87.87 0.52 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.326 -0.858 . . . . 0.0 109.441 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.436 ' C ' ' H ' ' A' ' 44' ' ' THR . . . 168.36 40.47 0.03 OUTLIER Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.508 ' C ' ' H ' ' A' ' 45' ' ' THR . 63.4 t60 -73.92 11.02 0.96 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.242 -1.152 . . . . 0.0 109.384 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.436 ' H ' ' C ' ' A' ' 42' ' ' GLY . 2.7 m -75.8 25.36 0.12 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.231 -0.918 . . . . 0.0 109.224 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.508 ' H ' ' C ' ' A' ' 43' ' ' HIS . 70.0 p -75.34 109.55 8.95 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.172 -0.955 . . . . 0.0 109.295 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 56.9 p -151.78 123.13 7.77 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.247 -0.908 . . . . 0.0 109.359 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 61.2 p -71.42 103.72 3.0 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.247 -0.908 . . . . 0.0 109.428 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 55.6 mtp180 -145.75 143.97 30.05 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.343 -0.848 . . . . 0.0 109.174 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.1 mmm180 -88.05 122.26 31.43 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.191 -0.943 . . . . 0.0 109.709 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.445 ' O ' ' O ' ' A' ' 51' ' ' CYS . 41.7 t -67.02 -67.82 0.42 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.222 -0.924 . . . . 0.0 109.668 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.445 ' O ' ' O ' ' A' ' 50' ' ' SER . 41.7 t -47.73 -93.39 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.157 -0.964 . . . . 0.0 109.235 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 48.7 m -55.47 149.79 12.9 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 22.9 tptp -95.56 100.4 12.14 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 120.959 -1.088 . . . . 0.0 108.438 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 41.2 t -128.45 116.2 40.83 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.647 -0.658 . . . . 0.0 109.562 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 17.0 tt -127.89 124.92 63.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 179.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.6 m -128.19 111.65 13.67 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.365 -0.835 . . . . 0.0 109.488 -179.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.402 ' H ' ' HB ' ' A' ' 69' ' ' THR . 10.0 mtmt -124.3 114.42 19.54 Favored 'General case' 0 N--CA 1.512 2.652 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 178.203 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.9 p -118.96 126.63 52.2 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.433 -0.792 . . . . 0.0 109.752 -179.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.6 m -132.35 122.93 49.12 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.13 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 178.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 7.9 t -107.57 120.17 41.46 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.561 -0.712 . . . . 0.0 109.98 -179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.462 ' ND2' ' O ' ' A' ' 65' ' ' ARG . 2.5 m-20 -111.82 145.45 39.41 Favored 'General case' 0 N--CA 1.51 2.553 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.479 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -69.96 -30.26 67.58 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 120.07 -1.644 . . . . 0.0 112.737 -177.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 11.5 p30 -67.07 3.99 1.0 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.249 -1.532 . . . . 0.0 109.863 -178.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.479 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 96.83 5.6 58.51 Favored Glycine 0 N--CA 1.496 2.654 0 N-CA-C 110.664 -0.974 . . . . 0.0 110.664 178.6 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.462 ' O ' ' ND2' ' A' ' 61' ' ' ASN . 11.7 mpt_? -91.68 104.82 17.24 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.568 -1.548 . . . . 0.0 108.043 178.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 28.7 p -130.1 104.53 7.38 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.536 -0.728 . . . . 0.0 109.128 -179.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -94.58 127.61 40.63 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.154 -0.966 . . . . 0.0 109.979 -179.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 73.3 m -108.68 108.37 19.2 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.546 -0.721 . . . . 0.0 109.286 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.402 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 5.8 m -102.08 27.14 6.86 Favored 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 178.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -70.09 69.04 0.33 Allowed 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 179.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -106.26 143.98 33.61 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.552 -0.718 . . . . 0.0 109.275 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 43.1 t -128.11 129.19 69.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 179.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 17.2 t -130.12 116.93 38.76 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 CA-C-O 122.072 0.939 . . . . 0.0 108.95 179.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 58.1 mttp -78.77 -164.56 0.6 Allowed 'General case' 0 C--N 1.287 -2.109 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.614 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.519 ' O ' ' N ' ' A' ' 77' ' ' ASP . 86.1 p -77.6 90.34 3.94 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.192 -0.943 . . . . 0.0 109.643 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -46.15 -14.93 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.36 -0.837 . . . . 0.0 109.839 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.519 ' N ' ' O ' ' A' ' 75' ' ' SER . 44.0 m-20 -158.12 -38.79 0.07 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.203 -0.936 . . . . 0.0 109.316 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.411 ' O ' ' OG ' ' A' ' 79' ' ' SER . . . 177.51 -5.5 0.03 OUTLIER Glycine 0 N--CA 1.488 2.162 0 N-CA-C 109.24 -1.544 . . . . 0.0 109.24 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' SER . . . . . 0.495 ' OG ' ' SG ' ' A' ' 81' ' ' CYS . 96.9 p 47.16 27.09 0.75 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.277 -1.131 . . . . 0.0 109.242 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 54.12 24.35 4.77 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.417 -0.802 . . . . 0.0 109.233 -179.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.495 ' SG ' ' OG ' ' A' ' 79' ' ' SER . 99.3 m -95.7 18.82 12.22 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.185 -0.947 . . . . 0.0 109.49 -179.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -158.8 -8.07 0.05 OUTLIER Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.491 ' C ' ' H ' ' A' ' 85' ' ' ASP . 9.0 p-10 -161.77 95.46 0.99 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.397 -1.061 . . . . 0.0 109.502 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -67.12 4.64 0.86 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.241 -0.912 . . . . 0.0 109.364 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.491 ' H ' ' C ' ' A' ' 83' ' ' ASP . 27.0 t70 -168.42 141.43 3.02 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.298 -0.876 . . . . 0.0 109.474 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -58.6 123.5 16.49 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.269 -0.894 . . . . 0.0 109.456 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -60.67 -48.14 83.11 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.215 -0.928 . . . . 0.0 109.467 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . 0.426 ' O ' ' O ' ' A' ' 89' ' ' HIS . 35.6 m95 -65.3 -37.51 87.36 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.194 -0.941 . . . . 0.0 109.491 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.426 ' O ' ' O ' ' A' ' 88' ' ' TRP . 49.9 t-80 54.89 169.8 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.389 -0.82 . . . . 0.0 109.516 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.416 ' ND1' ' N ' ' A' ' 90' ' ' HIS . 8.3 m80 -82.2 53.68 2.33 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.282 -0.886 . . . . 0.0 109.449 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 7.1 m -60.27 136.83 58.15 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.176 -0.952 . . . . 0.0 109.488 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 50.23 67.9 3.94 Favored Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.23 -0.919 . . . . 0.0 109.707 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -61.77 -31.4 85.67 Favored 'Trans proline' 0 C--N 1.318 -1.077 0 C-N-CA 121.399 1.399 . . . . 0.0 109.693 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 88.1 p -83.84 157.3 22.07 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.343 -0.848 . . . . 0.0 109.297 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.588 HH11 ' CG ' ' A' ' 95' ' ' ARG . 0.1 OUTLIER -167.35 -2.14 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.188 -0.945 . . . . 0.0 109.389 -179.938 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -67.91 54.68 0.38 Allowed Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.411 ' N ' ' O ' ' A' ' 95' ' ' ARG . 69.9 m-80 50.74 94.22 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.261 -1.141 . . . . 0.0 109.451 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 10.7 tp -170.91 118.25 0.49 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.317 -0.864 . . . . 0.0 109.317 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.443 ' OD1' ' N ' ' A' ' 100' ' ' ASP . 63.3 t0 -168.71 133.66 1.62 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.25 -0.906 . . . . 0.0 109.535 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.525 ' O ' ' CE2' ' A' ' 102' ' ' PHE . 56.8 m-20 52.07 86.73 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.3 -0.875 . . . . 0.0 109.667 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 22.0 p90 -59.49 -9.37 2.43 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.242 -0.911 . . . . 0.0 109.473 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.525 ' CE2' ' O ' ' A' ' 100' ' ' ASP . 13.2 m-85 60.21 105.99 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.406 -0.808 . . . . 0.0 109.488 -179.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -76.52 -32.18 58.11 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.227 -0.921 . . . . 0.0 109.53 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 58.6 ttt180 57.02 167.73 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.217 -0.927 . . . . 0.0 109.321 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.521 ' C ' ' H ' ' A' ' 107' ' ' ASP . 3.5 p30 -131.36 125.19 32.03 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.426 -0.796 . . . . 0.0 109.174 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -71.56 15.59 0.13 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.245 -0.909 . . . . 0.0 109.652 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.521 ' H ' ' C ' ' A' ' 105' ' ' ASP . 8.3 p-10 -171.76 87.85 0.1 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.267 -0.896 . . . . 0.0 109.518 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -66.05 134.62 53.25 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.258 -0.901 . . . . 0.0 109.307 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -63.21 -34.77 78.36 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.231 -0.918 . . . . 0.0 109.465 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -66.69 80.67 0.1 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.291 -0.88 . . . . 0.0 109.483 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 73.4 p -63.72 95.33 0.11 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.317 -0.864 . . . . 0.0 109.436 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.494 ' C ' ' H ' ' A' ' 114' ' ' SER . 69.2 ttt180 -67.86 87.43 0.24 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.245 -0.909 . . . . 0.0 109.428 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.416 ' OG ' ' O ' ' A' ' 112' ' ' ARG . 17.4 p 54.81 7.51 0.17 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.29 -0.881 . . . . 0.0 109.385 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.494 ' H ' ' C ' ' A' ' 112' ' ' ARG . 26.8 p 51.9 -156.55 0.14 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.28 -0.887 . . . . 0.0 109.433 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . 0.476 ' HD1' ' H ' ' A' ' 115' ' ' HIS . 32.0 p-80 -69.33 -165.23 0.07 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.345 -0.847 . . . . 0.0 109.554 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -69.55 161.44 29.55 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.261 -0.899 . . . . 0.0 109.403 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -63.14 130.87 46.48 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.193 -0.942 . . . . 0.0 109.517 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -169.33 73.18 0.08 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.33 -0.856 . . . . 0.0 109.259 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 176.66 86.45 0.06 OUTLIER Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 38.1 ttm180 -66.19 139.4 58.11 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.335 -1.097 . . . . 0.0 109.399 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 1.9 t -170.37 26.94 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.238 -0.914 . . . . 0.0 109.526 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 178.91 140.48 3.99 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.531 ' CD2' ' N ' ' A' ' 123' ' ' LEU . 3.4 mm? -75.4 127.46 33.17 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.219 -1.166 . . . . 0.0 109.064 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -77.28 161.78 71.58 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.156 -0.965 . . . . 0.0 108.816 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -57.79 154.64 36.59 Favored 'Trans proline' 0 C--N 1.32 -0.951 0 C-N-CA 121.409 1.406 . . . . 0.0 109.804 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -65.04 -133.94 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.202 -0.936 . . . . 0.0 109.159 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -76.72 -133.37 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.927 -1.108 . . . . 0.0 109.327 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -66.79 -69.31 0.31 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.216 -0.928 . . . . 0.0 109.443 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -172.29 158.84 4.55 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.267 -0.896 . . . . 0.0 109.39 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 10.9 tp -64.76 95.72 0.16 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.317 -0.865 . . . . 0.0 109.321 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . 0.425 ' O ' ' O ' ' A' ' 132' ' ' GLU . . . 175.79 31.55 0.04 OUTLIER Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . 0.532 ' CD ' ' H ' ' A' ' 132' ' ' GLU . 0.4 OUTLIER -55.29 -169.12 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.247 -1.149 . . . . 0.0 109.616 -179.934 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 27.8 t -170.93 -87.78 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.286 -0.884 . . . . 0.0 109.503 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 173.04 70.38 0.05 OUTLIER Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.485 -1.446 . . . . 0.0 109.485 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' SER . . . . . 0.401 ' O ' ' O ' ' A' ' 136' ' ' SER . 41.7 t -69.27 176.83 3.08 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.281 -1.129 . . . . 0.0 109.469 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' SER . . . . . 0.452 ' C ' ' H ' ' A' ' 138' ' ' SER . 12.8 t 53.19 97.67 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.253 -0.904 . . . . 0.0 109.418 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' SER . . . . . 0.483 ' C ' ' H ' ' A' ' 139' ' ' LYS . 90.7 p -58.39 -6.91 0.75 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.276 -0.89 . . . . 0.0 109.509 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' SER . . . . . 0.483 ' O ' ' N ' ' A' ' 140' ' ' THR . 84.8 p -72.7 13.36 0.37 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.316 -0.865 . . . . 0.0 109.401 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.483 ' H ' ' C ' ' A' ' 137' ' ' SER . 61.0 tttp -59.16 84.75 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.266 -0.896 . . . . 0.0 109.47 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' THR . . . . . 0.483 ' N ' ' O ' ' A' ' 138' ' ' SER . 39.9 m -165.4 -44.03 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.279 -0.888 . . . . 0.0 109.492 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 87.6 p -169.86 -167.94 0.71 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.341 -0.849 . . . . 0.0 109.408 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 1.5 t -171.75 164.93 6.62 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.292 -0.88 . . . . 0.0 109.48 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . 0.403 ' CG ' ' N ' ' A' ' 144' ' ' SER . 57.9 t-80 -63.0 164.76 7.79 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.195 -0.94 . . . . 0.0 109.444 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' SER . . . . . 0.403 ' N ' ' CG ' ' A' ' 143' ' ' HIS . 89.7 p -169.63 -138.51 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.218 -0.926 . . . . 0.0 109.51 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 19.1 ttpp -163.95 144.55 8.49 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.232 -0.917 . . . . 0.0 109.495 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 45.4 tt0 -169.73 -85.7 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.299 -0.875 . . . . 0.0 109.43 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . 0.52 ' O ' ' CD2' ' A' ' 147' ' ' PHE . 70.6 t80 51.15 47.8 24.19 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.234 -0.916 . . . . 0.0 109.47 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 9.0 p -171.16 151.75 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.328 -0.858 . . . . 0.0 109.403 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 31.4 t -170.78 170.2 6.64 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.257 -0.902 . . . . 0.0 109.398 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 81.1 p -169.36 89.73 0.2 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.257 -0.902 . . . . 0.0 109.471 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 14.0 m 52.73 62.55 2.63 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.262 -0.899 . . . . 0.0 109.504 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -75.43 -30.67 60.1 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.266 -0.896 . . . . 0.0 109.527 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 24.0 p -77.11 161.23 28.42 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.243 -0.911 . . . . 0.0 109.4 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.428 ' O ' ' O ' ' A' ' 155' ' ' ASN . 38.8 t -72.51 -74.77 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.252 -0.905 . . . . 0.0 109.466 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . 0.428 ' O ' ' O ' ' A' ' 154' ' ' VAL . 10.8 m120 -60.88 -149.74 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.279 -0.888 . . . . 0.0 109.561 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 54.6 mtp180 -148.79 100.96 3.15 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.17 -0.956 . . . . 0.0 109.304 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 65.55 82.32 0.11 Allowed Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -66.32 -98.39 0.02 OUTLIER Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 98.3 p -63.28 164.53 8.76 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.249 -1.147 . . . . 0.0 109.525 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . 0.462 ' O ' ' N ' ' A' ' 162' ' ' GLU . . . -67.13 -39.93 86.67 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.256 -0.902 . . . . 0.0 109.443 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . 0.474 ' C ' ' H ' ' A' ' 163' ' ' SER . 15.8 pt -68.46 56.5 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.281 -0.887 . . . . 0.0 109.483 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.462 ' N ' ' O ' ' A' ' 160' ' ' ALA . 15.3 pt-20 -73.92 39.7 0.11 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.215 -0.928 . . . . 0.0 109.452 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.474 ' H ' ' C ' ' A' ' 161' ' ' ILE . 53.4 p 50.69 77.83 0.12 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.187 -0.946 . . . . 0.0 109.495 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -66.92 90.11 0.17 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.166 -0.959 . . . . 0.0 109.443 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . 0.672 ' HD1' ' H ' ' A' ' 165' ' ' HIS . 16.1 p-80 -71.84 57.14 0.31 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.253 -0.904 . . . . 0.0 109.425 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 51.8 t80 . . . . . 0 N--CA 1.49 1.542 0 CA-C-O 118.04 -0.981 . . . . 0.0 109.501 179.974 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.3 mtm . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 121.292 0.568 . . . . 0.0 109.528 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -66.69 -112.62 0.01 OUTLIER Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.544 -1.423 . . . . 0.0 109.544 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.402 ' O ' ' N ' ' A' ' 5' ' ' ARG . 42.9 p -152.75 178.75 9.29 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.336 -1.096 . . . . 0.0 109.339 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 34.0 m-85 -70.99 49.42 0.13 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.257 -0.902 . . . . 0.0 109.394 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.402 ' N ' ' O ' ' A' ' 3' ' ' THR . 38.4 ttm180 -71.24 -12.7 61.6 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.152 -0.967 . . . . 0.0 109.445 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -59.3 -84.6 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.247 -0.908 . . . . 0.0 109.296 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.545 ' CD ' ' H ' ' A' ' 7' ' ' GLU . 1.1 pm0 -71.51 80.03 0.79 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.232 -0.918 . . . . 0.0 109.192 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -88.42 -70.44 1.27 Allowed Glycine 0 N--CA 1.494 2.527 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.9 t -172.87 -79.05 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.276 -1.132 . . . . 0.0 109.378 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.7 p -171.54 138.24 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.244 -0.91 . . . . 0.0 109.449 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.9 t -171.05 149.8 2.96 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.181 -0.949 . . . . 0.0 109.553 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.8 t -71.08 -74.69 0.14 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.243 -0.911 . . . . 0.0 109.534 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -171.3 141.81 6.66 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 75.1 p -72.04 -86.62 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.123 -1.222 . . . . 0.0 109.445 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 61.3 tttm -168.95 75.06 0.1 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.209 -0.932 . . . . 0.0 109.548 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.444 ' CD ' ' N ' ' A' ' 16' ' ' GLN . 3.1 mp0 -73.23 86.85 1.44 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.252 -0.905 . . . . 0.0 109.519 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -67.67 -31.55 71.61 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.292 -0.88 . . . . 0.0 109.397 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 80.9 t80 -72.58 154.49 40.76 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.195 -0.941 . . . . 0.0 109.451 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 77.8 m-70 -58.84 148.68 29.1 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.252 -0.905 . . . . 0.0 109.461 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 60.9 m -62.48 -34.08 76.14 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.237 -0.914 . . . . 0.0 109.443 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.426 ' O ' ' O ' ' A' ' 22' ' ' LYS . . . 69.01 5.55 48.05 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.426 ' O ' ' O ' ' A' ' 21' ' ' GLY . 33.6 ttpt 54.5 172.23 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.208 -1.172 . . . . 0.0 109.283 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.526 ' CD2' ' N ' ' A' ' 23' ' ' LEU . 3.5 mm? -81.76 158.85 24.0 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.236 -0.915 . . . . 0.0 109.049 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.407 ' O ' ' O ' ' A' ' 25' ' ' THR . 4.8 t 58.95 95.42 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.4 -0.813 . . . . 0.0 109.385 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.407 ' O ' ' O ' ' A' ' 24' ' ' VAL . 61.3 p -50.71 178.27 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.32 -0.863 . . . . 0.0 109.598 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.484 ' C ' ' H ' ' A' ' 28' ' ' GLY . 70.3 p -68.94 155.34 40.48 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.273 -0.892 . . . . 0.0 109.543 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.462 ' O ' ' N ' ' A' ' 29' ' ' ASP . 52.6 tttm -76.3 33.55 0.13 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.225 -0.922 . . . . 0.0 109.182 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.484 ' H ' ' C ' ' A' ' 26' ' ' THR . . . 68.12 -61.45 0.38 Allowed Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.462 ' N ' ' O ' ' A' ' 27' ' ' LYS . 70.3 m-20 -55.83 99.35 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.165 -1.197 . . . . 0.0 109.52 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.7 tttm -171.09 150.32 3.02 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.242 -0.912 . . . . 0.0 109.472 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.45 ' N ' ' CD ' ' A' ' 31' ' ' GLU . 13.9 mp0 -74.25 89.62 2.05 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.281 -0.887 . . . . 0.0 109.424 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 14.6 mt -78.4 -1.07 31.69 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.219 -0.926 . . . . 0.0 109.449 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 11.3 tp -170.87 148.33 2.85 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.233 -0.917 . . . . 0.0 109.303 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 75.5 mt -132.33 102.24 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.461 -0.774 . . . . 0.0 109.172 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -67.72 -160.5 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.277 -0.889 . . . . 0.0 109.491 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -169.55 -39.7 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.315 -0.866 . . . . 0.0 109.346 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -169.21 145.6 3.4 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.204 -0.935 . . . . 0.0 109.379 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 27.0 mtmm -153.27 -47.6 0.1 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.224 -0.923 . . . . 0.0 109.347 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.8 p -170.11 157.96 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.234 -0.916 . . . . 0.0 109.508 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 43.8 p -59.54 -160.28 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.252 -0.905 . . . . 0.0 109.43 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 81.0 p -164.5 -15.36 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.278 -0.889 . . . . 0.0 109.429 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -177.82 149.77 9.48 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.417 -1.473 . . . . 0.0 109.417 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.422 ' O ' ' OG1' ' A' ' 44' ' ' THR . 8.1 p80 -174.58 172.54 3.06 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.214 -1.168 . . . . 0.0 109.425 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.422 ' OG1' ' O ' ' A' ' 43' ' ' HIS . 25.9 p 49.91 -134.68 1.42 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.278 -0.889 . . . . 0.0 109.556 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.428 ' O ' ' O ' ' A' ' 46' ' ' THR . 80.6 p 43.47 -155.73 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.454 -0.779 . . . . 0.0 110.085 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.478 ' O ' ' N ' ' A' ' 48' ' ' ARG . 7.4 p 55.29 107.71 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.427 -0.796 . . . . 0.0 109.813 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 77.2 p -66.21 69.67 0.06 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.151 -0.968 . . . . 0.0 109.485 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.478 ' N ' ' O ' ' A' ' 46' ' ' THR . 44.7 mtp180 -141.97 143.04 33.02 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.308 -0.87 . . . . 0.0 109.155 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.558 ' CG ' HH11 ' A' ' 49' ' ' ARG . 0.4 OUTLIER -94.35 131.15 40.29 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.177 -0.952 . . . . 0.0 109.995 -179.772 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.446 ' O ' ' O ' ' A' ' 51' ' ' CYS . 31.0 m -70.45 -55.67 8.46 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.261 -0.899 . . . . 0.0 110.217 -179.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.446 ' O ' ' O ' ' A' ' 50' ' ' SER . 45.8 t -56.69 -107.88 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.214 -0.929 . . . . 0.0 109.346 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.3 t -51.06 165.89 0.11 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.867 -1.146 . . . . 0.0 108.469 179.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 16.4 mmmt -107.53 99.68 9.16 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.268 -0.895 . . . . 0.0 109.524 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.475 ' O ' ' CG1' ' A' ' 54' ' ' VAL . 9.6 p -129.28 115.79 37.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 179.301 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.9 mm -127.11 118.43 50.16 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.0 m -129.4 112.41 13.79 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.424 -0.797 . . . . 0.0 109.068 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.54 ' N ' ' OG1' ' A' ' 69' ' ' THR . 17.3 mttp -123.1 113.39 18.93 Favored 'General case' 0 N--CA 1.514 2.759 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 178.568 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 58.1 m -114.84 127.05 55.49 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.469 -0.769 . . . . 0.0 109.521 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.405 ' O ' ' CG2' ' A' ' 59' ' ' VAL . 2.8 m -131.56 123.84 53.17 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.144 0 O-C-N 121.486 -0.759 . . . . 0.0 109.051 179.081 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 73.2 p -108.37 120.61 42.9 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.703 -0.623 . . . . 0.0 110.006 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.545 ' N ' ' OD1' ' A' ' 61' ' ' ASN . 0.7 OUTLIER -108.53 144.16 36.56 Favored 'General case' 0 N--CA 1.512 2.675 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.692 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.462 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -66.66 -31.08 71.52 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 119.949 -1.719 . . . . 0.0 112.474 -177.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.433 ' OD1' ' N ' ' A' ' 63' ' ' ASP . 16.1 p-10 -66.96 3.58 1.06 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.295 -1.503 . . . . 0.0 109.798 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.462 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 94.61 5.34 61.61 Favored Glycine 0 N--CA 1.497 2.719 0 N-CA-C 110.586 -1.006 . . . . 0.0 110.586 178.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.429 ' O ' ' OD1' ' A' ' 61' ' ' ASN . 63.0 ttt180 -92.3 109.5 20.88 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.608 -1.525 . . . . 0.0 108.086 178.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 17.6 p -134.19 112.5 11.15 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.31 -0.869 . . . . 0.0 109.48 -179.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -94.35 130.9 40.48 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.326 -0.859 . . . . 0.0 109.827 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.494 ' O ' ' CG2' ' A' ' 68' ' ' THR . 1.1 t -111.52 110.33 20.7 Favored 'General case' 0 N--CA 1.5 2.052 0 CA-C-O 122.013 0.911 . . . . 0.0 109.525 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.54 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 68.4 p -110.68 28.65 8.47 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 179.727 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 18.4 mtmm -65.68 63.28 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.527 ' N ' ' O ' ' A' ' 69' ' ' THR . 56.5 mt-10 -102.23 140.83 35.99 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.447 -0.783 . . . . 0.0 109.502 -179.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.9 m -127.78 136.29 60.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 179.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 13.2 t -129.79 116.51 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 CA-C-O 121.863 0.839 . . . . 0.0 109.077 179.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -53.58 177.2 0.03 OUTLIER 'General case' 0 C--N 1.287 -2.115 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.509 ' C ' ' H ' ' A' ' 77' ' ' ASP . 93.7 p -69.36 123.95 22.57 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.207 -0.933 . . . . 0.0 109.476 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -73.67 20.09 0.1 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.303 -0.873 . . . . 0.0 109.482 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.509 ' H ' ' C ' ' A' ' 75' ' ' SER . 34.1 t70 -165.31 -46.52 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.256 -0.902 . . . . 0.0 109.317 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 83.11 53.43 3.48 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.494 -1.443 . . . . 0.0 109.494 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 95.7 p -64.49 -33.13 75.18 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.258 -1.142 . . . . 0.0 109.505 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -168.57 24.91 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.248 -0.907 . . . . 0.0 109.554 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 59.1 m -126.73 18.77 7.32 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.558 -0.714 . . . . 0.0 109.342 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -161.25 16.29 0.17 Allowed Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.707 -1.357 . . . . 0.0 109.707 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -157.62 141.31 15.71 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.249 -1.148 . . . . 0.0 109.476 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -171.12 54.26 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.343 -0.848 . . . . 0.0 109.497 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -171.06 69.63 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.257 -0.902 . . . . 0.0 109.431 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -57.06 106.11 0.28 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.303 -0.873 . . . . 0.0 109.518 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.52 ' CG ' ' H ' ' A' ' 88' ' ' TRP . 19.0 t70 -167.06 -172.43 2.04 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.209 -0.932 . . . . 0.0 109.599 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . 0.52 ' H ' ' CG ' ' A' ' 87' ' ' ASP . 1.8 t-105 -73.09 111.21 7.99 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.276 -0.89 . . . . 0.0 109.218 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -162.31 75.48 0.44 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.2 -0.937 . . . . 0.0 109.519 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -171.64 60.7 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.377 -0.827 . . . . 0.0 109.477 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 71.3 p -148.23 -151.25 0.38 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.249 -0.907 . . . . 0.0 109.284 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.564 ' C ' ' H ' ' A' ' 94' ' ' SER . 45.3 t80 53.52 70.17 1.91 Allowed Pre-proline 0 N--CA 1.49 1.528 0 O-C-N 121.208 -0.933 . . . . 0.0 109.647 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.512 ' C ' ' H ' ' A' ' 95' ' ' ARG . 1.4 Cg_endo -67.11 29.46 0.12 Allowed 'Trans proline' 0 C--N 1.316 -1.132 0 C-N-CA 121.601 1.534 . . . . 0.0 110.385 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.564 ' H ' ' C ' ' A' ' 92' ' ' PHE . 8.4 t 55.29 5.27 0.11 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.001 -1.062 . . . . 0.0 109.628 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.512 ' H ' ' C ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -91.57 120.06 32.03 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.248 -0.907 . . . . 0.0 109.262 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -171.69 94.03 0.1 Allowed Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.444 ' OD1' ' N ' ' A' ' 98' ' ' LEU . 46.4 t30 -75.06 164.54 26.42 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.335 -1.097 . . . . 0.0 109.525 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.444 ' N ' ' OD1' ' A' ' 97' ' ' ASN . 23.3 tp -65.41 126.81 29.42 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.268 -0.895 . . . . 0.0 109.242 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -157.03 141.92 16.98 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.214 -0.929 . . . . 0.0 109.529 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -172.45 -10.22 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.231 -0.918 . . . . 0.0 109.52 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 51.2 p90 -66.3 -19.83 65.93 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.254 -0.904 . . . . 0.0 109.476 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -64.87 -25.24 67.81 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.171 -0.956 . . . . 0.0 109.496 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.444 ' O ' ' O ' ' A' ' 104' ' ' ARG . 56.2 t-80 -65.92 -22.81 66.52 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.275 -0.891 . . . . 0.0 109.486 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.444 ' O ' ' O ' ' A' ' 103' ' ' HIS . 34.8 ttp180 61.08 133.14 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.566 -0.709 . . . . 0.0 109.705 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -157.58 -33.07 0.08 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.259 -0.901 . . . . 0.0 109.372 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -65.17 141.18 58.76 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.212 -0.93 . . . . 0.0 109.42 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -169.87 39.41 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.226 -0.921 . . . . 0.0 109.511 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 53.2 41.11 32.15 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.29 -0.881 . . . . 0.0 109.516 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -71.75 -40.51 69.31 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.266 -0.896 . . . . 0.0 109.475 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . 0.429 ' O ' ' O ' ' A' ' 111' ' ' THR . 71.6 t80 -171.35 -23.52 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.352 -0.842 . . . . 0.0 109.295 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' THR . . . . . 0.429 ' O ' ' O ' ' A' ' 110' ' ' PHE . 3.8 m 61.81 132.48 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.549 -0.719 . . . . 0.0 109.519 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 42.6 ttm180 -68.19 92.69 0.41 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.317 -0.864 . . . . 0.0 109.468 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 48.2 t -74.5 -149.85 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.269 -0.894 . . . . 0.0 109.416 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 80.0 p -171.55 12.93 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.251 -0.906 . . . . 0.0 109.422 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 21.7 t60 -70.4 156.69 39.0 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.221 -0.925 . . . . 0.0 109.403 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -72.64 158.67 35.21 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.203 -0.936 . . . . 0.0 109.51 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.508 ' O ' ' N ' ' A' ' 119' ' ' GLY . 61.5 t80 -74.11 -39.97 63.01 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.261 -0.899 . . . . 0.0 109.454 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 30.3 t0 -54.82 87.48 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.295 -0.878 . . . . 0.0 109.431 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.508 ' N ' ' O ' ' A' ' 117' ' ' PHE . . . -77.9 -87.72 0.41 Allowed Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 -179.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.408 ' O ' ' OG1' ' A' ' 121' ' ' THR . 53.1 mtp180 -144.3 -90.98 0.11 Allowed 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.145 -1.209 . . . . 0.0 109.309 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.408 ' OG1' ' O ' ' A' ' 120' ' ' ARG . 71.9 m -166.06 -77.27 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.227 -0.92 . . . . 0.0 109.483 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 164.99 -179.61 39.51 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.454 -1.459 . . . . 0.0 109.454 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.511 ' CD1' ' N ' ' A' ' 123' ' ' LEU . 7.9 mp -67.06 130.99 44.92 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.228 -1.16 . . . . 0.0 109.266 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -72.24 162.36 74.16 Favored Pre-proline 0 N--CA 1.49 1.545 0 O-C-N 121.192 -0.943 . . . . 0.0 108.862 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -56.47 148.42 62.99 Favored 'Trans proline' 0 C--N 1.319 -0.985 0 C-N-CA 121.317 1.345 . . . . 0.0 109.721 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.432 ' O ' ' O ' ' A' ' 127' ' ' PHE . 38.4 tt0 -77.33 50.84 0.81 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.288 -0.882 . . . . 0.0 109.364 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . 0.432 ' O ' ' O ' ' A' ' 126' ' ' GLU . 32.9 t80 60.06 121.99 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.438 -0.789 . . . . 0.0 109.727 -179.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -162.97 43.05 0.12 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.216 -0.928 . . . . 0.0 109.365 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -63.99 -155.29 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.318 -0.864 . . . . 0.0 109.503 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.459 ' CD1' ' N ' ' A' ' 130' ' ' LEU . 9.7 mp -55.6 -15.99 3.54 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.238 -0.914 . . . . 0.0 109.201 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 82.73 -100.39 2.18 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 52.21 -113.25 0.73 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.268 -1.136 . . . . 0.0 109.43 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 97.3 p -77.71 -152.83 0.05 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.184 -0.948 . . . . 0.0 109.468 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 177.14 25.38 0.03 OUTLIER Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 13.4 m 52.77 77.54 0.16 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.176 -1.19 . . . . 0.0 109.51 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 29.6 t -171.26 0.19 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.242 -0.911 . . . . 0.0 109.491 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 78.3 p -169.1 102.86 0.37 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.232 -0.917 . . . . 0.0 109.505 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' SER . . . . . 0.483 ' HG ' ' N ' ' A' ' 139' ' ' LYS . 92.2 p -73.09 -129.15 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.202 -0.936 . . . . 0.0 109.398 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.483 ' N ' ' HG ' ' A' ' 138' ' ' SER . 43.9 mtmt -58.42 113.05 1.79 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.164 -0.96 . . . . 0.0 109.494 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 67.4 p -78.74 37.08 0.28 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.264 -0.897 . . . . 0.0 109.467 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' SER . . . . . 0.42 ' H ' ' C ' ' A' ' 139' ' ' LYS . 29.3 t -169.59 98.41 0.32 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.251 -0.905 . . . . 0.0 109.511 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' THR . . . . . 0.523 ' O ' ' CG ' ' A' ' 143' ' ' HIS . 58.2 p -78.28 -172.75 2.95 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.282 -0.886 . . . . 0.0 109.495 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . 0.523 ' CG ' ' O ' ' A' ' 142' ' ' THR . 78.4 m80 -158.14 -58.26 0.08 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.318 -0.864 . . . . 0.0 109.359 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' SER . . . . . 0.405 ' O ' ' O ' ' A' ' 143' ' ' HIS . 11.1 t 53.82 100.44 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.322 -0.861 . . . . 0.0 109.503 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . 0.499 ' C ' ' H ' ' A' ' 147' ' ' PHE . 79.3 tttt -61.84 -86.14 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.273 -0.892 . . . . 0.0 109.368 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 59.0 1.82 0.22 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.256 -0.902 . . . . 0.0 109.563 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . 0.499 ' H ' ' C ' ' A' ' 145' ' ' LYS . 60.4 t80 -57.31 124.21 18.07 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.111 -0.993 . . . . 0.0 109.47 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 37.1 t -70.07 86.54 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.241 -0.912 . . . . 0.0 109.506 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 98.0 p -70.87 109.52 5.07 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.286 -0.883 . . . . 0.0 109.462 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 62.3 m -68.09 102.57 1.35 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.29 -0.881 . . . . 0.0 109.424 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 68.6 p -169.56 -76.56 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.237 -0.914 . . . . 0.0 109.419 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' THR . . . . . 0.411 ' O ' ' OG1' ' A' ' 153' ' ' THR . 6.9 t -75.76 -30.08 59.04 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.258 -0.901 . . . . 0.0 109.461 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' THR . . . . . 0.411 ' OG1' ' O ' ' A' ' 152' ' ' THR . 9.4 p 52.75 177.63 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.247 -0.908 . . . . 0.0 109.524 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 8.2 p -78.94 -31.43 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.206 -0.934 . . . . 0.0 109.533 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . 0.43 ' O ' ' O ' ' A' ' 156' ' ' ARG . 49.1 p30 -165.83 177.36 7.23 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.202 -0.936 . . . . 0.0 109.51 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . 0.43 ' O ' ' O ' ' A' ' 155' ' ' ASN . 35.6 ttm180 58.89 155.06 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.366 -0.834 . . . . 0.0 109.662 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -81.26 -161.0 26.06 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 171.55 173.95 38.84 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 10.0 t 51.55 -125.69 2.35 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.246 -1.149 . . . . 0.0 109.347 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -150.33 134.72 17.22 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.133 -0.979 . . . . 0.0 109.375 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . 0.415 ' O ' ' O ' ' A' ' 162' ' ' GLU . 16.6 tt -168.92 162.18 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.237 -0.915 . . . . 0.0 109.346 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.415 ' O ' ' O ' ' A' ' 161' ' ' ILE . 63.9 mt-10 -58.81 -158.58 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.277 -0.889 . . . . 0.0 109.503 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 41.6 m -156.02 147.58 22.81 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.253 -0.905 . . . . 0.0 109.381 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.51 91.08 8.55 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.202 -0.936 . . . . 0.0 109.408 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . 0.611 ' N ' ' HD1' ' A' ' 165' ' ' HIS . 0.9 OUTLIER -65.55 133.65 51.67 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.231 -0.918 . . . . 0.0 109.4 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 118.071 -0.966 . . . . 0.0 109.448 -179.938 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 8.9 tpt . . . . . 0 N--CA 1.491 1.596 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -71.93 130.24 16.7 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.7 t -169.66 -34.73 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.274 -1.133 . . . . 0.0 109.532 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 50.8 -101.71 0.1 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.213 -0.929 . . . . 0.0 109.458 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -168.47 46.26 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.224 -0.923 . . . . 0.0 109.492 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 52.2 -168.75 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.233 -0.917 . . . . 0.0 109.521 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 52.7 tt0 -66.51 -61.63 1.89 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.319 -0.863 . . . . 0.0 109.561 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 69.8 64.81 2.78 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.445 -1.462 . . . . 0.0 109.445 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.4 m -67.78 -51.85 44.04 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.249 -1.147 . . . . 0.0 109.504 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 41.4 t -147.98 156.84 9.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.266 -0.896 . . . . 0.0 109.35 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.402 ' OG ' ' N ' ' A' ' 12' ' ' SER . 79.1 p -164.53 -94.69 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.191 -0.943 . . . . 0.0 109.487 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.402 ' N ' ' OG ' ' A' ' 11' ' ' SER . 35.3 t -68.61 -22.92 64.41 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.308 -0.87 . . . . 0.0 109.389 179.855 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 62.94 67.92 1.87 Allowed Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 73.5 p -150.17 -16.63 0.25 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.271 -1.134 . . . . 0.0 109.243 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 89.0 mttt 50.51 67.2 0.96 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.252 -0.905 . . . . 0.0 109.407 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -69.8 179.64 2.14 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.27 -0.894 . . . . 0.0 109.54 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -77.48 -27.39 51.96 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.277 -0.889 . . . . 0.0 109.516 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 48.77 75.07 0.15 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.262 -0.899 . . . . 0.0 109.571 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 62.6 t-80 -170.54 -73.67 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.277 -0.889 . . . . 0.0 109.499 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 63.7 p -68.0 121.83 16.93 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.227 -0.921 . . . . 0.0 109.454 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.44 ' C ' ' H ' ' A' ' 23' ' ' LEU . . . -179.76 -155.41 15.22 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 179.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.412 ' O ' ' N ' ' A' ' 24' ' ' VAL . 44.4 mtmt -60.36 -5.39 1.13 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.2 -1.176 . . . . 0.0 109.433 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.44 ' H ' ' C ' ' A' ' 21' ' ' GLY . 16.3 mt -69.5 69.5 0.26 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.208 -0.932 . . . . 0.0 109.523 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.428 ' O ' ' O ' ' A' ' 25' ' ' THR . 34.0 m -150.71 -45.36 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 121.28 -0.887 . . . . 0.0 109.354 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.428 ' O ' ' O ' ' A' ' 24' ' ' VAL . 40.7 p 46.82 94.06 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.248 -0.907 . . . . 0.0 109.847 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.8 t -168.87 141.15 2.68 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.146 -0.971 . . . . 0.0 109.673 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 51.4 tttp -55.23 170.2 0.22 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.356 -0.84 . . . . 0.0 109.033 179.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -67.1 -17.96 68.5 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.249 -1.541 . . . . 0.0 109.249 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -64.42 100.11 0.34 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.26 -1.141 . . . . 0.0 109.383 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 33.1 ttmt -66.76 -65.61 0.66 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.29 -0.881 . . . . 0.0 109.48 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 80.5 mt-10 -59.32 115.65 3.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.232 -0.917 . . . . 0.0 109.422 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 11.5 tp -68.74 -40.96 79.57 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.224 -0.923 . . . . 0.0 109.271 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 16.8 mt -76.67 147.39 37.5 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.353 -0.842 . . . . 0.0 109.357 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.428 ' O ' ' O ' ' A' ' 35' ' ' ASP . 84.1 mt -69.2 -92.63 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.159 -0.963 . . . . 0.0 109.537 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.428 ' O ' ' O ' ' A' ' 34' ' ' ILE . 2.9 m-20 60.27 147.65 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.334 -0.854 . . . . 0.0 109.644 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -159.3 88.67 0.88 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.18 -0.95 . . . . 0.0 109.428 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.434 ' N ' ' CD ' ' A' ' 37' ' ' GLU . 1.9 mp0 -64.69 -14.06 56.87 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.231 -0.918 . . . . 0.0 109.471 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.8 mtpp -67.12 -120.89 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.228 -0.92 . . . . 0.0 109.492 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.9 t 52.68 88.19 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.143 -0.973 . . . . 0.0 109.409 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 81.6 p -73.38 -14.52 61.29 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.21 -0.932 . . . . 0.0 109.51 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 41.5 m 52.13 -111.21 0.56 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.274 -0.891 . . . . 0.0 109.453 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 179.36 16.33 0.03 OUTLIER Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 52.87 23.64 2.92 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.279 -1.13 . . . . 0.0 109.526 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.43 ' O ' ' O ' ' A' ' 45' ' ' THR . 10.8 m -70.71 60.76 0.23 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.335 -0.853 . . . . 0.0 109.493 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.43 ' O ' ' O ' ' A' ' 44' ' ' THR . 4.8 p 55.9 166.01 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.335 -0.853 . . . . 0.0 109.576 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.9 117.48 29.54 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.216 -0.927 . . . . 0.0 109.486 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 34.3 m -66.26 -49.44 67.13 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.216 -0.928 . . . . 0.0 109.298 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.568 ' CG ' HH11 ' A' ' 48' ' ' ARG . 3.4 mtt-85 -112.42 143.54 43.37 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -111.45 127.6 55.74 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.448 -0.782 . . . . 0.0 109.721 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.444 ' O ' ' O ' ' A' ' 51' ' ' CYS . 50.7 m -63.55 -52.66 60.15 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.215 -0.928 . . . . 0.0 109.862 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.444 ' O ' ' O ' ' A' ' 50' ' ' SER . 36.8 t -48.01 -93.85 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.147 -0.971 . . . . 0.0 109.187 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 11.3 t -63.09 138.29 58.51 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.053 -1.029 . . . . 0.0 108.369 179.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -73.06 104.81 4.27 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 120.918 -1.114 . . . . 0.0 109.543 -179.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 21.1 t -125.12 116.19 46.28 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 41.5 mm -126.64 121.6 58.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 22.8 m -128.17 110.59 12.58 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.445 -0.784 . . . . 0.0 109.193 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.41 ' H ' ' HB ' ' A' ' 69' ' ' THR . 7.3 mtmt -124.9 113.91 18.48 Favored 'General case' 0 N--CA 1.511 2.624 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 178.435 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 59.0 p -114.31 132.43 56.18 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.551 -0.718 . . . . 0.0 109.776 -179.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.4 ' O ' ' CG2' ' A' ' 59' ' ' VAL . 2.8 m -131.58 122.79 50.98 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.156 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 65.2 p -107.41 122.96 47.66 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.731 -0.605 . . . . 0.0 110.015 -179.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.444 ' ND2' ' O ' ' A' ' 65' ' ' ARG . 3.4 m-20 -113.2 145.16 41.46 Favored 'General case' 0 N--CA 1.511 2.61 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 179.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.435 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -70.59 -28.33 64.78 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 119.956 -1.715 . . . . 0.0 112.319 -177.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -67.33 2.38 1.7 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.536 -1.353 . . . . 0.0 109.827 -178.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.435 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 96.25 7.27 58.4 Favored Glycine 0 N--CA 1.496 2.681 0 N-CA-C 110.519 -1.032 . . . . 0.0 110.519 178.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.444 ' O ' ' ND2' ' A' ' 61' ' ' ASN . 16.0 mmm180 -95.98 109.46 21.84 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.876 -1.367 . . . . 0.0 108.344 179.058 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.7 p -134.67 109.24 8.49 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.347 -0.846 . . . . 0.0 109.336 -179.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -96.8 132.02 42.94 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.28 -0.887 . . . . 0.0 110.221 -179.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 81.1 m -108.82 107.25 17.6 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.468 -0.77 . . . . 0.0 109.495 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.41 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 6.3 m -94.31 32.29 1.57 Allowed 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 178.626 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.0 tttm -73.54 68.83 1.19 Allowed 'General case' 0 N--CA 1.504 2.249 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -107.5 147.44 30.5 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.529 -0.732 . . . . 0.0 109.598 -179.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 38.6 t -128.08 125.99 65.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 20.5 t -128.19 116.06 40.81 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 CA-C-O 122.238 1.018 . . . . 0.0 109.351 179.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.491 ' O ' ' N ' ' A' ' 78' ' ' GLY . 1.1 ptpp? -76.77 41.57 0.27 Allowed 'General case' 0 C--N 1.287 -2.115 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.593 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.422 ' OG ' ' O ' ' A' ' 74' ' ' LYS . 11.4 p 55.9 -146.54 0.56 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.123 -0.985 . . . . 0.0 109.502 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.405 ' H ' ' HG ' ' A' ' 75' ' ' SER . 71.9 mt-10 -69.71 -35.17 74.82 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.249 -0.907 . . . . 0.0 109.286 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -171.46 34.98 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.299 -0.875 . . . . 0.0 109.086 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.491 ' N ' ' O ' ' A' ' 74' ' ' LYS . . . 54.6 67.64 2.08 Favored Glycine 0 N--CA 1.489 2.205 0 N-CA-C 109.327 -1.509 . . . . 0.0 109.327 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 71.8 m -47.88 -90.6 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.28 -1.129 . . . . 0.0 109.561 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 38.4 t0 -83.62 27.16 0.63 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.244 -0.91 . . . . 0.0 109.542 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 66.0 m -150.76 32.29 0.62 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.24 -0.912 . . . . 0.0 109.833 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.502 ' C ' ' H ' ' A' ' 84' ' ' ALA . . . -169.2 -59.41 0.03 OUTLIER Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.81 -1.316 . . . . 0.0 109.81 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 6.9 t70 66.5 -41.21 0.38 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.485 -1.009 . . . . 0.0 109.635 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.502 ' H ' ' C ' ' A' ' 82' ' ' GLY . . . -159.36 173.91 15.54 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.094 -1.004 . . . . 0.0 109.471 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.53 ' O ' ' N ' ' A' ' 87' ' ' ASP . 26.6 t70 -167.07 6.29 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.304 -0.873 . . . . 0.0 109.516 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.487 ' O ' ' N ' ' A' ' 88' ' ' TRP . 2.8 m-85 64.73 -67.64 0.11 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.369 -0.832 . . . . 0.0 109.567 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.53 ' N ' ' O ' ' A' ' 85' ' ' ASP . 2.9 p30 42.44 22.23 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.564 -0.71 . . . . 0.0 110.311 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . 0.487 ' N ' ' O ' ' A' ' 86' ' ' PHE . 6.7 m0 -91.73 -52.93 4.51 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.143 -0.973 . . . . 0.0 109.307 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 61.7 t60 -81.97 138.19 34.99 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.243 -0.911 . . . . 0.0 109.453 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.582 ' ND1' ' N ' ' A' ' 91' ' ' THR . 11.1 p80 -173.53 -52.44 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.293 -0.88 . . . . 0.0 109.536 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.582 ' N ' ' ND1' ' A' ' 90' ' ' HIS . 5.6 t -80.24 -130.23 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.267 -0.896 . . . . 0.0 109.657 -179.751 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.429 ' N ' ' OG1' ' A' ' 91' ' ' THR . 95.7 m-85 -155.14 77.06 5.04 Favored Pre-proline 0 N--CA 1.494 1.727 0 O-C-N 121.195 -0.941 . . . . 0.0 109.609 -179.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.422 ' O ' ' OG ' ' A' ' 94' ' ' SER . 3.0 Cg_exo -64.87 -50.1 2.5 Favored 'Trans proline' 0 C--N 1.319 -1.007 0 C-N-CA 121.337 1.358 . . . . 0.0 109.746 -179.63 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.422 ' OG ' ' O ' ' A' ' 93' ' ' PRO . 23.1 p 53.97 -153.43 0.28 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.347 -0.845 . . . . 0.0 109.535 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 52.4 mtp180 -151.32 -46.08 0.11 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.226 -0.921 . . . . 0.0 109.329 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -179.7 120.96 0.71 Allowed Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.452 -1.459 . . . . 0.0 109.452 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -170.83 51.45 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.29 -1.124 . . . . 0.0 109.478 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.527 ' CD1' ' N ' ' A' ' 98' ' ' LEU . 7.8 mp -71.11 -111.47 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.33 -0.856 . . . . 0.0 109.251 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.436 ' O ' ' O ' ' A' ' 100' ' ' ASP . 73.1 m-20 -80.03 -108.12 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.219 -0.926 . . . . 0.0 109.406 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.436 ' O ' ' O ' ' A' ' 99' ' ' ASP . 7.8 m-20 58.12 111.26 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.298 -0.876 . . . . 0.0 109.603 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -59.42 -20.38 54.58 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.247 -0.908 . . . . 0.0 109.359 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -143.91 125.71 15.17 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.277 -0.89 . . . . 0.0 109.391 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 46.0 m-70 -58.85 -46.57 87.43 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.269 -0.894 . . . . 0.0 109.407 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 78.9 mtm180 -64.4 176.5 1.06 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.302 -0.874 . . . . 0.0 109.511 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -169.58 121.91 0.72 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.319 -0.863 . . . . 0.0 109.319 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.466 ' NZ ' ' CB ' ' A' ' 106' ' ' LYS . 0.3 OUTLIER -65.92 133.25 50.48 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.246 -0.909 . . . . 0.0 109.414 179.952 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -78.95 86.38 4.83 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.207 -0.933 . . . . 0.0 109.443 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -167.35 65.61 0.08 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.198 -0.939 . . . . 0.0 109.529 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -65.16 -49.27 70.5 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.223 -0.923 . . . . 0.0 109.432 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . 0.49 ' CG ' ' N ' ' A' ' 111' ' ' THR . 37.5 t80 -127.81 -170.82 2.3 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.516 -0.74 . . . . 0.0 109.221 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' THR . . . . . 0.49 ' N ' ' CG ' ' A' ' 110' ' ' PHE . 78.0 p -48.43 113.87 0.84 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.156 -0.965 . . . . 0.0 109.542 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -69.75 -165.45 0.09 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.238 -0.914 . . . . 0.0 109.483 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 68.5 m -64.72 -83.57 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.219 -0.925 . . . . 0.0 109.44 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 13.5 t 52.63 51.55 15.83 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.238 -0.914 . . . . 0.0 109.468 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 63.5 t60 -64.4 148.19 51.0 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.335 -0.853 . . . . 0.0 109.412 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -167.28 -126.59 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.218 -0.926 . . . . 0.0 109.292 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 30.2 p90 -173.11 154.06 2.67 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.185 -0.947 . . . . 0.0 109.513 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -157.79 -88.27 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.259 -0.901 . . . . 0.0 109.392 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -46.23 148.53 2.25 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.865 -1.294 . . . . 0.0 109.865 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.427 ' O ' ' OG1' ' A' ' 121' ' ' THR . 15.6 ptm180 -160.84 -38.56 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.279 -1.13 . . . . 0.0 109.569 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.427 ' OG1' ' O ' ' A' ' 120' ' ' ARG . 7.1 p 54.31 -169.34 0.06 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.187 -0.946 . . . . 0.0 109.511 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -161.16 -38.18 0.02 OUTLIER Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.528 ' CD1' ' N ' ' A' ' 123' ' ' LEU . 7.7 mp -80.57 147.37 30.81 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.179 -1.189 . . . . 0.0 109.221 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -68.44 162.15 64.09 Favored Pre-proline 0 N--CA 1.49 1.571 0 O-C-N 121.294 -0.879 . . . . 0.0 108.836 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -57.11 -61.23 0.33 Allowed 'Trans proline' 0 C--N 1.319 -0.99 0 C-N-CA 121.372 1.381 . . . . 0.0 109.726 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.526 ' CD ' ' H ' ' A' ' 126' ' ' GLU . 13.4 mp0 -52.01 127.9 22.79 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.374 -0.829 . . . . 0.0 109.621 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . 0.522 ' O ' ' N ' ' A' ' 129' ' ' ALA . 95.6 m-85 -79.12 135.62 36.89 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.295 -0.878 . . . . 0.0 109.419 179.9 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.15 71.76 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.186 -0.946 . . . . 0.0 109.468 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.522 ' N ' ' O ' ' A' ' 127' ' ' PHE . . . -79.43 0.68 28.39 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.317 -0.865 . . . . 0.0 109.448 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 11.0 tp -56.22 -48.39 76.56 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.266 -0.896 . . . . 0.0 109.314 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -176.59 177.34 48.02 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -166.08 -77.21 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.333 -1.098 . . . . 0.0 109.364 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 98.7 p -57.0 125.96 25.0 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.161 -0.962 . . . . 0.0 109.422 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -67.79 -148.9 0.16 Allowed Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.509 -1.437 . . . . 0.0 109.509 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 46.6 t -64.51 -30.88 71.91 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.235 -1.156 . . . . 0.0 109.515 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' SER . . . . . 0.498 ' C ' ' H ' ' A' ' 138' ' ' SER . 12.3 m 53.13 70.61 0.57 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.253 -0.904 . . . . 0.0 109.431 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 49.2 m -75.27 34.3 0.11 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.226 -0.921 . . . . 0.0 109.535 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' SER . . . . . 0.498 ' H ' ' C ' ' A' ' 136' ' ' SER . 30.0 t -171.36 142.65 1.72 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.203 -0.936 . . . . 0.0 109.482 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -168.09 -43.98 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.3 -0.875 . . . . 0.0 109.438 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' THR . . . . . 0.429 ' O ' ' O ' ' A' ' 141' ' ' SER . 34.6 m -62.92 -28.91 70.38 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.226 -0.921 . . . . 0.0 109.402 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' SER . . . . . 0.429 ' O ' ' O ' ' A' ' 140' ' ' THR . 2.5 m 59.83 151.74 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.362 -0.836 . . . . 0.0 109.568 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' THR . . . . . 0.429 ' OG1' ' O ' ' A' ' 141' ' ' SER . 5.5 m -166.7 48.48 0.07 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.27 -0.894 . . . . 0.0 109.306 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . 0.506 ' N ' ' HD1' ' A' ' 143' ' ' HIS . 0.0 OUTLIER -80.73 85.38 6.1 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.175 -0.953 . . . . 0.0 109.476 -179.961 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 45.8 m -62.51 -60.96 2.8 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.309 -0.869 . . . . 0.0 109.431 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 11.6 ttmm -170.09 -53.84 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.129 -0.982 . . . . 0.0 109.469 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 36.7 tp60 -170.77 -76.78 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.237 -0.914 . . . . 0.0 109.484 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -82.03 107.0 14.39 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.177 -0.952 . . . . 0.0 109.419 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 39.6 t -75.75 -18.83 15.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.291 -0.88 . . . . 0.0 109.418 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 55.1 m -55.16 -52.99 61.53 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.251 -0.906 . . . . 0.0 109.474 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' SER . . . . . 0.423 ' OG ' ' N ' ' A' ' 151' ' ' SER . 32.0 t -168.43 -171.11 1.38 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.186 -0.946 . . . . 0.0 109.501 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' SER . . . . . 0.423 ' N ' ' OG ' ' A' ' 150' ' ' SER . 66.6 m -165.69 59.77 0.11 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.347 -0.846 . . . . 0.0 109.378 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' THR . . . . . 0.437 ' OG1' ' N ' ' A' ' 153' ' ' THR . 2.0 t -58.97 -174.49 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.239 -0.913 . . . . 0.0 109.352 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' THR . . . . . 0.437 ' N ' ' OG1' ' A' ' 152' ' ' THR . 81.9 p -61.61 150.18 37.0 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.197 -0.94 . . . . 0.0 109.472 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 30.4 m -63.27 -10.95 7.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.279 -0.888 . . . . 0.0 109.443 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -56.7 115.72 2.72 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.251 -0.906 . . . . 0.0 109.482 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . 0.565 ' CG ' HH11 ' A' ' 156' ' ' ARG . 3.4 mtt-85 -66.03 -55.74 15.09 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.231 -0.918 . . . . 0.0 109.366 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -175.59 89.85 0.08 OUTLIER Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.511 -1.435 . . . . 0.0 109.511 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . 0.519 ' C ' ' H ' ' A' ' 160' ' ' ALA . . . -164.08 135.57 3.83 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.514 -1.435 . . . . 0.0 109.514 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 4.9 m 56.58 4.63 0.16 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.255 -1.144 . . . . 0.0 109.533 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . 0.519 ' H ' ' C ' ' A' ' 158' ' ' GLY . . . -86.86 -7.75 57.93 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.194 -0.941 . . . . 0.0 109.549 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 3.5 tp -160.16 -32.15 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.209 -0.932 . . . . 0.0 109.335 -179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -65.43 -34.1 77.5 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.178 -0.951 . . . . 0.0 109.611 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 45.0 t -64.7 170.0 4.52 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.226 -0.921 . . . . 0.0 109.546 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -63.95 141.49 58.75 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.261 -0.899 . . . . 0.0 109.444 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 47.8 m80 -65.51 103.43 0.84 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.206 -0.934 . . . . 0.0 109.456 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 . . . . . 0 N--CA 1.489 1.514 0 CA-C-O 118.036 -0.983 . . . . 0.0 109.509 179.982 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.575 ' N ' ' SD ' ' A' ' 1' ' ' MET . 2.0 mpt? . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 65.81 43.29 94.25 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.524 -1.431 . . . . 0.0 109.524 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 40.5 m -71.15 -21.59 62.16 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.236 -1.156 . . . . 0.0 109.514 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 -61.51 -160.26 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.192 -0.943 . . . . 0.0 109.47 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -168.91 33.35 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.171 -0.956 . . . . 0.0 109.541 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 48.4 tt0 -153.64 -38.14 0.1 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.238 -0.914 . . . . 0.0 109.353 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -69.42 -147.08 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.182 -0.949 . . . . 0.0 109.414 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -173.79 176.05 46.35 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 51.4 m -60.79 113.9 2.74 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.231 -1.158 . . . . 0.0 109.426 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.9 p -65.8 -32.56 58.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.279 -0.888 . . . . 0.0 109.485 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.7 t -171.56 152.81 3.28 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.268 -0.895 . . . . 0.0 109.43 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 91.2 p -66.63 -165.6 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.199 -0.938 . . . . 0.0 109.459 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 65.82 49.7 57.64 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.533 ' O ' ' N ' ' A' ' 16' ' ' GLN . 69.1 p -58.94 160.45 5.93 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.211 -1.17 . . . . 0.0 109.454 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 9.8 ttmm 60.25 -75.4 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.479 -0.763 . . . . 0.0 109.746 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.533 ' N ' ' O ' ' A' ' 14' ' ' THR . 4.7 tp-100 57.21 53.89 7.32 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.278 -0.889 . . . . 0.0 109.46 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -74.64 -28.68 60.97 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.274 -0.891 . . . . 0.0 109.398 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.591 ' CD2' ' N ' ' A' ' 19' ' ' HIS . 54.9 t80 -165.85 170.49 13.78 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.223 -0.923 . . . . 0.0 109.469 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.591 ' N ' ' CD2' ' A' ' 18' ' ' PHE . 41.3 t60 -166.98 124.9 1.3 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.27 -0.894 . . . . 0.0 109.547 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 48.3 m -72.63 153.19 41.36 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.294 -0.879 . . . . 0.0 109.479 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -170.7 125.4 1.22 Allowed Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.484 ' C ' ' H ' ' A' ' 24' ' ' VAL . 15.6 ptpt -172.88 -2.49 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.196 -1.179 . . . . 0.0 109.493 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.499 ' C ' ' H ' ' A' ' 25' ' ' THR . 21.2 mt -72.51 39.75 0.08 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.228 -0.92 . . . . 0.0 109.416 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.484 ' H ' ' C ' ' A' ' 22' ' ' LYS . 29.8 m -71.72 40.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.223 -0.923 . . . . 0.0 109.462 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.499 ' H ' ' C ' ' A' ' 23' ' ' LEU . 1.2 t -69.23 62.32 0.13 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.23 -0.919 . . . . 0.0 109.46 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.416 ' N ' ' O ' ' A' ' 24' ' ' VAL . 37.2 m -57.61 -50.31 73.56 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.241 -0.912 . . . . 0.0 109.398 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -72.77 80.68 1.14 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.28 -0.887 . . . . 0.0 109.391 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.06 76.49 0.06 OUTLIER Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -71.24 -16.47 62.49 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.317 -1.108 . . . . 0.0 109.328 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.489 ' NZ ' ' CB ' ' A' ' 30' ' ' LYS . 9.1 mtmp? -152.97 83.14 1.21 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.326 -0.859 . . . . 0.0 109.18 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 63.4 mt-10 -151.05 39.82 0.7 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.292 -0.88 . . . . 0.0 109.472 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.409 ' CD2' ' H ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -83.68 -3.5 57.81 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.192 -0.943 . . . . 0.0 108.997 179.94 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 26.1 mt 55.65 77.37 0.23 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.311 -0.868 . . . . 0.0 109.547 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 25.0 pt -66.17 -155.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.266 -0.896 . . . . 0.0 109.18 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -61.23 167.26 3.23 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.934 -1.104 . . . . 0.0 109.417 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 32.7 m120 -66.86 143.04 57.1 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.239 -0.913 . . . . 0.0 109.463 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.437 ' N ' ' CD ' ' A' ' 37' ' ' GLU . 3.3 mp0 -71.69 152.47 42.77 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.374 -0.829 . . . . 0.0 109.508 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 45.9 mtmt -72.95 166.72 22.49 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.252 -0.905 . . . . 0.0 109.486 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.0 p -69.79 143.68 14.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.205 -0.934 . . . . 0.0 109.439 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 25.8 m 53.13 95.94 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.26 -0.9 . . . . 0.0 109.413 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 47.8 t -61.45 -170.29 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.28 -0.887 . . . . 0.0 109.474 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 70.19 147.63 0.36 Allowed Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 22.7 t-160 -59.67 106.03 0.43 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.241 -1.153 . . . . 0.0 109.298 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.507 ' OG1' ' N ' ' A' ' 45' ' ' THR . 2.2 t -64.33 -130.87 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.169 -0.957 . . . . 0.0 109.529 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.507 ' N ' ' OG1' ' A' ' 44' ' ' THR . 1.8 t -173.91 -26.94 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.11 -0.994 . . . . 0.0 109.433 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.441 ' C ' ' H ' ' A' ' 48' ' ' ARG . 5.4 t -72.92 39.83 0.09 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.295 -0.878 . . . . 0.0 109.346 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.494 ' H ' ' C ' ' A' ' 45' ' ' THR . 2.6 t -62.55 -3.52 1.5 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.351 -0.843 . . . . 0.0 109.477 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.441 ' H ' ' C ' ' A' ' 46' ' ' THR . 33.6 ptt180 -145.99 143.18 29.31 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.14 -0.975 . . . . 0.0 109.471 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.555 ' CG ' HH11 ' A' ' 49' ' ' ARG . 3.6 mtt-85 -93.41 144.58 25.2 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.299 -0.876 . . . . 0.0 109.806 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.4 m 54.42 175.42 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.286 -0.884 . . . . 0.0 110.151 179.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 32.3 t -62.35 -73.27 0.11 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.375 -0.828 . . . . 0.0 109.398 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 76.6 p -47.59 144.66 3.04 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.207 -0.933 . . . . 0.0 108.912 179.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.415 ' O ' ' O ' ' A' ' 73' ' ' VAL . 24.9 mtpp -75.19 102.65 5.06 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 120.895 -1.128 . . . . 0.0 109.794 -178.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.416 ' O ' ' CG1' ' A' ' 54' ' ' VAL . 11.4 p -124.67 120.51 59.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.8 tt -126.29 130.52 71.98 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 24.4 m -128.57 117.89 22.04 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.546 -0.721 . . . . 0.0 109.483 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.427 ' H ' ' HB ' ' A' ' 69' ' ' THR . 26.4 ttpt -126.52 114.33 17.98 Favored 'General case' 0 N--CA 1.519 3.015 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 177.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 54.7 m -119.13 137.51 53.54 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.547 -0.721 . . . . 0.0 109.902 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.428 ' O ' ' CG2' ' A' ' 59' ' ' VAL . 2.8 m -132.25 120.79 44.4 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 33.9 p -109.66 133.5 53.04 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.739 -0.6 . . . . 0.0 109.555 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 18.2 t30 -134.65 169.59 17.08 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 121.352 -0.843 . . . . 0.0 109.424 179.463 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.13 -42.78 99.15 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.811 -1.18 . . . . 0.0 112.552 -177.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -68.8 2.65 2.41 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.393 -1.442 . . . . 0.0 110.457 -177.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.537 ' O ' ' N ' ' A' ' 66' ' ' THR . . . 95.01 10.89 57.08 Favored Glycine 0 N--CA 1.494 2.511 0 N-CA-C 110.059 -1.217 . . . . 0.0 110.059 179.123 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.573 ' CG ' HH11 ' A' ' 65' ' ' ARG . 0.1 OUTLIER -64.34 78.64 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.42 0 O-C-N 120.785 -1.421 . . . . 0.0 107.926 179.133 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.537 ' N ' ' O ' ' A' ' 64' ' ' GLY . 71.0 p -109.68 75.85 0.96 Allowed 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 -179.209 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -93.3 115.89 28.46 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.439 -0.788 . . . . 0.0 109.097 -179.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.454 ' C ' ' H ' ' A' ' 70' ' ' LYS . 3.7 m -97.74 109.99 22.64 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.186 -0.946 . . . . 0.0 109.703 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.51 ' O ' ' N ' ' A' ' 71' ' ' GLU . 3.6 m -85.27 35.09 0.58 Allowed 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 178.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.454 ' H ' ' C ' ' A' ' 68' ' ' THR . 40.4 pttt -64.45 61.53 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 179.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 69' ' ' THR . 13.2 mm-40 -88.09 150.21 23.5 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.061 -1.025 . . . . 0.0 109.547 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 15.8 t -129.0 116.24 39.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.415 ' O ' ' O ' ' A' ' 53' ' ' LYS . 98.7 t -109.71 129.82 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 CA-C-O 122.142 0.973 . . . . 0.0 109.151 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -86.54 163.56 17.41 Favored 'General case' 0 C--N 1.29 -2.018 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.527 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 70.0 m -63.6 112.09 2.66 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.303 -0.873 . . . . 0.0 109.53 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -85.33 -11.19 55.22 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.217 -0.927 . . . . 0.0 109.58 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -158.04 36.93 0.25 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.237 -0.914 . . . . 0.0 109.635 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -83.94 -28.65 33.9 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.308 -1.517 . . . . 0.0 109.308 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 11.3 t 53.83 13.19 0.5 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.341 -1.094 . . . . 0.0 109.526 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -171.06 25.68 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.198 -0.939 . . . . 0.0 109.575 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 51.2 t -158.97 67.61 0.43 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.292 -0.88 . . . . 0.0 109.532 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 167.87 -64.43 0.19 Allowed Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -78.61 114.98 18.0 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.232 -1.158 . . . . 0.0 109.438 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.418 ' O ' ' O ' ' A' ' 85' ' ' ASP . . . -63.63 -25.24 68.13 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.261 -0.899 . . . . 0.0 109.438 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.418 ' O ' ' O ' ' A' ' 84' ' ' ALA . 20.4 t70 55.96 167.23 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.21 -0.931 . . . . 0.0 109.508 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -81.64 148.81 28.86 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.23 -0.919 . . . . 0.0 109.471 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -69.15 104.4 2.16 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.171 -0.956 . . . . 0.0 109.402 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . 0.492 ' CD1' ' N ' ' A' ' 89' ' ' HIS . 76.7 t-105 -61.39 -101.12 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.308 -0.87 . . . . 0.0 109.46 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.492 ' N ' ' CD1' ' A' ' 88' ' ' TRP . 52.4 t-80 52.2 10.71 0.13 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.212 -0.93 . . . . 0.0 109.471 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.472 ' H ' ' C ' ' A' ' 88' ' ' TRP . 64.1 t60 -63.95 134.87 55.89 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.29 -0.882 . . . . 0.0 109.54 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 41.8 m -156.79 157.79 35.66 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.256 -0.902 . . . . 0.0 109.366 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -57.92 148.64 58.63 Favored Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.211 -0.931 . . . . 0.0 108.981 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -57.08 -58.23 1.0 Allowed 'Trans proline' 0 C--N 1.323 -0.772 0 C-N-CA 120.893 1.062 . . . . 0.0 109.788 179.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.66 ' HG ' ' H ' ' A' ' 95' ' ' ARG . 23.1 t -57.27 178.36 0.07 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.29 -0.882 . . . . 0.0 109.539 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.66 ' H ' ' HG ' ' A' ' 94' ' ' SER . 65.1 ttt180 -165.88 -15.89 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.339 -0.851 . . . . 0.0 109.4 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -163.22 46.15 0.32 Allowed Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -57.97 133.04 55.15 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.304 -1.115 . . . . 0.0 109.437 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 16.7 mt -69.31 -169.15 0.19 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.347 -0.846 . . . . 0.0 109.451 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -157.84 140.97 15.16 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.277 -0.889 . . . . 0.0 109.396 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -62.56 119.97 10.24 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.218 -0.926 . . . . 0.0 109.424 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 31.5 p90 -65.44 -18.79 65.59 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.321 -0.862 . . . . 0.0 109.45 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 83.0 t80 43.04 82.81 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.555 -0.716 . . . . 0.0 110.103 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -71.62 -47.96 51.12 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.164 -0.96 . . . . 0.0 109.484 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.57 HH11 ' CG ' ' A' ' 104' ' ' ARG . 0.3 OUTLIER -171.25 -60.25 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.263 -0.898 . . . . 0.0 109.355 179.959 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -158.22 142.04 15.54 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.276 -0.89 . . . . 0.0 109.365 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.469 ' O ' ' N ' ' A' ' 108' ' ' ASP . 86.3 tttt -65.76 90.12 0.12 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.222 -0.924 . . . . 0.0 109.455 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 17.7 t70 50.69 -93.93 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.244 -0.91 . . . . 0.0 109.495 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.469 ' N ' ' O ' ' A' ' 106' ' ' LYS . 25.2 t70 -169.97 133.28 1.17 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.335 -0.853 . . . . 0.0 109.471 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 69.1 m-85 -67.93 -47.1 69.66 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.255 -0.903 . . . . 0.0 109.442 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . 0.462 ' CD2' ' N ' ' A' ' 111' ' ' THR . 70.0 t80 51.47 -101.27 0.1 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.319 -0.863 . . . . 0.0 109.553 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' THR . . . . . 0.462 ' N ' ' CD2' ' A' ' 110' ' ' PHE . 93.0 m -74.53 156.56 36.73 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.132 -0.98 . . . . 0.0 109.47 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -168.4 -36.56 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.272 -0.893 . . . . 0.0 109.44 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 66.1 m -165.85 48.16 0.08 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.322 -0.861 . . . . 0.0 109.479 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 88.7 p -71.25 89.06 0.86 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.192 -0.943 . . . . 0.0 109.497 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -71.12 167.18 19.86 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.164 -0.96 . . . . 0.0 109.484 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 51.3 tt0 53.27 73.0 0.39 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.319 -0.863 . . . . 0.0 109.459 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -72.77 147.41 45.57 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.228 -0.92 . . . . 0.0 109.447 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -171.03 -166.49 0.48 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.162 -0.961 . . . . 0.0 109.554 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -179.11 40.27 0.08 OUTLIER Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.409 -1.476 . . . . 0.0 109.409 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -70.03 66.73 0.27 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.257 -1.143 . . . . 0.0 109.528 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 73.8 p -55.85 179.27 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.184 -0.947 . . . . 0.0 109.483 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -69.33 150.48 49.98 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.43 -1.468 . . . . 0.0 109.43 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 14.8 mt -68.59 148.42 50.52 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.123 -1.222 . . . . 0.0 109.681 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -66.7 162.31 52.63 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.33 -0.856 . . . . 0.0 108.844 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -56.56 -45.14 39.31 Favored 'Trans proline' 0 C--N 1.32 -0.968 0 C-N-CA 121.436 1.424 . . . . 0.0 110.009 179.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 58.36 169.98 0.05 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.258 -0.901 . . . . 0.0 109.311 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . 0.474 ' CD1' ' O ' ' A' ' 127' ' ' PHE . 52.3 p90 -75.27 133.22 41.38 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.251 -0.906 . . . . 0.0 109.478 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -169.14 -88.77 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.199 -0.938 . . . . 0.0 109.407 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -162.94 -168.84 1.87 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.266 -0.896 . . . . 0.0 109.47 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 44.6 tp -166.61 75.88 0.18 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.222 -0.924 . . . . 0.0 109.415 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 65.08 -126.93 32.2 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.753 -1.339 . . . . 0.0 109.753 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -66.83 86.99 0.13 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.26 -1.141 . . . . 0.0 109.694 -179.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 71.7 m -84.51 158.4 20.99 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.223 -0.923 . . . . 0.0 109.335 179.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 177.0 -166.5 37.23 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 31.4 t -166.96 -11.25 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.279 -1.13 . . . . 0.0 109.4 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.2 t 53.62 -119.64 1.53 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.305 -0.872 . . . . 0.0 109.44 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 93.5 p -167.62 139.06 3.03 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.282 -0.886 . . . . 0.0 109.49 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' SER . . . . . 0.47 ' OG ' ' N ' ' A' ' 139' ' ' LYS . 30.9 t -171.73 -168.55 0.6 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.273 -0.892 . . . . 0.0 109.438 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.47 ' N ' ' OG ' ' A' ' 138' ' ' SER . 7.5 mtpm? 50.99 -179.64 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.251 -0.905 . . . . 0.0 109.498 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 35.0 m -72.56 137.12 46.02 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.266 -0.896 . . . . 0.0 109.503 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 28.6 t -172.97 -63.81 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.248 -0.908 . . . . 0.0 109.404 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' THR . . . . . 0.585 ' HG1' HE22 ' A' ' 146' ' ' GLN . 77.0 p -64.87 114.76 4.73 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.236 -0.915 . . . . 0.0 109.521 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . 0.432 ' N ' ' HD1' ' A' ' 143' ' ' HIS . 0.0 OUTLIER -70.09 -143.76 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.231 -0.918 . . . . 0.0 109.445 179.996 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' SER . . . . . 0.538 ' HG ' ' H ' ' A' ' 145' ' ' LYS . 43.8 t -62.42 176.55 0.61 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.206 -0.934 . . . . 0.0 109.542 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . 0.538 ' H ' ' HG ' ' A' ' 144' ' ' SER . 39.6 mmtm 54.3 80.08 0.13 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.287 -0.883 . . . . 0.0 109.429 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . 0.585 HE22 ' HG1' ' A' ' 142' ' ' THR . 7.9 mm100 -72.42 -80.4 0.06 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.263 -0.898 . . . . 0.0 109.374 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -171.29 -29.21 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.233 -0.917 . . . . 0.0 109.414 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 38.7 t -58.8 -75.38 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.275 -0.891 . . . . 0.0 109.473 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 33.3 t -70.16 116.96 11.13 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.221 -0.924 . . . . 0.0 109.436 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 30.7 t -170.07 30.11 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.271 -0.893 . . . . 0.0 109.404 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 50.6 m -79.84 -64.53 1.16 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.264 -0.898 . . . . 0.0 109.368 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 80.5 p -70.12 -30.85 68.14 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.296 -0.877 . . . . 0.0 109.543 -179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 16.3 m -69.0 102.4 1.6 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.196 -0.94 . . . . 0.0 109.494 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 11.1 p -170.97 -34.15 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.272 -0.892 . . . . 0.0 109.391 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . 0.532 ' C ' ' H ' ' A' ' 157' ' ' GLY . 77.2 m-20 51.48 -105.61 0.22 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.281 -0.887 . . . . 0.0 109.545 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . 0.554 ' CG ' HH11 ' A' ' 156' ' ' ARG . 0.2 OUTLIER 60.99 -1.47 0.25 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.347 -0.846 . . . . 0.0 109.588 -179.867 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . 0.532 ' H ' ' C ' ' A' ' 155' ' ' ASN . . . -179.07 -166.14 34.52 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 46.89 -139.6 7.64 Favored Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.675 -1.37 . . . . 0.0 109.675 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' SER . . . . . 0.641 ' HG ' ' H ' ' A' ' 160' ' ' ALA . 13.0 t 51.05 -137.96 1.1 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.263 -1.139 . . . . 0.0 109.53 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . 0.641 ' H ' ' HG ' ' A' ' 159' ' ' SER . . . 57.19 45.39 20.63 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.334 -0.854 . . . . 0.0 109.455 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 74.7 mt -67.65 101.23 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.268 -0.895 . . . . 0.0 109.472 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -73.05 158.03 36.19 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.304 -0.872 . . . . 0.0 109.515 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 41.6 t -162.43 0.45 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.186 -0.946 . . . . 0.0 109.439 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 59.8 mttm 52.95 -151.2 0.32 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.319 -0.863 . . . . 0.0 109.476 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 76.1 t60 -59.75 127.66 33.05 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.237 -0.915 . . . . 0.0 109.463 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 57.3 t80 . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 118.016 -0.992 . . . . 0.0 109.441 179.966 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.0 mtt . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -68.11 136.0 30.32 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 77.3 p -68.79 89.47 0.39 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.207 -1.173 . . . . 0.0 109.502 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -49.59 -54.49 17.96 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.26 -0.9 . . . . 0.0 109.498 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -169.92 -28.03 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.252 -0.905 . . . . 0.0 109.548 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.427 ' N ' ' CD ' ' A' ' 6' ' ' GLU . 20.7 mp0 -66.5 156.87 33.65 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.294 -0.879 . . . . 0.0 109.54 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 56.61 41.14 28.88 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.342 -0.849 . . . . 0.0 109.408 -179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 62.83 141.78 0.01 OUTLIER Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.415 ' O ' ' O ' ' A' ' 10' ' ' VAL . 40.9 t -71.55 -42.08 68.31 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.328 -1.101 . . . . 0.0 109.386 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.429 ' C ' ' HG ' ' A' ' 11' ' ' SER . 16.9 t 53.53 99.73 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.25 -0.906 . . . . 0.0 109.436 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.429 ' HG ' ' C ' ' A' ' 10' ' ' VAL . 49.2 m -163.97 125.38 2.3 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.288 -0.882 . . . . 0.0 109.434 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.5 t -168.68 -52.52 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.198 -0.939 . . . . 0.0 109.435 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -69.56 70.49 0.52 Allowed Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.4 ' OG1' ' N ' ' A' ' 15' ' ' LYS . 82.6 p -66.41 -105.49 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.214 -1.168 . . . . 0.0 109.485 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.4 ' N ' ' OG1' ' A' ' 14' ' ' THR . 22.8 pttm -173.0 -24.31 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.283 -0.885 . . . . 0.0 109.514 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 54.2 tt0 -62.1 98.96 0.11 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.28 -0.887 . . . . 0.0 109.532 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.56 ' CD ' ' H ' ' A' ' 17' ' ' GLU . 1.7 pm0 -73.29 -28.06 61.9 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.294 -0.879 . . . . 0.0 109.437 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.48 ' CD2' ' N ' ' A' ' 19' ' ' HIS . 80.2 t80 -170.3 -97.51 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.184 -0.947 . . . . 0.0 109.532 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.505 ' O ' ' N ' ' A' ' 21' ' ' GLY . 56.4 t-80 51.1 59.39 4.64 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.207 -0.933 . . . . 0.0 109.525 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.1 m 66.25 -46.26 0.42 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.605 -0.684 . . . . 0.0 109.764 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.505 ' N ' ' O ' ' A' ' 19' ' ' HIS . . . 72.17 46.38 35.39 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 94.2 mttt 52.55 -174.1 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.254 -1.145 . . . . 0.0 109.48 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 15.4 tp -71.27 -78.51 0.08 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.232 -0.917 . . . . 0.0 109.165 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 8.3 p -67.65 140.36 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.254 -0.904 . . . . 0.0 109.411 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.417 ' O ' ' OG1' ' A' ' 26' ' ' THR . 61.6 p -77.47 -167.59 0.97 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.257 -0.902 . . . . 0.0 109.494 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.417 ' OG1' ' O ' ' A' ' 25' ' ' THR . 54.6 m -166.29 109.71 0.77 Allowed 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.241 -0.912 . . . . 0.0 109.486 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.1 pttm -170.53 12.16 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.284 -0.885 . . . . 0.0 109.489 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 176.01 -159.28 26.59 Favored Glycine 0 N--CA 1.49 2.261 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.3 m-20 -104.47 -64.99 1.06 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.437 -1.037 . . . . 0.0 109.36 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -71.01 114.01 8.63 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.335 -0.853 . . . . 0.0 109.473 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.463 ' C ' ' H ' ' A' ' 33' ' ' LEU . 46.5 mt-10 -65.17 126.01 26.79 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.173 -0.954 . . . . 0.0 109.458 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.509 ' CD1' ' N ' ' A' ' 32' ' ' LEU . 8.2 mp -64.79 -0.14 1.37 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.238 -0.914 . . . . 0.0 109.162 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.463 ' H ' ' C ' ' A' ' 31' ' ' GLU . 10.7 tp 53.88 100.33 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.338 -0.851 . . . . 0.0 109.456 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 15.6 mm -58.0 160.52 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.296 -0.878 . . . . 0.0 109.463 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -160.84 -44.09 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.32 -0.863 . . . . 0.0 109.32 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -157.51 84.05 0.9 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.379 -0.826 . . . . 0.0 109.388 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.0 tt0 -73.48 -68.45 0.5 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.255 -0.903 . . . . 0.0 109.709 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -95.36 -171.72 2.47 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.202 -0.936 . . . . 0.0 109.354 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 19.2 m -77.67 -13.62 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.27 -0.894 . . . . 0.0 109.376 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 20.5 p 50.1 40.61 22.05 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.231 -0.918 . . . . 0.0 109.474 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 41.4 t -75.51 -8.9 57.95 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.264 -0.897 . . . . 0.0 109.481 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 68.93 -135.0 27.8 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 53.35 -172.41 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.267 -1.137 . . . . 0.0 109.436 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 55.9 m -85.61 146.81 26.7 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.265 -0.897 . . . . 0.0 109.398 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.439 ' O ' ' O ' ' A' ' 46' ' ' THR . 74.4 p -65.86 136.17 55.79 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.175 -0.953 . . . . 0.0 109.429 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.591 ' C ' ' H ' ' A' ' 48' ' ' ARG . 1.3 m -60.24 -146.16 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.398 -0.814 . . . . 0.0 109.595 -179.538 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.408 ' H ' ' CG2' ' A' ' 46' ' ' THR . 2.6 m 65.05 -14.3 0.11 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.286 -0.884 . . . . 0.0 110.007 -179.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.591 ' H ' ' C ' ' A' ' 46' ' ' THR . 37.9 ttm180 -146.69 143.59 28.86 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 120.983 -1.073 . . . . 0.0 109.076 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 -87.71 142.42 27.84 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.256 -0.902 . . . . 0.0 109.403 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.425 ' O ' ' O ' ' A' ' 51' ' ' CYS . 87.8 p -66.72 163.0 20.07 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.244 -0.91 . . . . 0.0 109.308 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.425 ' O ' ' O ' ' A' ' 50' ' ' SER . 4.3 t 62.3 139.17 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.324 -0.86 . . . . 0.0 109.395 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.583 ' N ' ' SG ' ' A' ' 81' ' ' CYS . 10.1 t 51.61 178.25 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.283 -0.886 . . . . 0.0 109.425 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.435 ' N ' ' OG ' ' A' ' 52' ' ' SER . 56.7 mttp -113.86 111.64 22.06 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.527 -0.733 . . . . 0.0 109.536 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 91.7 t -126.68 117.17 47.34 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.452 -0.78 . . . . 0.0 109.565 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 29.1 mm -111.3 116.04 51.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.945 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 179.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.6 m -129.27 113.49 15.07 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.423 -0.798 . . . . 0.0 109.593 -179.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.53 ' N ' ' OG1' ' A' ' 69' ' ' THR . 1.5 mtmm -122.73 111.64 16.96 Favored 'General case' 0 N--CA 1.511 2.587 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 178.294 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 63.4 m -119.36 135.37 54.75 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.477 -0.765 . . . . 0.0 109.446 -179.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.447 ' O ' ' CG2' ' A' ' 59' ' ' VAL . 2.9 m -131.81 118.93 39.99 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.212 0 O-C-N 121.544 -0.722 . . . . 0.0 109.571 179.123 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 81.2 p -112.8 136.46 52.39 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 179.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.521 ' OD1' ' N ' ' A' ' 62' ' ' ALA . 7.0 t30 -163.91 163.88 23.49 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 120.586 -1.322 . . . . 0.0 110.095 179.356 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.521 ' N ' ' OD1' ' A' ' 61' ' ' ASN . . . -74.68 -10.45 59.54 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.013 -1.055 . . . . 0.0 110.898 -179.346 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.408 ' CB ' ' ND2' ' A' ' 61' ' ' ASN . 26.7 t70 -75.25 6.25 4.61 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.187 -0.946 . . . . 0.0 109.752 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.19 10.89 79.54 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 108.91 -1.676 . . . . 0.0 108.91 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -92.61 97.56 10.88 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.936 -1.332 . . . . 0.0 108.779 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 54.1 p -127.41 68.77 1.29 Allowed 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 179.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -94.24 129.46 40.86 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.523 -0.736 . . . . 0.0 111.053 -178.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -111.28 111.76 23.05 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 178.712 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.53 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 22.4 p -109.91 37.22 2.73 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 179.167 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 45.4 pttt -65.72 61.39 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.906 0 C-N-CA 120.252 -0.579 . . . . 0.0 109.46 179.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.514 ' N ' ' O ' ' A' ' 69' ' ' THR . 50.0 mt-10 -84.92 146.78 27.08 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.169 -0.957 . . . . 0.0 109.609 -179.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 22.4 m -127.44 143.23 41.31 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 12.3 t -128.55 119.17 49.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.027 0 CA-C-O 122.029 0.918 . . . . 0.0 109.064 179.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -69.76 162.3 28.09 Favored 'General case' 0 C--N 1.291 -1.954 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.542 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 13.2 m -75.52 144.32 42.03 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.314 -0.866 . . . . 0.0 109.483 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -85.3 -13.92 48.2 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.312 -0.867 . . . . 0.0 109.271 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -172.27 46.62 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.345 -0.847 . . . . 0.0 109.364 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.523 ' C ' ' H ' ' A' ' 80' ' ' ASP . . . -81.44 -28.45 43.84 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.667 -1.373 . . . . 0.0 109.667 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 6.3 t 58.03 3.31 0.23 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.329 -1.1 . . . . 0.0 109.327 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.523 ' H ' ' C ' ' A' ' 78' ' ' GLY . 23.6 m-20 -160.38 27.21 0.16 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.319 -0.863 . . . . 0.0 108.922 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.583 ' SG ' ' N ' ' A' ' 52' ' ' SER . 4.5 t -165.62 38.16 0.06 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.471 -0.768 . . . . 0.0 109.607 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 175.59 -75.12 0.08 OUTLIER Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -73.46 -28.71 62.09 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.233 -1.157 . . . . 0.0 109.595 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . 64.26 165.17 0.14 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.312 -0.868 . . . . 0.0 109.398 -179.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 54.03 -159.34 0.16 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.205 -0.935 . . . . 0.0 109.289 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 34.0 p90 -165.49 26.22 0.05 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.148 -0.97 . . . . 0.0 109.419 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -170.55 171.19 6.5 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.226 -0.921 . . . . 0.0 109.493 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . 0.441 ' O ' ' NE2' ' A' ' 90' ' ' HIS . 5.4 m0 -88.86 99.58 12.5 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.17 -0.956 . . . . 0.0 109.354 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.524 ' O ' ' CG ' ' A' ' 90' ' ' HIS . 12.7 p80 -55.22 -170.08 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.246 -0.908 . . . . 0.0 109.475 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.524 ' CG ' ' O ' ' A' ' 89' ' ' HIS . 91.4 m-70 -157.18 111.71 2.71 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.295 -0.878 . . . . 0.0 109.503 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 29.3 m -51.87 114.27 1.24 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.275 -0.89 . . . . 0.0 109.413 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -61.03 149.2 82.57 Favored Pre-proline 0 N--CA 1.49 1.542 0 O-C-N 121.297 -0.877 . . . . 0.0 109.032 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.423 ' O ' ' OG ' ' A' ' 94' ' ' SER . 2.0 Cg_endo -56.66 -166.94 0.02 OUTLIER 'Trans proline' 0 C--N 1.323 -0.804 0 C-N-CA 120.965 1.11 . . . . 0.0 109.724 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.423 ' OG ' ' O ' ' A' ' 93' ' ' PRO . 74.8 m -167.79 -165.26 0.63 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.249 -0.907 . . . . 0.0 109.359 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 43.6 ttp180 -168.93 115.26 0.61 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.246 -0.909 . . . . 0.0 109.52 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 175.17 -53.16 0.13 Allowed Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.566 HD21 ' N ' ' A' ' 98' ' ' LEU . 0.4 OUTLIER -173.6 -13.23 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.33 -1.1 . . . . 0.0 109.525 -179.97 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.566 ' N ' HD21 ' A' ' 97' ' ' ASN . 36.8 mt -72.13 -72.69 0.22 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.276 -0.89 . . . . 0.0 109.383 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -76.57 79.18 3.25 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.181 -0.949 . . . . 0.0 109.565 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -71.6 82.79 0.84 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.271 -0.893 . . . . 0.0 109.216 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -71.49 -56.75 5.3 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.296 -0.877 . . . . 0.0 109.585 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -87.86 117.61 26.82 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.13 -0.981 . . . . 0.0 109.114 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.569 ' HD1' ' H ' ' A' ' 103' ' ' HIS . 10.3 m80 -58.68 -38.73 78.84 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.267 -0.896 . . . . 0.0 109.813 -179.741 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 62.4 ttt180 56.39 60.83 2.95 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.269 -0.895 . . . . 0.0 109.464 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -161.41 -33.95 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.235 -0.916 . . . . 0.0 109.542 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 18.2 tptm -59.54 135.78 57.78 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.172 -0.955 . . . . 0.0 109.414 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.405 ' N ' ' OD1' ' A' ' 107' ' ' ASP . 16.5 p-10 -171.19 156.17 4.62 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.328 -0.858 . . . . 0.0 109.458 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.517 ' CG ' ' H ' ' A' ' 109' ' ' PHE . 25.5 t70 -68.61 -168.64 0.13 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.288 -0.882 . . . . 0.0 109.4 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . 0.517 ' H ' ' CG ' ' A' ' 108' ' ' ASP . 69.5 t80 -59.55 -29.45 67.93 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.245 -0.909 . . . . 0.0 109.242 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . 0.515 ' O ' ' CD2' ' A' ' 110' ' ' PHE . 64.1 t80 -154.79 13.52 0.4 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.245 -0.909 . . . . 0.0 109.438 -179.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 7.5 m 57.32 103.12 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.317 -0.864 . . . . 0.0 109.559 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 14.9 ptm180 -55.86 165.2 0.97 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.282 -0.887 . . . . 0.0 109.502 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 57.3 p -172.07 -102.24 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.257 -0.902 . . . . 0.0 109.448 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 57.4 m -75.39 119.94 20.16 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.293 -0.879 . . . . 0.0 109.485 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -74.29 -135.97 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.293 -0.88 . . . . 0.0 109.502 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.474 ' CD ' ' N ' ' A' ' 116' ' ' GLU . 1.4 pm0 -165.11 41.95 0.08 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.236 -0.915 . . . . 0.0 109.487 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -71.49 145.23 49.33 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.206 -0.934 . . . . 0.0 109.43 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.499 ' CG ' ' H ' ' A' ' 119' ' ' GLY . 3.8 p-10 -73.68 -104.55 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.267 -0.896 . . . . 0.0 109.508 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.499 ' H ' ' CG ' ' A' ' 118' ' ' ASP . . . -67.79 -92.89 0.05 OUTLIER Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.574 -1.411 . . . . 0.0 109.574 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 37.7 ttm180 -165.93 125.26 1.65 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.321 -1.106 . . . . 0.0 109.474 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 52.9 m -73.87 121.45 20.93 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.251 -0.905 . . . . 0.0 109.446 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 158.56 107.57 0.24 Allowed Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.365 -1.494 . . . . 0.0 109.365 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.531 ' CD1' ' N ' ' A' ' 123' ' ' LEU . 7.5 mp -88.01 147.92 24.77 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.233 -1.157 . . . . 0.0 109.195 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -70.95 162.14 73.95 Favored Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 121.161 -0.962 . . . . 0.0 108.784 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -56.5 -178.78 0.08 OUTLIER 'Trans proline' 0 C--N 1.318 -1.051 0 C-N-CA 121.369 1.379 . . . . 0.0 109.765 179.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.423 ' O ' ' O ' ' A' ' 127' ' ' PHE . 46.8 mt-10 49.18 39.73 16.13 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.271 -0.893 . . . . 0.0 109.437 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . 0.423 ' O ' ' O ' ' A' ' 126' ' ' GLU . 45.8 m-85 49.72 -176.76 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.265 -0.897 . . . . 0.0 109.494 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -78.33 -51.73 9.67 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.342 -0.849 . . . . 0.0 109.348 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -64.73 110.99 2.57 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.287 -0.883 . . . . 0.0 109.406 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.475 ' O ' ' N ' ' A' ' 132' ' ' GLU . 16.5 mt -70.36 -38.64 74.83 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.24 -0.912 . . . . 0.0 109.42 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . 0.425 ' O ' ' O ' ' A' ' 132' ' ' GLU . . . 67.84 -63.39 0.33 Allowed Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . 0.475 ' N ' ' O ' ' A' ' 130' ' ' LEU . 12.8 tp10 59.07 155.13 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.385 -1.068 . . . . 0.0 109.572 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 40.7 t -53.89 132.15 41.31 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.224 -0.923 . . . . 0.0 109.5 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 68.99 159.55 1.84 Allowed Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 98.8 p -169.93 27.84 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.186 -1.184 . . . . 0.0 109.409 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 30.1 t -170.46 -46.85 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.323 -0.861 . . . . 0.0 109.522 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 40.5 t -67.98 -8.16 34.97 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.252 -0.905 . . . . 0.0 109.439 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 60.8 m -59.53 -80.93 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.27 -0.894 . . . . 0.0 109.415 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -61.97 155.25 24.19 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.215 -0.928 . . . . 0.0 109.534 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' THR . . . . . 0.611 ' HG1' ' H ' ' A' ' 141' ' ' SER . 3.1 t -167.42 -167.02 0.83 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.242 -0.911 . . . . 0.0 109.475 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' SER . . . . . 0.611 ' H ' ' HG1' ' A' ' 140' ' ' THR . 85.6 p -167.42 17.91 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.348 -0.845 . . . . 0.0 109.413 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' THR . . . . . 0.409 ' O ' ' O ' ' A' ' 143' ' ' HIS . 2.8 m 57.58 20.89 6.6 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.297 -0.877 . . . . 0.0 109.332 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . 0.409 ' O ' ' O ' ' A' ' 142' ' ' THR . 11.5 m170 54.29 173.95 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.255 -0.903 . . . . 0.0 109.524 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' SER . . . . . 0.406 ' OG ' ' O ' ' A' ' 143' ' ' HIS . 53.5 p 50.48 79.3 0.09 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.231 -0.918 . . . . 0.0 109.508 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . 0.495 ' C ' ' H ' ' A' ' 147' ' ' PHE . 60.7 mttp -65.16 168.14 7.16 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.29 -0.881 . . . . 0.0 109.471 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . 0.479 ' C ' ' H ' ' A' ' 148' ' ' VAL . 22.4 mt-30 -75.35 21.23 0.14 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.256 -0.902 . . . . 0.0 109.42 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . 0.515 ' O ' ' CD2' ' A' ' 147' ' ' PHE . 65.6 t80 -74.19 16.6 0.23 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.282 -0.886 . . . . 0.0 109.48 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . 0.479 ' H ' ' C ' ' A' ' 146' ' ' GLN . 21.6 t 53.1 89.94 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.275 -0.89 . . . . 0.0 109.431 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 14.7 m 52.03 -173.45 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.25 -0.906 . . . . 0.0 109.489 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 29.4 t -168.72 -64.92 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.274 -0.891 . . . . 0.0 109.465 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 53.4 m -68.8 124.36 23.46 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.276 -0.89 . . . . 0.0 109.495 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 80.4 p -68.51 104.67 1.99 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.297 -0.877 . . . . 0.0 109.551 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 31.7 m -69.91 -30.7 68.18 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.259 -0.9 . . . . 0.0 109.431 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 23.6 t 53.36 80.69 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.305 -0.872 . . . . 0.0 109.471 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 20.8 p30 -73.72 -27.64 61.3 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.214 -0.929 . . . . 0.0 109.366 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 59.9 ttt180 -48.85 169.13 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.261 -0.899 . . . . 0.0 109.42 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -154.76 133.5 3.86 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.546 -1.421 . . . . 0.0 109.546 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -56.16 -33.69 61.5 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 61.6 m -162.55 85.5 0.56 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.178 -1.19 . . . . 0.0 109.511 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -170.35 45.68 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.255 -0.903 . . . . 0.0 109.368 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 20.1 pt -152.29 42.11 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.336 -0.852 . . . . 0.0 109.275 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -169.04 16.95 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.308 -0.87 . . . . 0.0 109.479 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.434 ' O ' ' O ' ' A' ' 164' ' ' LYS . 66.8 m -165.13 97.63 0.72 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.207 -0.933 . . . . 0.0 109.426 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.434 ' O ' ' O ' ' A' ' 163' ' ' SER . 35.6 mttp 60.66 139.54 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.421 -0.799 . . . . 0.0 109.731 -179.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -76.69 138.21 39.87 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.11 -0.994 . . . . 0.0 109.411 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 57.7 t80 . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 117.998 -1.001 . . . . 0.0 109.525 179.976 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.3 mtt . . . . . 0 N--CA 1.491 1.598 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 175.76 41.56 0.05 OUTLIER Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.5 t -170.42 -16.42 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.296 -1.12 . . . . 0.0 109.369 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.475 ' O ' ' N ' ' A' ' 6' ' ' GLU . 55.6 m-85 53.06 -144.96 0.61 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.229 -0.919 . . . . 0.0 109.465 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 52.2 -91.48 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.358 -0.839 . . . . 0.0 109.473 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.475 ' N ' ' O ' ' A' ' 4' ' ' PHE . 28.5 tt0 -83.95 120.97 26.74 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.075 -1.016 . . . . 0.0 109.373 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -56.85 -10.71 1.14 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.239 -0.913 . . . . 0.0 109.448 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.407 ' H ' ' C ' ' A' ' 6' ' ' GLU . . . -50.59 146.34 9.2 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.423 ' OG ' ' N ' ' A' ' 10' ' ' VAL . 47.8 t -72.22 -136.94 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.299 -1.118 . . . . 0.0 109.419 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.423 ' N ' ' OG ' ' A' ' 9' ' ' SER . 9.1 p -163.12 -36.0 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.222 -0.924 . . . . 0.0 109.519 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 87.4 p -71.27 -153.45 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.159 -0.963 . . . . 0.0 109.487 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 39.0 t -169.22 50.6 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.209 -0.932 . . . . 0.0 109.52 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 65.51 114.59 0.01 OUTLIER Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.426 ' OG1' ' N ' ' A' ' 15' ' ' LYS . 60.0 p -53.39 -74.28 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.225 -1.161 . . . . 0.0 109.448 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.426 ' N ' ' OG1' ' A' ' 14' ' ' THR . 32.9 ttmt -170.73 44.34 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.209 -0.932 . . . . 0.0 109.424 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -81.06 127.05 32.18 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.201 -0.937 . . . . 0.0 109.368 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.499 ' O ' ' N ' ' A' ' 19' ' ' HIS . 68.3 mt-10 -69.12 -49.31 58.14 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.173 -0.955 . . . . 0.0 109.599 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -44.01 92.73 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.405 -0.809 . . . . 0.0 110.044 -179.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.499 ' N ' ' O ' ' A' ' 17' ' ' GLU . 9.4 p80 -82.66 -128.47 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.374 -0.829 . . . . 0.0 109.403 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.476 ' N ' ' CG ' ' A' ' 19' ' ' HIS . 1.6 t -174.85 157.6 2.45 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.195 -0.941 . . . . 0.0 109.561 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.448 ' O ' ' N ' ' A' ' 23' ' ' LEU . . . 65.78 171.28 3.54 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -68.83 66.4 0.13 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.222 -1.164 . . . . 0.0 109.421 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.448 ' N ' ' O ' ' A' ' 21' ' ' GLY . 9.7 tp 49.2 -118.95 1.16 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.266 -0.896 . . . . 0.0 109.372 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 46.3 t -144.31 115.76 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.115 -0.991 . . . . 0.0 109.31 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 59.3 p -60.38 -61.23 2.75 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.288 -0.883 . . . . 0.0 109.437 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.4 t -166.73 173.25 9.76 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.275 -0.89 . . . . 0.0 109.475 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.1 ptmm? -171.49 33.93 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.257 -0.902 . . . . 0.0 109.44 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -66.62 163.0 44.1 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -70.43 126.69 30.35 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.247 -1.149 . . . . 0.0 109.439 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.489 ' NZ ' ' CB ' ' A' ' 30' ' ' LYS . 2.6 ttmp? -73.08 50.01 0.26 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.221 -0.924 . . . . 0.0 109.348 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -172.62 88.01 0.08 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.253 -0.904 . . . . 0.0 109.181 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 11.1 tp -56.99 -29.77 63.58 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.291 -0.88 . . . . 0.0 109.444 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.441 ' CG ' ' H ' ' A' ' 34' ' ' ILE . 6.6 tp -165.49 -132.59 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.157 -0.965 . . . . 0.0 109.513 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.441 ' H ' ' CG ' ' A' ' 33' ' ' LEU . 38.2 mt -139.22 -55.54 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.356 -0.84 . . . . 0.0 109.252 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.16 63.04 2.34 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.207 -0.933 . . . . 0.0 109.439 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -168.29 -84.02 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.228 -0.92 . . . . 0.0 109.469 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -71.96 100.36 2.44 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.283 -0.886 . . . . 0.0 109.439 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 58.4 tttp -167.9 -20.23 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.258 -0.901 . . . . 0.0 109.451 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 31.4 m -57.78 146.78 7.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.267 -0.895 . . . . 0.0 109.495 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.8 t -65.35 174.78 1.96 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.363 -0.835 . . . . 0.0 109.429 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 71.8 p -170.43 176.65 4.34 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.333 -0.854 . . . . 0.0 109.367 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 179.76 165.43 33.73 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.462 ' HD1' ' C ' ' A' ' 43' ' ' HIS . 0.6 OUTLIER -167.96 19.69 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.235 -1.156 . . . . 0.0 109.423 179.96 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 30.5 m -78.8 74.74 5.32 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.302 -0.874 . . . . 0.0 109.42 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 72.8 p -77.19 104.2 7.56 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.154 -0.966 . . . . 0.0 109.42 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 66.1 p -73.22 -133.94 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.268 -0.895 . . . . 0.0 109.452 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 33.7 p -155.24 41.46 0.43 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.268 -0.895 . . . . 0.0 109.061 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.553 ' CG ' HH11 ' A' ' 48' ' ' ARG . 0.0 OUTLIER -145.84 167.63 22.75 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.301 -0.874 . . . . 0.0 109.374 -179.802 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.428 ' O ' ' O ' ' A' ' 50' ' ' SER . 95.5 mtt180 -87.8 126.14 34.84 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.217 -0.927 . . . . 0.0 109.614 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.428 ' O ' ' O ' ' A' ' 49' ' ' ARG . 47.1 t -59.07 -156.65 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.234 -0.916 . . . . 0.0 109.494 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.502 ' SG ' ' O ' ' A' ' 81' ' ' CYS . 4.8 t 50.74 -118.24 1.2 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.101 -0.999 . . . . 0.0 108.716 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.6 ' N ' ' SG ' ' A' ' 81' ' ' CYS . 26.6 t -56.97 -167.11 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.502 0 O-C-N 120.712 -1.242 . . . . 0.0 108.966 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.491 ' N ' ' OG ' ' A' ' 52' ' ' SER . 50.5 mttp -126.4 103.65 7.75 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.326 -0.858 . . . . 0.0 109.45 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 51.0 t -127.66 116.15 42.28 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.569 -0.707 . . . . 0.0 109.192 179.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 14.8 tt -128.66 125.25 63.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.564 -0.71 . . . . 0.0 109.415 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 81.0 p -127.85 113.33 15.78 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.402 -0.811 . . . . 0.0 109.323 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 41.7 tttm -127.59 113.64 16.36 Favored 'General case' 0 N--CA 1.519 3.022 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 91.5 m -108.94 125.22 51.79 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.496 -0.752 . . . . 0.0 109.436 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.5 m -132.56 119.92 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.178 0 O-C-N 121.45 -0.781 . . . . 0.0 109.071 178.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 60.8 m -109.65 134.44 51.96 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.753 -0.592 . . . . 0.0 109.655 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -127.19 162.29 26.51 Favored 'General case' 0 N--CA 1.516 2.85 0 O-C-N 121.385 -0.822 . . . . 0.0 109.347 179.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.457 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -71.59 -33.37 68.99 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.538 -1.351 . . . . 0.0 112.6 -177.531 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -69.48 7.26 0.85 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.453 -1.405 . . . . 0.0 109.813 -178.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.457 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 87.84 5.02 78.29 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.404 HH11 ' CG ' ' A' ' 65' ' ' ARG . 1.9 ttt-85 -81.15 96.55 7.24 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 120.705 -1.468 . . . . 0.0 107.865 178.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.409 ' O ' ' OG1' ' A' ' 66' ' ' THR . 18.6 p -122.08 94.89 4.45 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.607 -0.683 . . . . 0.0 109.196 -179.069 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -94.66 119.64 33.62 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.228 -0.92 . . . . 0.0 109.864 -179.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.659 ' HG1' ' NZ ' ' A' ' 70' ' ' LYS . 40.7 p -102.36 108.53 19.91 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.377 -0.827 . . . . 0.0 109.631 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.545 ' O ' ' N ' ' A' ' 71' ' ' GLU . 3.2 m -87.87 31.38 0.78 Allowed 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 178.693 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.659 ' NZ ' ' HG1' ' A' ' 68' ' ' THR . 22.0 pttm -65.13 56.7 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 179.831 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.545 ' N ' ' O ' ' A' ' 69' ' ' THR . 75.0 mt-10 -93.8 135.94 34.59 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.962 -1.086 . . . . 0.0 109.943 -179.621 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 47.8 t -128.03 129.17 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 179.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.422 ' O ' ' OG ' ' A' ' 52' ' ' SER . 16.6 t -128.61 116.2 40.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 CA-C-O 121.946 0.879 . . . . 0.0 109.236 179.677 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 45.9 mtmt -83.99 51.52 2.08 Favored 'General case' 0 C--N 1.289 -2.052 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 6.0 m 55.6 -153.3 0.34 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.235 -0.916 . . . . 0.0 109.463 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.432 ' N ' ' CD ' ' A' ' 76' ' ' GLU . 4.5 mp0 -85.22 -65.9 0.96 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.321 -0.862 . . . . 0.0 109.22 179.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 20.2 p-10 -162.0 82.05 0.56 Allowed 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.304 -0.872 . . . . 0.0 109.211 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.452 ' O ' ' N ' ' A' ' 80' ' ' ASP . . . 50.89 45.73 49.68 Favored Glycine 0 N--CA 1.489 2.233 0 N-CA-C 109.395 -1.482 . . . . 0.0 109.395 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 42.9 t -68.31 50.33 0.07 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.271 -1.135 . . . . 0.0 109.513 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.452 ' N ' ' O ' ' A' ' 78' ' ' GLY . 0.8 OUTLIER 54.16 44.75 28.71 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.299 -0.876 . . . . 0.0 109.614 179.948 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.6 ' SG ' ' N ' ' A' ' 52' ' ' SER . 3.0 t -95.64 53.28 1.43 Allowed 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.189 -0.944 . . . . 0.0 109.072 179.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 48.83 22.77 3.06 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.711 -1.355 . . . . 0.0 109.711 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -171.03 96.62 0.2 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.208 -1.172 . . . . 0.0 109.646 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -79.19 -141.3 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.184 -0.947 . . . . 0.0 109.265 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.508 ' CG ' ' H ' ' A' ' 86' ' ' PHE . 5.8 p-10 -69.54 -107.46 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.202 -0.936 . . . . 0.0 109.404 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.52 ' O ' ' N ' ' A' ' 88' ' ' TRP . 96.3 m-85 50.01 -161.74 0.06 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.273 -0.892 . . . . 0.0 109.437 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 9.2 t70 60.76 -75.27 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.413 -0.805 . . . . 0.0 109.73 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . 0.52 ' N ' ' O ' ' A' ' 86' ' ' PHE . 73.8 m95 53.59 -172.57 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.221 -0.924 . . . . 0.0 109.465 -179.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.409 ' O ' ' CG ' ' A' ' 89' ' ' HIS . 79.2 t60 -163.29 4.09 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.256 -0.902 . . . . 0.0 109.232 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -168.82 98.85 0.39 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.314 -0.866 . . . . 0.0 109.342 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.518 ' OG1' ' CD2' ' A' ' 92' ' ' PHE . 80.3 p -83.02 -159.04 0.31 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.339 -0.85 . . . . 0.0 109.428 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.518 ' CD2' ' OG1' ' A' ' 91' ' ' THR . 62.9 m-85 51.63 67.74 3.88 Favored Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.246 -0.909 . . . . 0.0 109.671 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -61.45 -3.21 3.1 Favored 'Trans proline' 0 C--N 1.318 -1.067 0 C-N-CA 121.361 1.374 . . . . 0.0 109.724 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.445 ' H ' ' C ' ' A' ' 92' ' ' PHE . 29.1 t -165.49 120.03 1.25 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.288 -0.883 . . . . 0.0 109.437 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -70.53 -45.68 65.09 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.214 -0.929 . . . . 0.0 109.352 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 73.02 85.03 0.23 Allowed Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.608 ' ND2' ' H ' ' A' ' 98' ' ' LEU . 4.2 p-10 -55.7 -70.63 0.11 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.212 -1.169 . . . . 0.0 109.51 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.608 ' H ' ' ND2' ' A' ' 97' ' ' ASN . 1.4 tt -76.94 41.4 0.28 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.19 -0.944 . . . . 0.0 109.003 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.423 ' H ' ' C ' ' A' ' 97' ' ' ASN . 16.6 m-20 49.82 -163.07 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.242 -0.911 . . . . 0.0 109.529 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 57.0 m-20 -157.89 -17.91 0.08 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.252 -0.905 . . . . 0.0 109.362 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -61.93 -53.05 61.13 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.206 -0.934 . . . . 0.0 109.447 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -72.46 66.87 0.71 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.303 -0.873 . . . . 0.0 109.435 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -65.59 -47.67 74.96 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.273 -0.892 . . . . 0.0 109.409 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -79.85 -153.68 0.08 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.226 -0.921 . . . . 0.0 109.439 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -157.96 100.49 1.73 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.317 -0.864 . . . . 0.0 109.426 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.4 tttm 51.5 86.68 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.315 -0.865 . . . . 0.0 109.517 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -61.19 177.53 0.34 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.238 -0.913 . . . . 0.0 109.5 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -167.2 108.44 0.63 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.327 -0.858 . . . . 0.0 109.391 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -68.84 -0.53 5.58 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.233 -0.917 . . . . 0.0 109.612 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 48.7 t80 58.43 67.51 0.93 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.307 -0.87 . . . . 0.0 109.541 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 68.5 p -57.44 127.1 30.28 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.303 -0.873 . . . . 0.0 109.355 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 84.7 mtm180 -73.41 -5.44 39.88 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.26 -0.9 . . . . 0.0 109.558 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 78.6 p -171.77 161.97 6.08 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.214 -0.929 . . . . 0.0 109.549 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 13.0 t 52.57 -146.43 0.51 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.263 -0.898 . . . . 0.0 109.519 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 41.7 p-80 -165.8 -40.22 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.224 -0.922 . . . . 0.0 109.491 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -170.16 -54.99 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.314 -0.866 . . . . 0.0 109.517 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -61.75 -61.08 2.76 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.234 -0.916 . . . . 0.0 109.426 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 33.6 t70 54.05 89.83 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.24 -0.913 . . . . 0.0 109.457 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 168.05 36.66 0.02 OUTLIER Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.541 -1.424 . . . . 0.0 109.541 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.541 ' CG ' HH11 ' A' ' 120' ' ' ARG . 0.0 OUTLIER -73.72 -35.69 65.12 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.256 -1.144 . . . . 0.0 109.515 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 1.7 t -61.57 164.71 5.62 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.25 -0.906 . . . . 0.0 109.556 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -178.79 -92.73 0.08 OUTLIER Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.43 -1.468 . . . . 0.0 109.43 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 15.3 mt -69.84 127.2 32.06 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.275 -1.132 . . . . 0.0 109.294 179.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.417 ' O ' ' O ' ' A' ' 125' ' ' PRO . . . -72.23 161.94 76.3 Favored Pre-proline 0 N--CA 1.489 1.524 0 O-C-N 121.148 -0.97 . . . . 0.0 108.908 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . 0.417 ' O ' ' O ' ' A' ' 124' ' ' ALA . 1.8 Cg_endo -57.08 -157.88 0.01 OUTLIER 'Trans proline' 0 C--N 1.32 -0.952 0 C-N-CA 121.346 1.364 . . . . 0.0 109.709 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.439 ' O ' ' O ' ' A' ' 127' ' ' PHE . 66.6 mm-40 -76.92 120.29 21.84 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.244 -0.91 . . . . 0.0 109.372 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . 0.541 ' CD2' ' N ' ' A' ' 128' ' ' ALA . 60.6 t80 -51.62 -176.39 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.306 -0.871 . . . . 0.0 109.775 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.541 ' N ' ' CD2' ' A' ' 127' ' ' PHE . . . -76.24 136.85 39.68 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.288 -0.883 . . . . 0.0 109.411 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -167.93 174.0 7.76 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.227 -0.921 . . . . 0.0 109.489 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.447 ' CD1' ' N ' ' A' ' 130' ' ' LEU . 9.7 mp -52.94 135.89 35.69 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.247 -0.908 . . . . 0.0 109.274 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 62.28 168.2 0.73 Allowed Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -63.1 -27.4 69.37 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.203 -1.175 . . . . 0.0 109.475 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 28.0 t -171.16 12.22 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.34 -0.85 . . . . 0.0 109.482 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -62.71 179.67 4.92 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.443 -1.463 . . . . 0.0 109.443 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 66.0 m -166.16 -37.59 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.209 -1.171 . . . . 0.0 109.437 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 30.6 t -171.09 73.55 0.06 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.279 -0.888 . . . . 0.0 109.374 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 38.9 t -66.66 -19.8 65.84 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.303 -0.873 . . . . 0.0 109.416 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 49.7 m -64.49 100.25 0.36 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.258 -0.901 . . . . 0.0 109.467 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.484 ' O ' ' N ' ' A' ' 141' ' ' SER . 68.4 mttm -64.47 124.34 21.56 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.251 -0.906 . . . . 0.0 109.447 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' THR . . . . . 0.629 ' HG1' ' H ' ' A' ' 141' ' ' SER . 58.7 p 48.07 -93.89 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.257 -0.902 . . . . 0.0 109.589 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' SER . . . . . 0.629 ' H ' ' HG1' ' A' ' 140' ' ' THR . 40.5 t -166.24 56.85 0.1 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.205 -0.935 . . . . 0.0 109.463 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 2.5 t -61.48 146.5 48.35 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.208 -0.932 . . . . 0.0 109.46 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 16.6 t60 -68.76 145.41 53.83 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.207 -0.933 . . . . 0.0 109.498 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 41.4 t -61.55 139.17 58.29 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.233 -0.917 . . . . 0.0 109.436 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 23.7 mtpp -66.05 98.91 0.46 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.193 -0.942 . . . . 0.0 109.58 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 41.3 tp60 -167.48 129.61 1.6 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.199 -0.938 . . . . 0.0 109.358 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 50.72 87.78 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.214 -0.929 . . . . 0.0 109.396 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 35.8 m -59.45 139.07 19.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.254 -0.904 . . . . 0.0 109.425 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 92.0 p -78.4 159.2 28.44 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.33 -0.856 . . . . 0.0 109.459 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 52.5 m -71.03 99.22 1.77 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.262 -0.899 . . . . 0.0 109.395 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' SER . . . . . 0.415 ' O ' ' O ' ' A' ' 152' ' ' THR . 49.6 m -63.39 -41.94 98.79 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.237 -0.915 . . . . 0.0 109.471 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' THR . . . . . 0.497 ' OG1' ' N ' ' A' ' 153' ' ' THR . 1.9 t -56.26 -166.87 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.291 -0.881 . . . . 0.0 109.485 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' THR . . . . . 0.497 ' N ' ' OG1' ' A' ' 152' ' ' THR . 69.1 p -74.06 150.07 40.81 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.315 -0.866 . . . . 0.0 109.492 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 8.7 p -167.39 145.31 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.191 -0.943 . . . . 0.0 109.553 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -171.6 137.8 1.07 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.278 -0.889 . . . . 0.0 109.491 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 56.3 mtp180 -59.22 -19.64 47.27 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.258 -0.901 . . . . 0.0 109.5 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -65.69 -167.2 1.98 Allowed Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 177.18 -21.98 0.05 OUTLIER Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 91.9 p -64.28 98.44 0.23 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.263 -1.14 . . . . 0.0 109.499 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -64.7 -178.39 0.4 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.221 -0.924 . . . . 0.0 109.391 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 18.5 pt -60.72 -177.98 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.226 -0.921 . . . . 0.0 109.475 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -66.07 138.07 57.5 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.162 -0.961 . . . . 0.0 109.455 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 50.1 m -77.6 165.04 24.79 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.151 -0.968 . . . . 0.0 109.508 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 58.3 pttt -69.08 146.06 52.92 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.235 -0.915 . . . . 0.0 109.468 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . 0.452 ' HD1' ' H ' ' A' ' 165' ' ' HIS . 12.1 m80 -67.14 -70.45 0.25 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.299 -0.876 . . . . 0.0 109.487 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 64.4 t80 . . . . . 0 N--CA 1.49 1.563 0 CA-C-O 118.045 -0.979 . . . . 0.0 109.532 179.975 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 73.9 mtp . . . . . 0 N--CA 1.489 1.508 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -178.62 124.92 0.95 Allowed Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 64.7 p -67.74 156.99 35.71 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.222 -1.163 . . . . 0.0 109.437 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -66.32 141.94 57.82 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.296 -0.877 . . . . 0.0 109.508 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -70.07 137.5 51.28 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.228 -0.92 . . . . 0.0 109.416 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -148.55 -144.86 0.16 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.254 -0.904 . . . . 0.0 109.294 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.468 ' N ' ' CD ' ' A' ' 7' ' ' GLU . 1.4 pm0 -166.61 153.81 9.36 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.152 -0.968 . . . . 0.0 109.456 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -60.74 134.45 49.57 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.432 ' O ' ' O ' ' A' ' 10' ' ' VAL . 77.5 p -68.4 -89.75 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.288 -1.125 . . . . 0.0 109.547 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.432 ' O ' ' O ' ' A' ' 9' ' ' SER . 4.1 t 58.73 154.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.43 -0.794 . . . . 0.0 109.645 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.6 t 48.61 26.49 1.22 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.198 -0.939 . . . . 0.0 109.615 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.9 t -69.12 -134.4 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.236 -0.915 . . . . 0.0 109.46 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . 0.426 ' O ' ' NE2' ' A' ' 16' ' ' GLN . . . -168.59 36.38 0.2 Allowed Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.501 ' C ' ' H ' ' A' ' 16' ' ' GLN . 64.2 p -81.74 -23.61 36.57 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.265 -1.138 . . . . 0.0 109.419 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -75.48 32.89 0.11 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.272 -0.893 . . . . 0.0 109.505 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.501 ' H ' ' C ' ' A' ' 14' ' ' THR . 1.9 pp0? -171.47 4.44 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.25 -0.906 . . . . 0.0 109.515 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -70.3 -28.5 65.23 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.221 -0.925 . . . . 0.0 109.493 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 31.3 p90 -163.3 -172.76 3.09 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.203 -0.936 . . . . 0.0 109.453 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.408 ' O ' ' O ' ' A' ' 20' ' ' THR . 61.2 t-80 -165.15 -11.02 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.255 -0.903 . . . . 0.0 109.481 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.408 ' O ' ' O ' ' A' ' 19' ' ' HIS . 22.7 m 53.29 97.76 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.258 -0.901 . . . . 0.0 109.431 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -168.27 -105.24 0.18 Allowed Glycine 0 N--CA 1.489 2.232 0 N-CA-C 109.452 -1.459 . . . . 0.0 109.452 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -67.77 101.7 1.1 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.282 -1.128 . . . . 0.0 109.468 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.9 tp -73.22 75.44 1.3 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.233 -0.917 . . . . 0.0 109.371 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 34.4 m -75.72 1.74 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.214 -0.928 . . . . 0.0 109.53 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.472 ' HG1' ' N ' ' A' ' 26' ' ' THR . 30.4 p -64.08 -31.18 72.28 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.215 -0.928 . . . . 0.0 109.493 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.472 ' N ' ' HG1' ' A' ' 25' ' ' THR . 56.9 m -166.34 145.71 5.88 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.265 -0.897 . . . . 0.0 109.384 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 15.2 pttp -169.3 122.99 0.79 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.253 -0.904 . . . . 0.0 109.433 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 55.26 175.26 0.13 Allowed Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.556 -1.417 . . . . 0.0 109.556 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 48.1 m-20 -154.34 130.36 10.25 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.371 -1.076 . . . . 0.0 109.363 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.436 ' HZ2' ' CB ' ' A' ' 30' ' ' LYS . 0.4 OUTLIER -65.99 -136.4 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.259 -0.901 . . . . 0.0 109.481 -179.982 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.428 ' O ' ' O ' ' A' ' 30' ' ' LYS . 15.6 mm-40 52.13 97.14 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.906 -1.121 . . . . 0.0 109.113 -179.704 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.499 ' CD1' ' N ' ' A' ' 32' ' ' LEU . 8.3 mp -64.5 -40.99 96.68 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.229 -0.92 . . . . 0.0 109.265 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 15.5 mt -79.23 89.99 4.91 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.277 -0.889 . . . . 0.0 109.373 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 21.2 pt -70.06 159.53 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.142 -0.974 . . . . 0.0 109.468 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 53.23 82.82 0.07 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.218 -0.927 . . . . 0.0 109.472 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -71.85 104.18 3.38 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.289 -0.882 . . . . 0.0 109.416 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -70.45 111.11 5.76 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.274 -0.891 . . . . 0.0 109.43 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 68.2 mttm 50.78 -101.29 0.1 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.286 -0.884 . . . . 0.0 109.41 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.45 ' O ' ' N ' ' A' ' 41' ' ' SER . 8.6 p -169.41 -32.85 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.364 -0.835 . . . . 0.0 109.446 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.405 ' C ' ' H ' ' A' ' 42' ' ' GLY . 81.2 p -62.83 80.58 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.219 -0.925 . . . . 0.0 109.464 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.45 ' N ' ' O ' ' A' ' 39' ' ' VAL . 44.4 t -73.35 6.96 2.52 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.26 -0.9 . . . . 0.0 109.476 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.405 ' H ' ' C ' ' A' ' 40' ' ' THR . . . 68.72 63.4 3.53 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.622 ' CD2' ' H ' ' A' ' 43' ' ' HIS . 5.1 p80 -69.71 -104.16 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.25 -1.147 . . . . 0.0 109.429 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.566 ' H ' ' CG ' ' A' ' 43' ' ' HIS . 4.8 m 57.46 45.53 19.53 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.21 -0.931 . . . . 0.0 109.316 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 52.6 m -89.13 111.2 21.91 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.272 -0.892 . . . . 0.0 109.358 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.7 t -60.16 144.71 49.28 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.228 -0.92 . . . . 0.0 109.543 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -167.87 66.63 0.08 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.18 -0.95 . . . . 0.0 109.588 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.57 ' CG ' HH11 ' A' ' 48' ' ' ARG . 3.2 mtt-85 -145.54 142.89 29.59 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.207 -0.933 . . . . 0.0 109.328 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 53.6 mtp180 -88.62 137.6 32.17 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.346 -0.846 . . . . 0.0 110.059 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.9 m 58.22 169.99 0.05 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.383 -0.823 . . . . 0.0 110.149 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.44 ' SG ' ' N ' ' A' ' 52' ' ' SER . 31.2 p -66.83 -38.08 85.74 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.436 -0.79 . . . . 0.0 109.397 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.492 ' OG ' ' N ' ' A' ' 53' ' ' LYS . 15.0 t -58.09 -161.36 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.371 -0.831 . . . . 0.0 108.984 179.807 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.492 ' N ' ' OG ' ' A' ' 52' ' ' SER . 36.1 ttpt -121.83 102.01 7.93 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.263 -0.898 . . . . 0.0 109.252 179.393 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 74.5 t -129.33 117.81 44.14 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -127.28 132.0 69.99 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 O-C-N 121.431 -0.793 . . . . 0.0 109.077 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 69.4 p -129.22 114.9 16.85 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.381 -0.824 . . . . 0.0 109.185 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.46 ' H ' ' HB ' ' A' ' 69' ' ' THR . 9.1 ttmm -127.19 113.99 17.08 Favored 'General case' 0 N--CA 1.52 3.056 0 N-CA-C 109.3 -0.629 . . . . 0.0 109.3 178.671 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 33.7 p -119.76 132.06 55.53 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.494 -0.754 . . . . 0.0 109.429 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.427 ' O ' ' CG2' ' A' ' 59' ' ' VAL . 2.8 m -132.54 120.25 41.63 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.177 0 O-C-N 121.383 -0.823 . . . . 0.0 109.534 179.133 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 35.9 p -109.77 133.01 53.62 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.781 -0.574 . . . . 0.0 109.523 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -136.3 170.23 16.37 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.263 -0.898 . . . . 0.0 109.674 179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.456 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -63.42 -40.78 98.1 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.88 -1.138 . . . . 0.0 112.766 -177.275 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.425 ' OD1' ' N ' ' A' ' 63' ' ' ASP . 18.6 p-10 -68.54 5.24 1.09 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.38 -1.45 . . . . 0.0 110.065 -178.305 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.528 ' O ' ' N ' ' A' ' 66' ' ' THR . . . 90.51 8.9 65.38 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.978 -1.249 . . . . 0.0 109.978 179.098 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 36.4 ttp180 -65.21 78.77 0.05 Allowed 'General case' 0 N--CA 1.486 1.343 0 O-C-N 120.689 -1.477 . . . . 0.0 107.915 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.528 ' N ' ' O ' ' A' ' 64' ' ' GLY . 70.3 p -110.03 77.65 1.07 Allowed 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 -179.356 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.0 tm-20 -92.78 119.81 32.52 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.418 -0.801 . . . . 0.0 109.214 -179.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 12.7 p -99.31 109.71 22.31 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.353 -0.842 . . . . 0.0 109.677 -179.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.504 ' O ' ' N ' ' A' ' 71' ' ' GLU . 4.2 m -97.02 25.41 5.41 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 107.173 -1.418 . . . . 0.0 107.173 178.561 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -65.76 70.13 0.05 Allowed 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 179.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.504 ' N ' ' O ' ' A' ' 69' ' ' THR . 81.2 mt-10 -110.13 155.04 22.46 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.538 -0.726 . . . . 0.0 110.043 -179.052 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.9 m -127.78 134.85 64.54 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 179.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 16.4 t -128.91 116.32 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 CA-C-O 121.996 0.903 . . . . 0.0 109.382 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.4 ptmm? -52.69 178.56 0.02 OUTLIER 'General case' 0 C--N 1.289 -2.023 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 85.2 p -66.02 -112.88 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.239 -0.913 . . . . 0.0 109.311 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.411 ' OE1' ' OD2' ' A' ' 77' ' ' ASP . 0.4 OUTLIER -168.2 -56.27 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.187 -0.945 . . . . 0.0 109.155 179.834 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.411 ' OD2' ' OE1' ' A' ' 76' ' ' GLU . 79.0 m-20 -125.08 -6.31 7.24 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.589 -0.694 . . . . 0.0 109.409 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 82.38 43.36 8.0 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 109.292 -1.523 . . . . 0.0 109.292 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 90.7 p -68.07 -20.75 64.98 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.329 -1.101 . . . . 0.0 109.7 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -164.84 27.3 0.06 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.105 -0.997 . . . . 0.0 109.651 -179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.493 ' C ' ' H ' ' A' ' 83' ' ' ASP . 11.7 m -146.08 -75.04 0.21 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.211 -0.931 . . . . 0.0 109.601 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -68.15 7.67 2.38 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.493 ' H ' ' C ' ' A' ' 81' ' ' CYS . 47.9 m-20 49.92 -164.77 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.211 -1.17 . . . . 0.0 109.369 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -171.23 37.16 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.221 -0.924 . . . . 0.0 109.493 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -65.88 -16.83 64.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.242 -0.911 . . . . 0.0 109.472 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -70.5 -174.59 0.89 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.184 -0.948 . . . . 0.0 109.498 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 26.0 t70 53.12 42.54 32.18 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.253 -0.904 . . . . 0.0 109.599 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 29.8 t90 -66.04 -75.98 0.08 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.264 -0.898 . . . . 0.0 109.445 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.662 ' CG ' ' H ' ' A' ' 90' ' ' HIS . 13.1 t60 -70.81 -171.38 0.52 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.284 -0.885 . . . . 0.0 109.405 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.662 ' H ' ' CG ' ' A' ' 89' ' ' HIS . 13.7 p80 -158.0 54.25 0.46 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.208 -0.932 . . . . 0.0 109.421 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.43 ' O ' ' O ' ' A' ' 92' ' ' PHE . 17.5 m -165.3 66.68 0.13 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.308 -0.87 . . . . 0.0 109.378 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.43 ' O ' ' O ' ' A' ' 91' ' ' THR . 3.9 m-85 62.11 149.59 0.1 OUTLIER Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 121.406 -0.809 . . . . 0.0 108.853 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -56.54 153.99 32.68 Favored 'Trans proline' 0 C--N 1.323 -0.798 0 C-N-CA 120.887 1.058 . . . . 0.0 109.634 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 30.7 t -74.07 125.59 28.66 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.246 -0.909 . . . . 0.0 109.28 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.663 ' H ' ' NE ' ' A' ' 95' ' ' ARG . 0.1 OUTLIER -65.32 -166.72 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.198 -0.939 . . . . 0.0 109.159 -179.922 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -156.5 -57.05 0.01 OUTLIER Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.441 -1.463 . . . . 0.0 109.441 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -68.98 91.99 0.5 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.258 -1.142 . . . . 0.0 109.405 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.447 ' C ' ' H ' ' A' ' 100' ' ' ASP . 15.0 mt -68.51 -147.4 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.235 -0.915 . . . . 0.0 109.524 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.49 ' C ' ' H ' ' A' ' 101' ' ' PHE . 0.8 OUTLIER -55.98 -8.83 0.49 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.213 -0.929 . . . . 0.0 109.502 -179.923 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.447 ' H ' ' C ' ' A' ' 98' ' ' LEU . 65.1 t0 -68.29 45.71 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.264 -0.897 . . . . 0.0 109.413 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.49 ' H ' ' C ' ' A' ' 99' ' ' ASP . 52.9 t80 -77.43 -22.39 51.56 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.3 -0.875 . . . . 0.0 109.457 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -87.22 142.82 27.62 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.246 -0.908 . . . . 0.0 109.447 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 24.7 m80 -73.33 -22.7 60.26 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.232 -0.917 . . . . 0.0 109.477 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.562 HH11 ' CG ' ' A' ' 104' ' ' ARG . 3.4 mtt-85 50.93 -100.57 0.09 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.181 -0.949 . . . . 0.0 109.445 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.496 ' CG ' ' H ' ' A' ' 106' ' ' LYS . 31.5 t70 53.35 -176.74 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.221 -0.924 . . . . 0.0 109.394 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.496 ' H ' ' CG ' ' A' ' 105' ' ' ASP . 40.3 tptt -68.78 68.34 0.15 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.231 -0.918 . . . . 0.0 109.414 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.481 ' C ' ' H ' ' A' ' 109' ' ' PHE . 27.8 p30 -75.07 -6.19 48.17 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.287 -0.883 . . . . 0.0 109.5 -179.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -62.56 0.11 0.53 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.262 -0.899 . . . . 0.0 109.474 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . 0.481 ' H ' ' C ' ' A' ' 107' ' ' ASP . 84.1 t80 -68.26 -12.35 60.87 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.242 -0.911 . . . . 0.0 109.494 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -70.9 -21.02 62.43 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.313 -0.867 . . . . 0.0 109.452 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 69.8 p -63.38 -75.91 0.07 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.273 -0.892 . . . . 0.0 109.498 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.571 ' CG ' HH11 ' A' ' 112' ' ' ARG . 0.3 OUTLIER 52.93 76.67 0.19 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.242 -0.911 . . . . 0.0 109.493 -179.984 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.503 ' O ' ' N ' ' A' ' 115' ' ' HIS . 46.2 t -170.35 -144.09 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.249 -0.907 . . . . 0.0 109.495 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.447 ' N ' ' OG ' ' A' ' 113' ' ' SER . 41.5 t -66.53 64.6 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.28 -0.888 . . . . 0.0 109.438 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . 0.503 ' N ' ' O ' ' A' ' 113' ' ' SER . 52.4 t-80 -166.26 63.37 0.1 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.232 -0.918 . . . . 0.0 109.458 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -151.5 -56.43 0.15 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.235 -0.916 . . . . 0.0 109.347 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.518 ' O ' ' N ' ' A' ' 119' ' ' GLY . 72.3 t80 -65.68 -11.19 42.94 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.25 -0.907 . . . . 0.0 109.459 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 20.0 t70 50.99 -90.59 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.229 -0.92 . . . . 0.0 109.578 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' A' ' 117' ' ' PHE . . . -162.17 -179.72 36.98 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.449 -1.461 . . . . 0.0 109.449 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.487 ' C ' ' H ' ' A' ' 122' ' ' GLY . 51.3 mtp180 -57.31 160.79 3.71 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.264 -1.139 . . . . 0.0 109.52 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 76.5 p -72.18 13.84 0.28 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.291 -0.881 . . . . 0.0 109.444 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . 0.487 ' H ' ' C ' ' A' ' 120' ' ' ARG . . . -165.53 105.75 0.25 Allowed Glycine 0 N--CA 1.49 2.261 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 15.9 mt -67.56 127.56 33.2 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.24 -1.153 . . . . 0.0 109.212 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -73.32 162.15 75.75 Favored Pre-proline 0 N--CA 1.489 1.482 0 O-C-N 121.229 -0.919 . . . . 0.0 108.814 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . 0.454 ' C ' ' H ' ' A' ' 127' ' ' PHE . 2.3 Cg_endo -55.99 177.79 0.13 Allowed 'Trans proline' 0 C--N 1.319 -1.021 0 C-N-CA 121.354 1.37 . . . . 0.0 109.69 179.625 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -78.43 29.22 0.19 Allowed 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.215 -0.928 . . . . 0.0 109.443 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . 0.514 ' CE2' ' O ' ' A' ' 128' ' ' ALA . 68.7 t80 -76.06 176.39 8.01 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.219 -0.926 . . . . 0.0 109.381 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.514 ' O ' ' CE2' ' A' ' 127' ' ' PHE . . . -161.17 -136.36 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.319 -0.863 . . . . 0.0 109.528 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -169.16 -69.82 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.185 -0.947 . . . . 0.0 109.449 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.421 ' O ' ' O ' ' A' ' 131' ' ' GLY . 1.8 tt -62.26 -73.67 0.1 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.167 -0.958 . . . . 0.0 109.026 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . 0.421 ' O ' ' O ' ' A' ' 130' ' ' LEU . . . 61.17 146.66 0.01 OUTLIER Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.674 -1.37 . . . . 0.0 109.674 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . 0.543 ' CD ' ' H ' ' A' ' 132' ' ' GLU . 1.4 pm0 -54.59 -26.42 32.35 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.25 -1.147 . . . . 0.0 109.39 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 69.0 m -83.36 96.01 8.39 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.317 -0.864 . . . . 0.0 109.477 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -67.45 -14.05 63.9 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' SER . . . . . 0.485 ' OG ' ' N ' ' A' ' 136' ' ' SER . 28.8 t -172.52 -130.59 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.307 -1.114 . . . . 0.0 109.439 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' SER . . . . . 0.485 ' N ' ' OG ' ' A' ' 135' ' ' SER . 18.4 p 54.77 13.6 0.74 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.242 -0.911 . . . . 0.0 109.479 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 42.9 t -72.71 151.27 42.28 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.341 -0.849 . . . . 0.0 109.499 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 10.7 m 53.88 -121.73 1.88 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.241 -0.912 . . . . 0.0 109.438 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 56.4 mttp -61.75 -153.17 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.202 -0.936 . . . . 0.0 109.432 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' THR . . . . . 0.428 ' O ' ' OG ' ' A' ' 141' ' ' SER . 1.3 t -164.99 -22.45 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.264 -0.898 . . . . 0.0 109.407 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' SER . . . . . 0.428 ' OG ' ' O ' ' A' ' 140' ' ' THR . 5.4 p 61.17 149.22 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.372 -0.83 . . . . 0.0 109.447 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 69.5 p -78.89 52.59 1.26 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.312 -0.867 . . . . 0.0 109.52 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . 0.404 ' O ' ' OG ' ' A' ' 144' ' ' SER . 13.3 m-70 51.79 -158.57 0.11 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.234 -0.917 . . . . 0.0 109.453 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' SER . . . . . 0.438 ' O ' ' N ' ' A' ' 146' ' ' GLN . 74.6 m -166.6 48.65 0.07 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.174 -0.954 . . . . 0.0 109.461 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -69.65 65.02 0.2 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.282 -0.886 . . . . 0.0 109.462 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . 0.438 ' N ' ' O ' ' A' ' 144' ' ' SER . 11.2 tt0 -73.02 75.86 1.2 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.234 -0.916 . . . . 0.0 109.55 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -71.1 154.39 41.79 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.273 -0.892 . . . . 0.0 109.471 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 8.2 p -170.12 161.66 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.292 -0.88 . . . . 0.0 109.474 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 73.6 m -158.07 -95.59 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.233 -0.917 . . . . 0.0 109.469 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 18.0 t -172.41 -2.73 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.253 -0.904 . . . . 0.0 109.487 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 44.0 t -62.47 111.35 2.0 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.183 -0.948 . . . . 0.0 109.511 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 24.8 m 53.26 94.49 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.259 -0.901 . . . . 0.0 109.482 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -67.67 79.84 0.19 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.295 -0.878 . . . . 0.0 109.499 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 27.4 m -61.62 -17.7 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.232 -0.918 . . . . 0.0 109.485 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . 0.514 ' ND2' ' H ' ' A' ' 157' ' ' GLY . 15.9 t30 -61.31 178.69 0.26 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.195 -0.941 . . . . 0.0 109.424 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . 0.47 ' H ' ' CG ' ' A' ' 155' ' ' ASN . 28.7 ptt180 -168.66 52.53 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.304 -0.873 . . . . 0.0 109.505 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . 0.514 ' H ' ' ND2' ' A' ' 155' ' ' ASN . . . -70.89 -65.82 2.36 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 170.57 150.65 7.06 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 27.4 m -165.08 154.74 13.07 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.254 -1.144 . . . . 0.0 109.478 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -82.58 33.67 0.42 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.222 -0.923 . . . . 0.0 109.498 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 95.8 mt -67.22 -71.26 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.202 -0.936 . . . . 0.0 109.488 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -78.86 109.59 13.27 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.285 -0.884 . . . . 0.0 109.45 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 89.8 p -163.95 126.16 2.42 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.231 -0.918 . . . . 0.0 109.473 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 4.8 tmtp? 56.7 34.61 24.87 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.253 -0.904 . . . . 0.0 109.129 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 75.8 m-70 48.04 -168.48 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.189 -0.944 . . . . 0.0 109.72 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 63.8 t80 . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 117.954 -1.022 . . . . 0.0 109.489 -179.918 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.6 mmt . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -61.92 -60.71 7.62 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 24.4 m 52.94 96.8 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.254 -1.145 . . . . 0.0 109.45 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.516 ' O ' ' CD2' ' A' ' 4' ' ' PHE . 70.9 t80 -169.22 36.44 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.242 -0.911 . . . . 0.0 109.475 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 52.94 70.39 0.59 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.184 -0.948 . . . . 0.0 109.524 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -170.36 135.18 1.23 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.317 -0.864 . . . . 0.0 109.439 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -170.01 -163.09 0.34 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.133 -0.979 . . . . 0.0 109.472 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -166.34 89.6 0.1 Allowed Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 84.8 p -170.47 120.75 0.59 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.346 -1.09 . . . . 0.0 109.379 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.413 ' O ' ' OG ' ' A' ' 11' ' ' SER . 28.7 m -64.13 166.05 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.272 -0.893 . . . . 0.0 109.482 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.413 ' OG ' ' O ' ' A' ' 10' ' ' VAL . 68.2 m -166.85 87.24 0.3 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.334 -0.854 . . . . 0.0 109.418 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.6 m -72.7 -134.61 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.216 -0.928 . . . . 0.0 109.392 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -52.55 118.17 7.42 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 80.8 p -64.09 104.23 0.7 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.271 -1.135 . . . . 0.0 109.476 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.528 ' O ' ' N ' ' A' ' 17' ' ' GLU . 59.7 mttm 52.57 -133.04 1.87 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.35 -0.844 . . . . 0.0 109.498 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 52.25 -88.52 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.285 -0.884 . . . . 0.0 109.562 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.528 ' N ' ' O ' ' A' ' 15' ' ' LYS . 43.3 tt0 -64.73 -48.65 73.81 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.227 -0.921 . . . . 0.0 109.528 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -82.59 50.72 1.71 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.286 -0.884 . . . . 0.0 109.549 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -171.47 -69.22 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.229 -0.919 . . . . 0.0 109.646 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 82.7 p -63.15 176.15 0.8 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.348 -0.845 . . . . 0.0 109.701 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -158.01 -149.35 5.43 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.14 -1.584 . . . . 0.0 109.14 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 75.3 mttt 58.56 -152.55 0.4 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.143 -1.21 . . . . 0.0 109.579 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.9 tp 68.71 172.21 0.29 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.226 -0.921 . . . . 0.0 108.991 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.506 ' O ' ' N ' ' A' ' 26' ' ' THR . 13.1 p -69.51 -5.95 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.119 -0.988 . . . . 0.0 109.472 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.594 ' HG1' ' H ' ' A' ' 26' ' ' THR . 69.1 p 48.39 -92.02 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.255 -0.903 . . . . 0.0 109.667 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.594 ' H ' ' HG1' ' A' ' 25' ' ' THR . 29.9 m -162.34 -0.71 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.195 -0.941 . . . . 0.0 109.462 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -80.85 46.95 0.93 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.105 -0.997 . . . . 0.0 109.496 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -160.5 -152.45 6.57 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.514 -1.435 . . . . 0.0 109.514 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -164.15 -0.17 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.248 -1.148 . . . . 0.0 109.385 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -60.66 99.03 0.07 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.242 -0.911 . . . . 0.0 109.427 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -68.62 143.29 54.87 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.226 -0.921 . . . . 0.0 109.318 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.4 tp -66.76 -22.07 66.05 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.229 -0.919 . . . . 0.0 109.439 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.499 ' CD1' ' N ' ' A' ' 33' ' ' LEU . 8.5 mp -78.08 120.49 22.98 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.325 -0.86 . . . . 0.0 109.291 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.426 ' O ' ' O ' ' A' ' 33' ' ' LEU . 67.3 mt 52.63 99.69 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.295 -0.878 . . . . 0.0 109.598 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.416 ' OD1' ' N ' ' A' ' 35' ' ' ASP . 15.3 p-10 -75.18 122.83 24.23 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.239 -0.913 . . . . 0.0 109.395 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 -67.86 94.74 0.48 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.223 -0.923 . . . . 0.0 109.509 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 50.15 -148.72 0.29 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.261 -0.9 . . . . 0.0 109.535 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 19.7 pttp -163.92 57.19 0.16 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.212 -0.93 . . . . 0.0 109.436 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 20.8 t 53.35 72.68 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.242 -0.911 . . . . 0.0 109.479 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 62.2 m -78.17 155.75 30.23 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.244 -0.91 . . . . 0.0 109.436 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 90.8 p -60.9 104.88 0.4 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.292 -0.88 . . . . 0.0 109.533 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 173.48 144.65 4.79 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.527 ' HD1' ' N ' ' A' ' 44' ' ' THR . 3.0 p80 -170.06 -16.55 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.331 -1.099 . . . . 0.0 109.439 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.527 ' N ' ' HD1' ' A' ' 43' ' ' HIS . 37.3 m -62.74 -72.82 0.12 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.271 -0.893 . . . . 0.0 109.481 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 81.6 p -68.77 101.14 1.27 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.28 -0.887 . . . . 0.0 109.429 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 41.1 p -152.86 -39.33 0.1 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.269 -0.894 . . . . 0.0 109.441 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.9 m -165.85 31.08 0.05 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.289 -0.882 . . . . 0.0 109.382 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 10.1 ptp180 -146.12 143.37 29.3 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.121 -0.987 . . . . 0.0 109.214 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.467 ' N ' ' CD ' ' A' ' 49' ' ' ARG . 11.1 mpt_? -88.14 127.4 35.43 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.068 -1.02 . . . . 0.0 109.448 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.413 ' O ' ' O ' ' A' ' 51' ' ' CYS . 98.6 p -58.24 -62.48 1.8 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.292 -0.88 . . . . 0.0 109.663 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.415 ' SG ' ' N ' ' A' ' 52' ' ' SER . 36.8 t -50.81 -97.14 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.213 -0.929 . . . . 0.0 109.703 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.415 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 30.8 t -51.1 150.12 3.36 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.294 -0.879 . . . . 0.0 109.721 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -85.2 105.01 15.59 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.28 -0.888 . . . . 0.0 109.106 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 99.4 t -126.55 119.68 54.3 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.517 -0.739 . . . . 0.0 110.021 -179.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 19.3 tt -127.13 128.74 70.73 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 179.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 48.7 p -130.42 120.71 24.64 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.247 -0.908 . . . . 0.0 110.357 -179.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.6 mttp -121.04 111.34 17.34 Favored 'General case' 0 N--CA 1.509 2.506 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 177.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 52.0 p -119.26 139.43 51.9 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.377 -0.827 . . . . 0.0 109.498 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.8 m -132.48 121.12 44.74 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 O-C-N 121.542 -0.724 . . . . 0.0 109.184 178.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -109.49 135.55 50.32 Favored 'General case' 0 N--CA 1.497 1.909 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 179.607 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.835 HD21 ' H ' ' A' ' 63' ' ' ASP . 0.2 OUTLIER -153.11 153.49 32.92 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 120.661 -1.274 . . . . 0.0 109.536 -179.814 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.699 ' N ' HD21 ' A' ' 61' ' ' ASN . . . -74.36 -11.9 60.38 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 120.498 -1.376 . . . . 0.0 112.091 -178.556 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.835 ' H ' HD21 ' A' ' 61' ' ' ASN . 11.7 p30 -74.32 2.19 9.87 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.043 -1.036 . . . . 0.0 109.743 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.78 11.16 62.24 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 36.9 ttm180 -96.08 99.09 10.88 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.011 -1.288 . . . . 0.0 109.123 179.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 68.4 p -125.8 83.4 2.16 Favored 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -94.99 129.76 41.92 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.348 -0.845 . . . . 0.0 111.065 -178.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.1 p -108.45 112.43 24.83 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 179.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.522 ' O ' ' N ' ' A' ' 71' ' ' GLU . 3.6 m -106.47 31.06 5.47 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 179.106 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.9 mttm -64.13 70.79 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 119.808 -0.757 . . . . 0.0 109.388 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.522 ' N ' ' O ' ' A' ' 69' ' ' THR . 51.7 mt-10 -89.55 140.18 29.8 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.242 -0.911 . . . . 0.0 109.274 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 23.6 m -127.39 136.31 60.94 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 17.2 t -128.2 117.38 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.976 0 CA-C-O 122.186 0.993 . . . . 0.0 109.122 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.412 ' O ' ' O ' ' A' ' 75' ' ' SER . 94.1 mttt -94.08 -2.95 52.05 Favored 'General case' 0 C--N 1.291 -1.949 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.561 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.412 ' O ' ' O ' ' A' ' 74' ' ' LYS . 8.4 m 51.34 -178.89 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.252 -0.905 . . . . 0.0 109.235 -179.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.466 ' N ' ' CD ' ' A' ' 76' ' ' GLU . 1.4 pm0 -157.94 44.84 0.33 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.213 -0.929 . . . . 0.0 109.604 -179.812 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -153.5 17.85 0.54 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.278 -0.889 . . . . 0.0 109.722 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 70.42 63.91 3.06 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 109.614 -1.395 . . . . 0.0 109.614 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 49.5 m -52.88 -53.94 41.75 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.216 -1.167 . . . . 0.0 109.293 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -155.45 9.61 0.29 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.248 -0.908 . . . . 0.0 109.158 179.684 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 85.6 m -131.72 -89.72 0.44 Allowed 'General case' 0 N--CA 1.498 1.952 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.498 ' C ' ' H ' ' A' ' 84' ' ' ALA . . . -179.44 31.13 0.06 OUTLIER Glycine 0 N--CA 1.489 2.203 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 68.6 m-20 -64.02 1.34 0.7 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.233 -1.157 . . . . 0.0 109.446 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.498 ' H ' ' C ' ' A' ' 82' ' ' GLY . . . -65.11 -144.29 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.266 -0.896 . . . . 0.0 109.422 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.522 ' O ' ' CG ' ' A' ' 86' ' ' PHE . 6.1 p-10 -168.86 -115.71 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.288 -0.883 . . . . 0.0 109.423 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.522 ' CG ' ' O ' ' A' ' 85' ' ' ASP . 90.7 m-85 -158.91 78.12 0.76 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.294 -0.879 . . . . 0.0 109.456 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -157.71 46.46 0.37 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.284 -0.885 . . . . 0.0 109.348 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 26.4 t-105 -57.24 150.15 18.44 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.229 -0.919 . . . . 0.0 109.476 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.522 ' O ' ' CG ' ' A' ' 90' ' ' HIS . 29.4 t-80 -166.19 93.38 0.52 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.246 -0.909 . . . . 0.0 109.472 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.522 ' CG ' ' O ' ' A' ' 89' ' ' HIS . 61.5 m80 -157.27 176.67 12.4 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.247 -0.908 . . . . 0.0 109.313 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.4 m -69.13 -145.09 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.215 -0.928 . . . . 0.0 109.245 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 52.1 t80 45.42 67.25 4.38 Favored Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 121.222 -0.924 . . . . 0.0 109.922 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -61.95 -163.9 0.04 OUTLIER 'Trans proline' 0 C--N 1.317 -1.095 0 C-N-CA 121.371 1.381 . . . . 0.0 109.768 -179.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 62.4 m -163.1 109.22 1.15 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.296 -0.877 . . . . 0.0 109.385 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 36.0 ttp180 -64.96 134.1 53.18 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.239 -0.913 . . . . 0.0 109.499 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -73.81 107.71 2.32 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -78.72 48.3 0.8 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.213 -1.169 . . . . 0.0 109.464 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 17.0 mt -69.46 172.93 6.48 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.163 -0.96 . . . . 0.0 109.392 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.501 ' O ' ' N ' ' A' ' 101' ' ' PHE . 34.9 t70 -168.58 -75.06 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.204 -0.935 . . . . 0.0 109.461 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -65.5 68.68 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.302 -0.873 . . . . 0.0 109.522 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.501 ' N ' ' O ' ' A' ' 99' ' ' ASP . 81.5 t80 -77.81 -28.21 50.3 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.214 -0.929 . . . . 0.0 109.421 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.521 ' O ' ' CD2' ' A' ' 102' ' ' PHE . 81.2 t80 -169.54 7.58 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.193 -0.942 . . . . 0.0 109.555 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -63.5 -42.62 98.5 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.18 -0.95 . . . . 0.0 109.533 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -65.75 169.03 6.9 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.336 -0.852 . . . . 0.0 109.523 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 52.57 75.05 0.25 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.222 -0.924 . . . . 0.0 109.515 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 18.8 ttpp -63.74 124.19 20.81 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.222 -0.924 . . . . 0.0 109.459 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -167.13 102.42 0.53 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.237 -0.914 . . . . 0.0 109.497 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.48 ' C ' ' H ' ' A' ' 110' ' ' PHE . 13.4 p-10 -170.05 -4.09 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.218 -0.926 . . . . 0.0 109.478 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . 0.51 ' O ' ' CD2' ' A' ' 109' ' ' PHE . 78.5 t80 -65.64 3.06 0.8 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.196 -0.94 . . . . 0.0 109.484 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . 0.519 ' O ' ' CD2' ' A' ' 110' ' ' PHE . 37.8 p90 -162.28 114.07 1.64 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.241 -0.912 . . . . 0.0 109.415 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 78.7 p -67.15 -171.1 0.14 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.29 -0.881 . . . . 0.0 109.501 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.526 ' CG ' HH11 ' A' ' 112' ' ' ARG . 0.2 OUTLIER -71.21 -36.27 71.83 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.311 -0.868 . . . . 0.0 109.496 -179.948 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 24.3 t -173.09 -16.7 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.312 -0.867 . . . . 0.0 109.419 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 92.6 p -63.24 94.7 0.08 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.213 -0.93 . . . . 0.0 109.388 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . 0.524 ' CG ' ' H ' ' A' ' 116' ' ' GLU . 0.4 OUTLIER -72.79 -116.39 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.215 -0.928 . . . . 0.0 109.481 -179.995 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.524 ' H ' ' CG ' ' A' ' 115' ' ' HIS . 37.2 mt-10 -152.56 127.01 9.31 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.134 -0.979 . . . . 0.0 109.284 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -74.21 -104.24 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.314 -0.867 . . . . 0.0 109.566 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.429 ' OD1' ' N ' ' A' ' 119' ' ' GLY . 18.4 p30 -70.23 -116.78 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.292 -0.88 . . . . 0.0 109.546 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.429 ' N ' ' OD1' ' A' ' 118' ' ' ASP . . . 72.06 -158.79 53.52 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.427 ' O ' ' O ' ' A' ' 119' ' ' GLY . 32.8 ptt180 -56.56 -166.45 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.259 -1.142 . . . . 0.0 109.303 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 71.8 p -148.64 -75.94 0.17 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.129 -0.982 . . . . 0.0 109.408 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -171.48 -149.14 6.4 Favored Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 10.7 tp -65.24 136.19 56.31 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.231 -1.158 . . . . 0.0 109.287 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -72.04 162.43 73.57 Favored Pre-proline 0 N--CA 1.491 1.596 0 O-C-N 121.256 -0.903 . . . . 0.0 108.814 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -56.18 143.82 83.25 Favored 'Trans proline' 0 C--N 1.32 -0.947 0 C-N-CA 121.3 1.333 . . . . 0.0 109.73 179.589 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -72.11 -21.71 61.44 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.216 -0.928 . . . . 0.0 109.344 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -140.64 115.87 9.92 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.334 -0.853 . . . . 0.0 109.295 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -72.55 -63.61 1.12 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.235 -0.916 . . . . 0.0 109.502 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -168.67 142.95 3.18 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.219 -0.925 . . . . 0.0 109.568 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.502 ' C ' ' H ' ' A' ' 132' ' ' GLU . 14.3 mt -71.61 51.62 0.19 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.314 -0.866 . . . . 0.0 109.353 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -74.25 35.88 0.94 Allowed Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . 0.502 ' H ' ' C ' ' A' ' 130' ' ' LEU . 44.7 mm-40 -72.0 121.35 19.01 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.286 -1.126 . . . . 0.0 109.51 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' SER . . . . . 0.678 ' HG ' ' H ' ' A' ' 134' ' ' GLY . 47.9 t -71.0 -151.75 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.25 -0.906 . . . . 0.0 109.493 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . 0.678 ' H ' ' HG ' ' A' ' 133' ' ' SER . . . -61.59 -146.84 0.01 OUTLIER Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.485 -1.446 . . . . 0.0 109.485 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 3.8 t 62.35 -73.04 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.393 -1.063 . . . . 0.0 109.643 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' SER . . . . . 0.521 ' N ' ' O ' ' A' ' 134' ' ' GLY . 29.9 t -48.5 -85.34 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.266 -0.896 . . . . 0.0 109.512 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 69.6 m -165.31 72.6 0.19 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.25 -0.906 . . . . 0.0 109.474 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 77.4 p -170.58 37.94 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.254 -0.904 . . . . 0.0 109.511 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.415 ' O ' ' OG1' ' A' ' 140' ' ' THR . 86.2 tttt -70.67 -28.24 64.64 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.199 -0.938 . . . . 0.0 109.43 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' THR . . . . . 0.415 ' OG1' ' O ' ' A' ' 139' ' ' LYS . 32.7 p 48.93 56.95 6.98 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.214 -0.929 . . . . 0.0 109.57 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' SER . . . . . 0.575 ' HG ' ' H ' ' A' ' 142' ' ' THR . 39.3 t -68.97 -125.93 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.23 -0.919 . . . . 0.0 109.393 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' THR . . . . . 0.575 ' H ' ' HG ' ' A' ' 141' ' ' SER . 80.6 p -67.81 -174.79 0.48 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.203 -0.936 . . . . 0.0 109.447 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 46.2 m170 -68.89 -57.47 5.49 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.214 -0.929 . . . . 0.0 109.421 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 31.7 t -169.79 106.79 0.36 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.228 -0.92 . . . . 0.0 109.504 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -69.92 -100.03 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.21 -0.931 . . . . 0.0 109.446 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -170.24 89.25 0.15 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.281 -0.887 . . . . 0.0 109.512 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . 0.488 ' C ' ' H ' ' A' ' 149' ' ' SER . 70.0 m-85 -71.31 152.73 42.96 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.195 -0.941 . . . . 0.0 109.451 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . 0.403 ' C ' ' H ' ' A' ' 150' ' ' SER . 33.5 m -69.5 7.7 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.226 -0.922 . . . . 0.0 109.491 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' SER . . . . . 0.488 ' H ' ' C ' ' A' ' 147' ' ' PHE . 66.3 m -69.96 49.12 0.1 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.237 -0.914 . . . . 0.0 109.49 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' SER . . . . . 0.404 ' OG ' ' O ' ' A' ' 149' ' ' SER . 75.6 m -166.84 28.85 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.257 -0.902 . . . . 0.0 109.467 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' SER . . . . . 0.418 ' C ' ' H ' ' A' ' 153' ' ' THR . 12.2 t 52.8 53.79 11.56 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.214 -0.929 . . . . 0.0 109.451 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 46.5 p -70.81 48.28 0.11 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.258 -0.901 . . . . 0.0 109.458 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' THR . . . . . 0.418 ' H ' ' C ' ' A' ' 151' ' ' SER . 54.0 m -55.49 165.92 0.73 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.218 -0.927 . . . . 0.0 109.416 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 28.3 t -48.2 -32.53 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.246 -0.909 . . . . 0.0 109.558 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 9.5 m120 52.62 95.44 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.249 -0.907 . . . . 0.0 109.601 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 70.4 ttt180 -62.14 112.04 2.21 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.238 -0.914 . . . . 0.0 109.445 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 73.34 -147.58 39.34 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 174.04 -147.37 9.28 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.621 -1.391 . . . . 0.0 109.621 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 90.1 p -59.66 -19.48 49.72 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.244 -1.151 . . . . 0.0 109.436 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -60.67 168.39 2.26 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.221 -0.924 . . . . 0.0 109.45 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 20.6 pt -69.32 167.63 1.74 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.286 -0.884 . . . . 0.0 109.459 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.415 ' O ' ' O ' ' A' ' 163' ' ' SER . 52.4 mt-10 -67.55 -25.76 65.97 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.29 -0.881 . . . . 0.0 109.428 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.415 ' O ' ' O ' ' A' ' 162' ' ' GLU . 12.5 t 52.85 176.95 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.21 -0.931 . . . . 0.0 109.475 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -73.22 -76.64 0.12 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.137 -0.977 . . . . 0.0 109.491 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . 0.442 ' CG ' ' O ' ' A' ' 165' ' ' HIS . 53.9 t-80 -169.49 13.52 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.221 -0.924 . . . . 0.0 109.492 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 57.3 t80 . . . . . 0 N--CA 1.489 1.515 0 CA-C-O 117.992 -1.004 . . . . 0.0 109.488 -179.97 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.1 ptt? . . . . . 0 N--CA 1.49 1.559 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 177.51 33.16 0.05 OUTLIER Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -162.53 72.89 0.36 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.253 -1.145 . . . . 0.0 109.45 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -66.15 -21.32 66.33 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.231 -0.918 . . . . 0.0 109.527 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.0 ptp180 -63.23 -112.77 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.269 -0.894 . . . . 0.0 109.447 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 50.73 36.47 14.35 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.119 -0.988 . . . . 0.0 109.296 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -80.67 -69.05 0.63 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.306 -0.871 . . . . 0.0 109.464 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 178.44 -67.02 0.08 OUTLIER Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.424 ' O ' ' O ' ' A' ' 10' ' ' VAL . 13.0 m 52.19 38.23 23.97 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.225 -1.162 . . . . 0.0 109.458 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.491 ' C ' ' H ' ' A' ' 12' ' ' SER . 32.9 m -61.92 -146.61 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.192 -0.943 . . . . 0.0 109.376 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 87.9 p -58.2 -4.92 0.4 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.196 -0.94 . . . . 0.0 109.491 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.491 ' H ' ' C ' ' A' ' 10' ' ' VAL . 32.6 t -53.01 -86.83 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.157 -0.964 . . . . 0.0 109.496 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 67.03 144.27 0.07 OUTLIER Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.446 ' O ' ' O ' ' A' ' 15' ' ' LYS . 40.0 m -62.65 141.22 58.61 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.223 -1.163 . . . . 0.0 109.493 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.446 ' O ' ' O ' ' A' ' 14' ' ' THR . 18.4 mmmt 54.5 164.37 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.584 -0.698 . . . . 0.0 109.954 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -90.42 73.6 6.95 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.041 -1.037 . . . . 0.0 109.227 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -65.13 -46.44 80.93 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.265 -0.897 . . . . 0.0 109.733 -179.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.51 ' O ' ' CD2' ' A' ' 18' ' ' PHE . 52.6 t80 51.89 29.49 6.1 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.111 -0.993 . . . . 0.0 109.462 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.432 ' O ' ' CG ' ' A' ' 19' ' ' HIS . 46.1 t-80 -170.0 17.18 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.229 -0.919 . . . . 0.0 109.523 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.1 m -69.25 -48.6 61.36 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.266 -0.897 . . . . 0.0 109.467 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 71.62 41.39 57.29 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 32.6 tptt -71.63 1.87 6.04 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.276 -1.132 . . . . 0.0 109.175 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 16.4 mt -63.07 120.91 12.35 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.334 -0.854 . . . . 0.0 109.439 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.9 t -75.47 -28.13 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.282 -0.886 . . . . 0.0 109.444 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.43 ' O ' ' OG1' ' A' ' 26' ' ' THR . 40.9 m -164.02 144.96 8.58 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.245 -0.909 . . . . 0.0 109.518 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.43 ' OG1' ' O ' ' A' ' 25' ' ' THR . 49.7 m -166.51 163.88 17.13 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.384 -0.823 . . . . 0.0 109.24 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.5 tmtm? -158.13 73.93 0.69 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.203 -0.936 . . . . 0.0 109.159 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -155.93 -172.42 23.4 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.457 ' O ' ' N ' ' A' ' 31' ' ' GLU . 15.2 t70 -164.68 -74.54 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.215 -1.167 . . . . 0.0 109.482 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.472 ' N ' ' CD ' ' A' ' 30' ' ' LYS . 11.9 mptt 50.82 -95.01 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.228 -0.92 . . . . 0.0 109.189 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.457 ' N ' ' O ' ' A' ' 29' ' ' ASP . 34.0 tt0 55.17 58.61 4.56 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.311 -0.868 . . . . 0.0 109.475 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 15.5 mt -76.68 2.16 14.99 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.213 -0.93 . . . . 0.0 109.387 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.6 tt -78.75 111.62 15.05 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.267 -0.895 . . . . 0.0 109.11 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 16.2 tt -162.08 152.22 3.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.229 -0.919 . . . . 0.0 109.427 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -64.25 108.98 1.73 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.304 -0.872 . . . . 0.0 109.434 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -170.15 111.88 0.43 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.275 -0.89 . . . . 0.0 109.483 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.544 ' CD ' ' H ' ' A' ' 37' ' ' GLU . 9.0 pm0 -63.06 139.49 58.78 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.207 -0.933 . . . . 0.0 109.524 -179.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -93.55 80.25 4.32 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.186 -0.946 . . . . 0.0 109.48 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.6 p -170.56 142.17 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.206 -0.934 . . . . 0.0 109.551 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.5 t -174.38 -27.87 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.249 -0.907 . . . . 0.0 109.436 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 24.2 t -171.78 161.55 5.96 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.289 -0.882 . . . . 0.0 109.521 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 178.74 -79.46 0.06 OUTLIER Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 15.6 p-80 -52.8 173.96 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.224 -1.163 . . . . 0.0 109.441 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.9 p -149.36 -134.95 0.07 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.291 -0.881 . . . . 0.0 109.421 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.445 ' O ' ' O ' ' A' ' 46' ' ' THR . 67.8 p -79.38 -30.19 42.4 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.187 -0.945 . . . . 0.0 109.488 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.445 ' O ' ' O ' ' A' ' 45' ' ' THR . 4.3 p 57.0 109.76 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.402 -0.811 . . . . 0.0 109.727 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 70.7 p -66.68 49.46 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.311 -0.868 . . . . 0.0 110.026 -179.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.44 ' N ' ' O ' ' A' ' 46' ' ' THR . 84.8 mtt180 -146.0 142.51 28.72 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.174 -0.954 . . . . 0.0 108.946 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 11.3 tpp180 -96.73 121.77 38.95 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.082 -1.011 . . . . 0.0 109.538 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 89.3 p -60.28 -166.33 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.162 -0.961 . . . . 0.0 109.171 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 4.4 t 48.87 -125.67 1.99 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.104 -0.997 . . . . 0.0 109.048 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.442 ' N ' ' SG ' ' A' ' 81' ' ' CYS . 25.0 t -50.18 132.08 23.75 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.802 -1.186 . . . . 0.0 109.059 179.517 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.443 ' O ' ' O ' ' A' ' 73' ' ' VAL . 59.3 tttm -76.9 105.3 7.88 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.86 -1.15 . . . . 0.0 109.558 -179.489 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 47.5 t -123.88 116.08 46.98 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 O-C-N 121.484 -0.76 . . . . 0.0 109.454 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 43.7 mm -122.91 115.97 47.39 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 75.4 p -128.6 111.6 13.39 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.328 -0.858 . . . . 0.0 109.243 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.682 ' H ' ' HG1' ' A' ' 69' ' ' THR . 7.3 mtmt -124.67 113.46 18.03 Favored 'General case' 0 N--CA 1.515 2.775 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.793 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 58.9 p -119.4 131.84 55.73 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.549 -0.719 . . . . 0.0 109.117 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.406 ' CG2' ' OE1' ' A' ' 67' ' ' GLU . 2.8 m -133.47 126.79 52.58 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.2 0 O-C-N 121.476 -0.765 . . . . 0.0 109.605 179.421 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.6 t -108.13 134.16 51.39 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.429 -0.795 . . . . 0.0 109.34 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -125.89 162.02 26.13 Favored 'General case' 0 N--CA 1.516 2.875 0 O-C-N 121.503 -0.748 . . . . 0.0 109.304 179.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.405 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -73.05 -36.4 66.88 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.648 -1.283 . . . . 0.0 111.895 -178.238 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -72.83 7.05 2.17 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.571 -1.33 . . . . 0.0 109.874 -179.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.405 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 85.19 7.49 83.1 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.334 -1.506 . . . . 0.0 109.334 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 18.0 tpt180 -82.8 109.32 16.84 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 120.949 -1.324 . . . . 0.0 107.818 178.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.9 p -140.42 151.42 44.9 Favored 'General case' 0 C--N 1.306 -1.301 0 O-C-N 121.217 -0.927 . . . . 0.0 108.678 -178.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.406 ' OE1' ' CG2' ' A' ' 59' ' ' VAL . 24.4 mp0 -131.43 117.43 18.84 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 179.428 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.8 p -100.89 105.97 17.28 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.189 -0.944 . . . . 0.0 110.16 -179.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.682 ' HG1' ' H ' ' A' ' 57' ' ' LYS . 78.3 p -109.82 30.51 6.62 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 178.626 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.0 ptpt -66.74 66.0 0.06 Allowed 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 179.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.504 ' N ' ' O ' ' A' ' 69' ' ' THR . 63.2 mm-40 -108.17 151.59 25.71 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.425 -0.797 . . . . 0.0 110.147 -179.152 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 12.7 m -127.97 135.11 63.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.443 ' O ' ' O ' ' A' ' 53' ' ' LYS . 16.4 t -129.34 115.64 36.22 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 CA-C-O 122.235 1.017 . . . . 0.0 109.625 179.662 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 45.5 mttp -74.02 150.06 40.88 Favored 'General case' 0 C--N 1.289 -2.027 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.428 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 32.2 t -74.92 111.65 10.34 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.238 -0.914 . . . . 0.0 109.489 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 -71.37 -10.84 60.41 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.25 -0.906 . . . . 0.0 109.237 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -105.78 -18.19 14.14 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.49 -0.756 . . . . 0.0 109.522 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.34 -37.93 90.96 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.399 -1.481 . . . . 0.0 109.399 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 6.2 m 55.83 11.44 0.69 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.34 -1.094 . . . . 0.0 109.719 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -163.69 20.22 0.07 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.087 -1.008 . . . . 0.0 109.628 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.442 ' SG ' ' N ' ' A' ' 52' ' ' SER . 6.2 t -136.39 115.07 12.01 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.527 -0.733 . . . . 0.0 109.313 -179.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.47 -46.36 3.55 Favored Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.4 -1.48 . . . . 0.0 109.4 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -81.45 122.99 28.21 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.29 -1.123 . . . . 0.0 109.386 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.433 ' C ' ' H ' ' A' ' 86' ' ' PHE . . . -169.0 33.01 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.301 -0.874 . . . . 0.0 109.384 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -76.38 41.26 0.24 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.194 -0.941 . . . . 0.0 109.215 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.433 ' H ' ' C ' ' A' ' 84' ' ' ALA . 85.0 m-85 -64.38 -179.43 0.46 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.411 -0.806 . . . . 0.0 109.297 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.424 ' O ' ' N ' ' A' ' 89' ' ' HIS . 59.5 m-20 -157.55 -66.95 0.1 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.274 -0.891 . . . . 0.0 109.38 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . 0.544 ' C ' ' H ' ' A' ' 90' ' ' HIS . 96.9 m95 51.49 -95.27 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.25 -0.906 . . . . 0.0 109.57 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.424 ' N ' ' O ' ' A' ' 87' ' ' ASP . 0.8 OUTLIER 61.54 -4.18 0.18 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.507 -0.746 . . . . 0.0 109.98 -179.886 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.544 ' H ' ' C ' ' A' ' 88' ' ' TRP . 30.2 m-70 45.4 58.95 3.83 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.121 -0.987 . . . . 0.0 109.904 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.43 ' O ' ' O ' ' A' ' 90' ' ' HIS . 5.5 m 56.88 165.29 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.247 -0.908 . . . . 0.0 109.337 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -59.56 149.97 68.13 Favored Pre-proline 0 N--CA 1.49 1.573 0 O-C-N 121.214 -0.929 . . . . 0.0 108.936 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -57.17 -42.74 59.94 Favored 'Trans proline' 0 C--N 1.323 -0.805 0 C-N-CA 121.006 1.137 . . . . 0.0 109.719 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 8.6 t 55.81 63.58 2.0 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.297 -0.877 . . . . 0.0 109.451 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 55.1 mtp180 -74.09 -144.23 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.29 -0.881 . . . . 0.0 109.48 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -175.29 9.76 0.03 OUTLIER Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -70.12 -21.5 63.1 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.287 -1.125 . . . . 0.0 109.495 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 59.5 tp -59.25 131.74 51.91 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.282 -0.886 . . . . 0.0 109.233 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.412 ' O ' ' O ' ' A' ' 100' ' ' ASP . 26.3 t0 -168.18 68.51 0.08 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.249 -0.907 . . . . 0.0 109.556 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.412 ' O ' ' O ' ' A' ' 99' ' ' ASP . 29.6 m-20 50.72 -177.9 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.213 -0.929 . . . . 0.0 109.516 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -76.83 -53.8 7.44 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.249 -0.907 . . . . 0.0 109.467 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 51.8 91.61 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.222 -0.924 . . . . 0.0 109.0 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 -76.59 -22.64 53.95 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.236 -0.915 . . . . 0.0 109.274 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.57 HH11 ' CG ' ' A' ' 104' ' ' ARG . 0.0 OUTLIER -167.55 137.27 2.75 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.246 -0.909 . . . . 0.0 109.4 179.974 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.51 ' O ' ' N ' ' A' ' 107' ' ' ASP . 3.8 p30 -73.83 122.36 22.35 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.233 -0.917 . . . . 0.0 109.48 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 19.8 mtpp -62.6 77.25 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.262 -0.899 . . . . 0.0 109.347 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.51 ' N ' ' O ' ' A' ' 105' ' ' ASP . 5.6 p-10 -57.83 167.89 1.05 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.341 -0.849 . . . . 0.0 109.628 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.413 ' OD1' ' N ' ' A' ' 108' ' ' ASP . 19.3 p-10 -167.24 65.68 0.09 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.312 -0.868 . . . . 0.0 109.173 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 46.6 m-85 -59.93 -46.22 90.09 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.272 -0.892 . . . . 0.0 109.858 -179.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 -51.55 151.36 3.21 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.023 -1.048 . . . . 0.0 109.822 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 81.6 p -135.94 -62.44 0.68 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.547 -0.721 . . . . 0.0 109.12 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 17.3 tpt180 -75.02 122.65 23.84 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.295 -0.878 . . . . 0.0 109.288 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 72.4 m -165.73 -99.68 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.225 -0.922 . . . . 0.0 109.493 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 23.8 t -170.34 2.56 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.301 -0.874 . . . . 0.0 109.498 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . 0.416 ' HD1' ' H ' ' A' ' 115' ' ' HIS . 31.6 m80 -59.73 -22.16 61.67 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.166 -0.959 . . . . 0.0 109.462 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -70.87 135.19 47.88 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.249 -0.907 . . . . 0.0 109.422 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -70.71 102.59 2.34 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.194 -0.941 . . . . 0.0 109.46 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -169.11 59.38 0.05 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.251 -0.906 . . . . 0.0 109.486 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 161.98 -0.13 0.06 OUTLIER Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.526 ' CG ' HH11 ' A' ' 120' ' ' ARG . 0.3 OUTLIER -75.32 -103.89 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.274 -1.133 . . . . 0.0 109.451 -179.92 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 4.3 m 57.71 -127.08 1.67 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.12 -0.988 . . . . 0.0 109.419 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 169.39 160.96 18.85 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 10.7 tp -73.36 146.89 44.85 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.277 -1.131 . . . . 0.0 109.318 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -67.61 153.63 94.66 Favored Pre-proline 0 N--CA 1.489 1.518 0 O-C-N 121.102 -0.999 . . . . 0.0 108.82 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -57.08 -24.63 59.21 Favored 'Trans proline' 0 C--N 1.323 -0.808 0 C-N-CA 121.02 1.147 . . . . 0.0 109.683 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 23.9 tp10 -159.48 -124.85 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.329 -0.857 . . . . 0.0 109.458 -179.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -102.37 -168.2 1.5 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.285 -0.884 . . . . 0.0 109.405 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -76.89 -84.52 0.06 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.237 -0.915 . . . . 0.0 109.341 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -75.88 -135.01 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.324 -0.86 . . . . 0.0 109.404 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 1.6 tt -169.31 101.79 0.35 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.252 -0.905 . . . . 0.0 109.218 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . 0.426 ' O ' ' N ' ' A' ' 133' ' ' SER . . . 169.31 2.15 0.03 OUTLIER Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 73.0 mt-10 -70.35 58.43 0.18 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.327 -1.102 . . . . 0.0 109.484 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' SER . . . . . 0.426 ' N ' ' O ' ' A' ' 131' ' ' GLY . 89.8 p -64.42 157.02 27.57 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.261 -0.899 . . . . 0.0 109.427 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -62.65 -81.07 0.1 OUTLIER Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.521 -1.431 . . . . 0.0 109.521 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 20.4 m -64.92 -153.77 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.23 -1.159 . . . . 0.0 109.464 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 89.1 p -169.12 -2.52 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.209 -0.932 . . . . 0.0 109.422 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 79.2 p -170.3 136.72 1.4 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.235 -0.915 . . . . 0.0 109.383 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 30.1 t -170.9 84.29 0.09 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.222 -0.924 . . . . 0.0 109.554 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -65.67 143.91 57.26 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.23 -0.918 . . . . 0.0 109.313 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 67.4 p -87.09 -131.19 0.06 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.231 -0.918 . . . . 0.0 109.359 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 99.3 p -62.85 115.25 4.2 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.236 -0.915 . . . . 0.0 109.412 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 39.4 m -69.14 141.52 54.61 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.339 -0.85 . . . . 0.0 109.495 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 54.0 m-70 -68.84 -75.73 0.1 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.307 -0.871 . . . . 0.0 109.445 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' SER . . . . . 0.431 ' C ' ' H ' ' A' ' 146' ' ' GLN . 14.7 t 51.85 63.42 2.25 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.203 -0.936 . . . . 0.0 109.407 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -69.92 5.19 1.65 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.251 -0.906 . . . . 0.0 109.548 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . 0.431 ' H ' ' C ' ' A' ' 144' ' ' SER . 25.2 mt-30 -63.6 -62.49 1.63 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.27 -0.894 . . . . 0.0 109.443 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -63.65 88.83 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.325 -0.86 . . . . 0.0 109.487 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 26.9 m -69.15 143.48 14.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.197 -0.939 . . . . 0.0 109.412 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 43.8 t -69.87 -39.22 76.46 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.317 -0.865 . . . . 0.0 109.52 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 27.2 m -65.84 -157.25 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.271 -0.893 . . . . 0.0 109.513 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 49.4 m -61.97 143.81 55.97 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.329 -0.857 . . . . 0.0 109.459 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' THR . . . . . 0.518 ' O ' ' N ' ' A' ' 154' ' ' VAL . 24.4 m -71.16 72.27 0.61 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.259 -0.901 . . . . 0.0 109.464 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 98.1 m 51.71 -89.25 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.295 -0.878 . . . . 0.0 109.52 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.518 ' N ' ' O ' ' A' ' 152' ' ' THR . 30.0 m -64.52 160.94 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.224 -0.923 . . . . 0.0 109.437 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . 0.497 ' ND2' ' H ' ' A' ' 156' ' ' ARG . 12.6 p-10 -169.05 -112.69 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.305 -0.872 . . . . 0.0 109.56 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . 0.497 ' H ' ' ND2' ' A' ' 155' ' ' ASN . 11.6 tpp180 -68.07 -56.0 10.47 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.161 -0.962 . . . . 0.0 109.413 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -171.91 -43.57 0.04 OUTLIER Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -171.67 -118.78 0.49 Allowed Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 31.3 t -172.93 159.74 4.13 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.173 -1.192 . . . . 0.0 109.453 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -68.1 94.82 0.52 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.251 -0.906 . . . . 0.0 109.334 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 13.6 tt -70.83 117.33 13.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.182 -0.948 . . . . 0.0 109.552 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.413 ' O ' ' OG ' ' A' ' 163' ' ' SER . 11.8 tp10 -168.36 -58.1 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.154 -0.967 . . . . 0.0 109.422 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.413 ' OG ' ' O ' ' A' ' 162' ' ' GLU . 66.1 m -166.59 140.04 3.93 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.321 -0.862 . . . . 0.0 109.445 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 62.2 tttp -167.62 -15.02 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.222 -0.924 . . . . 0.0 109.545 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . 0.41 ' C ' ' HD1' ' A' ' 165' ' ' HIS . 2.7 p80 -162.78 165.3 25.61 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.311 -0.868 . . . . 0.0 109.438 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 . . . . . 0 N--CA 1.489 1.507 0 CA-C-O 118.002 -0.999 . . . . 0.0 109.451 -179.939 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.7 ttp . . . . . 0 N--CA 1.491 1.592 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -176.81 131.07 1.76 Allowed Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 65.9 p -64.18 -45.34 88.79 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.236 -1.155 . . . . 0.0 109.32 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 66.3 t80 -66.73 130.96 44.88 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.205 -0.934 . . . . 0.0 109.482 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.572 HH11 ' CG ' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -170.39 -80.95 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.255 -0.903 . . . . 0.0 109.343 179.953 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.401 ' O ' ' O ' ' A' ' 5' ' ' ARG . 36.5 mt-10 -63.64 -134.37 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.173 -0.954 . . . . 0.0 109.493 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 58.01 100.83 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.24 -0.913 . . . . 0.0 109.268 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.464 ' C ' ' H ' ' A' ' 10' ' ' VAL . . . -172.61 133.65 2.73 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 90.2 p -73.08 11.83 0.64 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.209 -1.171 . . . . 0.0 109.468 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.464 ' H ' ' C ' ' A' ' 8' ' ' GLY . 34.0 t -60.85 128.83 22.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.262 -0.899 . . . . 0.0 109.565 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 92.9 p -62.16 174.47 0.9 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.335 -0.853 . . . . 0.0 109.506 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.3 t -174.1 68.33 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.231 -0.918 . . . . 0.0 109.515 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -179.5 50.07 0.09 OUTLIER Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.479 -1.449 . . . . 0.0 109.479 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 73.1 p -64.45 -11.85 37.64 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.296 -1.12 . . . . 0.0 109.447 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.488 ' C ' ' H ' ' A' ' 17' ' ' GLU . 18.8 tptm -70.39 53.93 0.14 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.189 -0.944 . . . . 0.0 109.406 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 36.1 mm-40 -75.68 34.26 0.12 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.268 -0.895 . . . . 0.0 109.456 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.488 ' H ' ' C ' ' A' ' 15' ' ' LYS . 25.0 mm-40 -73.47 -43.85 59.31 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.263 -0.898 . . . . 0.0 109.463 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -73.92 -69.06 0.46 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.21 -0.932 . . . . 0.0 109.498 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 69.0 t60 -76.13 121.07 22.3 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.225 -0.922 . . . . 0.0 109.466 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.6 t -174.08 -31.21 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.241 -0.912 . . . . 0.0 109.494 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -75.47 -117.65 0.11 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.458 ' CB ' ' NZ ' ' A' ' 22' ' ' LYS . 0.1 OUTLIER -167.99 63.2 0.07 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.287 -1.125 . . . . 0.0 109.449 -179.921 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 16.5 mt -66.15 -50.7 63.04 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.211 -0.931 . . . . 0.0 109.547 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 13.2 t 55.48 -113.32 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.258 -0.901 . . . . 0.0 109.218 -179.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -164.75 -166.49 1.07 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.882 -1.137 . . . . 0.0 109.222 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 59.5 p -45.44 -38.25 5.91 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.219 -0.926 . . . . 0.0 109.892 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 46.8 mtmt -148.94 -133.93 0.06 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.228 -0.92 . . . . 0.0 109.436 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 76.07 -8.26 24.65 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.475 ' CG ' ' H ' ' A' ' 30' ' ' LYS . 15.6 t70 -169.72 -135.83 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.251 -1.147 . . . . 0.0 109.474 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.475 ' H ' ' CG ' ' A' ' 29' ' ' ASP . 65.1 tttm 50.16 85.32 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.232 -0.918 . . . . 0.0 109.449 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.43 ' O ' ' OE1' ' A' ' 31' ' ' GLU . 1.7 pp20? -172.57 26.03 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.264 -0.897 . . . . 0.0 109.606 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 20.2 mt -67.01 -20.53 65.88 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.25 -0.906 . . . . 0.0 109.425 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.93 28.2 1.42 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.294 -0.879 . . . . 0.0 109.224 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 16.4 tt -64.62 -45.55 95.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.164 -0.96 . . . . 0.0 109.366 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 46.75 37.49 4.78 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.202 -0.936 . . . . 0.0 109.683 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 51.9 77.0 0.16 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.189 -0.945 . . . . 0.0 109.381 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.429 ' O ' ' N ' ' A' ' 39' ' ' VAL . 39.1 tt0 -62.91 118.6 8.0 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.25 -0.906 . . . . 0.0 109.564 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt -68.08 53.76 0.07 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.243 -0.911 . . . . 0.0 109.5 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.429 ' N ' ' O ' ' A' ' 37' ' ' GLU . 35.9 m -46.16 146.8 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.232 -0.917 . . . . 0.0 109.798 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.417 ' HG1' ' N ' ' A' ' 41' ' ' SER . 1.7 t -170.95 174.95 4.57 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.334 -0.854 . . . . 0.0 109.401 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.417 ' N ' ' HG1' ' A' ' 40' ' ' THR . 43.0 t -66.97 -58.34 5.14 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.271 -0.893 . . . . 0.0 109.444 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -173.19 113.16 0.46 Allowed Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.333 -1.507 . . . . 0.0 109.333 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -81.64 -68.01 0.73 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.33 -1.1 . . . . 0.0 109.42 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.9 p -75.95 73.29 2.85 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.231 -0.918 . . . . 0.0 109.308 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 61.3 p -75.45 140.66 43.02 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.182 -0.949 . . . . 0.0 109.447 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.6 t -147.44 31.98 0.89 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.247 -0.908 . . . . 0.0 109.42 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 41.9 m -71.06 -71.66 0.25 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.31 -0.869 . . . . 0.0 109.288 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 26.2 ttp180 -146.01 142.8 28.98 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.301 -0.874 . . . . 0.0 109.32 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.4 mmt180 -100.69 134.66 43.33 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.315 -0.865 . . . . 0.0 109.839 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.464 ' O ' ' O ' ' A' ' 51' ' ' CYS . 18.7 m -71.53 -61.22 1.86 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.2 -0.937 . . . . 0.0 110.52 -179.444 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.587 ' SG ' ' N ' ' A' ' 52' ' ' SER . 32.5 t -56.23 -108.74 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.194 -0.942 . . . . 0.0 109.526 -179.542 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.587 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 62.0 m -52.57 113.91 1.21 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 120.944 -1.097 . . . . 0.0 108.2 179.35 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.436 ' O ' ' O ' ' A' ' 73' ' ' VAL . 18.0 tptm -74.2 100.83 3.79 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.75 -1.219 . . . . 0.0 109.553 -178.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.47 ' CG1' ' O ' ' A' ' 54' ' ' VAL . 8.3 p -128.55 116.12 40.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 179.421 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -127.97 130.87 69.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 16.6 m -128.56 111.96 13.8 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.378 -0.826 . . . . 0.0 108.896 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.41 ' H ' ' HB ' ' A' ' 69' ' ' THR . 14.9 mttm -124.19 113.37 18.22 Favored 'General case' 0 N--CA 1.511 2.583 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 178.623 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 71.6 p -113.04 134.73 54.39 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.49 -0.756 . . . . 0.0 109.742 -179.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.8 m -131.49 123.98 53.67 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.047 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 178.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 42.4 p -107.2 120.39 41.98 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.683 -0.635 . . . . 0.0 110.252 -179.026 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.461 ' OD1' ' N ' ' A' ' 61' ' ' ASN . 1.2 m-20 -107.62 143.97 35.33 Favored 'General case' 0 N--CA 1.51 2.544 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 179.209 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.467 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -69.51 -28.95 66.48 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 119.976 -1.702 . . . . 0.0 112.331 -177.645 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.456 ' OD1' ' N ' ' A' ' 63' ' ' ASP . 0.6 OUTLIER -67.36 4.19 1.06 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.527 -1.358 . . . . 0.0 109.75 -178.969 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.467 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 96.52 6.16 58.64 Favored Glycine 0 N--CA 1.497 2.706 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 178.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -92.39 110.49 21.89 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.725 -1.456 . . . . 0.0 107.857 179.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 23.8 p -135.16 102.92 5.35 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.418 -0.801 . . . . 0.0 109.32 -179.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -96.91 128.64 44.07 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.21 -0.931 . . . . 0.0 110.185 -179.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.663 ' HG1' ' NZ ' ' A' ' 70' ' ' LYS . 40.0 p -106.36 108.96 20.74 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.532 -0.73 . . . . 0.0 109.489 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.499 ' O ' ' N ' ' A' ' 71' ' ' GLU . 5.6 m -88.43 33.14 0.75 Allowed 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 179.005 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.663 ' NZ ' ' HG1' ' A' ' 68' ' ' THR . 21.0 pttm -66.14 60.99 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.286 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.499 ' N ' ' O ' ' A' ' 69' ' ' THR . 86.9 mt-10 -96.13 141.93 28.92 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 120.968 -1.083 . . . . 0.0 110.079 -179.37 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.441 ' O ' ' CG2' ' A' ' 72' ' ' VAL . 5.9 m -129.16 122.39 56.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 179.115 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.436 ' O ' ' O ' ' A' ' 53' ' ' LYS . 20.6 t -128.96 115.44 36.58 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.996 0 CA-C-O 122.323 1.058 . . . . 0.0 109.47 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.439 ' NZ ' ' O ' ' A' ' 79' ' ' SER . 66.4 tttm -64.46 154.12 36.76 Favored 'General case' 0 C--N 1.287 -2.129 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.433 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 68.6 m -60.57 112.32 1.94 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.228 -0.92 . . . . 0.0 109.392 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -88.69 36.18 0.79 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.194 -0.941 . . . . 0.0 109.37 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -157.38 -38.12 0.07 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.272 -0.893 . . . . 0.0 109.628 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -84.6 3.49 86.51 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' SER . . . . . 0.515 ' C ' ' H ' ' A' ' 81' ' ' CYS . 8.5 m 53.96 -127.22 2.36 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.337 -1.096 . . . . 0.0 109.362 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.517 ' O ' ' N ' ' A' ' 82' ' ' GLY . 28.5 t70 -75.53 25.97 0.11 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.079 -1.013 . . . . 0.0 109.484 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.519 ' C ' ' H ' ' A' ' 83' ' ' ASP . 3.6 t 64.5 -63.58 0.16 Allowed 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.587 -0.696 . . . . 0.0 109.76 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' A' ' 80' ' ' ASP . . . -71.8 36.77 0.61 Allowed Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.655 -1.378 . . . . 0.0 109.655 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.519 ' H ' ' C ' ' A' ' 81' ' ' CYS . 19.0 p30 -61.04 158.64 13.12 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.126 -1.22 . . . . 0.0 109.47 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.72 -41.67 91.37 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.279 -0.888 . . . . 0.0 109.446 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 26.6 t0 53.61 90.12 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.348 -0.845 . . . . 0.0 109.411 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.46 ' CD2' ' N ' ' A' ' 87' ' ' ASP . 70.4 t80 -169.91 -101.69 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.295 -0.878 . . . . 0.0 109.444 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.46 ' N ' ' CD2' ' A' ' 86' ' ' PHE . 24.8 t70 -171.38 15.76 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.208 -0.933 . . . . 0.0 109.481 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 76.2 t90 -81.64 -43.22 18.89 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.266 -0.896 . . . . 0.0 109.375 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.469 ' CG ' ' N ' ' A' ' 90' ' ' HIS . 58.1 t-80 -65.72 168.32 7.93 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.302 -0.874 . . . . 0.0 109.501 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.469 ' N ' ' CG ' ' A' ' 89' ' ' HIS . 81.9 t60 52.3 86.13 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.163 -0.96 . . . . 0.0 109.45 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 11.4 m -143.36 60.53 1.4 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.3 -0.875 . . . . 0.0 109.365 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 49.72 67.24 4.63 Favored Pre-proline 0 N--CA 1.489 1.502 0 O-C-N 121.299 -0.875 . . . . 0.0 109.844 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.58 -43.51 26.73 Favored 'Trans proline' 0 C--N 1.317 -1.123 0 C-N-CA 121.314 1.343 . . . . 0.0 109.54 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.401 ' O ' ' O ' ' A' ' 95' ' ' ARG . 61.8 m -156.24 29.42 0.35 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.284 -0.885 . . . . 0.0 109.399 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.401 ' O ' ' O ' ' A' ' 94' ' ' SER . 39.3 ttp180 51.59 96.58 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.248 -0.908 . . . . 0.0 109.457 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 61.39 -150.96 43.73 Favored Glycine 0 N--CA 1.489 2.208 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -169.21 149.6 4.2 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.275 -1.132 . . . . 0.0 109.437 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 8.3 tp 55.08 -125.12 2.18 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.221 -0.924 . . . . 0.0 109.234 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -62.8 154.27 30.35 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.13 -0.981 . . . . 0.0 109.518 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -68.55 165.2 19.63 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.247 -0.908 . . . . 0.0 109.392 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -69.94 -55.54 9.39 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.18 -0.95 . . . . 0.0 109.494 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -68.9 123.98 22.46 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.25 -0.906 . . . . 0.0 109.516 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 37.2 m-70 -65.79 -31.2 72.03 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.266 -0.896 . . . . 0.0 109.413 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 52.92 73.84 0.33 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.319 -0.863 . . . . 0.0 109.458 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -72.96 166.33 23.26 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.233 -0.917 . . . . 0.0 109.429 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 24.3 ttpp -167.39 120.76 0.96 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.297 -0.877 . . . . 0.0 109.501 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -68.95 146.79 52.47 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.165 -0.959 . . . . 0.0 109.394 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.412 ' N ' ' OD1' ' A' ' 108' ' ' ASP . 12.4 p-10 -167.92 105.65 0.5 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.256 -0.902 . . . . 0.0 109.473 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -68.19 -48.65 64.66 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.25 -0.906 . . . . 0.0 109.454 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . 0.524 ' O ' ' CD2' ' A' ' 110' ' ' PHE . 48.1 p90 -77.41 121.99 24.56 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.279 -0.888 . . . . 0.0 109.459 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 12.3 m -164.13 63.91 0.15 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.245 -0.909 . . . . 0.0 109.31 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.514 ' O ' ' N ' ' A' ' 114' ' ' SER . 26.6 mtm-85 -150.46 71.3 1.05 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.288 -0.883 . . . . 0.0 109.376 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 69.2 m 51.9 -89.24 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.247 -0.908 . . . . 0.0 109.512 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.514 ' N ' ' O ' ' A' ' 112' ' ' ARG . 44.8 t -157.57 -166.19 1.96 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.288 -0.883 . . . . 0.0 109.385 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . 0.412 ' N ' ' OG ' ' A' ' 114' ' ' SER . 40.9 p-80 -166.8 51.04 0.07 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.276 -0.89 . . . . 0.0 109.463 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 51.49 63.88 2.07 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.233 -0.917 . . . . 0.0 109.447 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -77.05 -40.89 44.68 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.237 -0.914 . . . . 0.0 109.538 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -71.55 57.8 0.28 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.253 -0.904 . . . . 0.0 109.653 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -143.78 111.06 0.61 Allowed Glycine 0 N--CA 1.495 2.624 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -171.61 -36.92 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.319 -1.107 . . . . 0.0 109.476 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 72.7 p -74.53 -87.27 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.227 -0.921 . . . . 0.0 109.515 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 58.72 -133.99 52.56 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.489 ' CD2' ' N ' ' A' ' 123' ' ' LEU . 1.4 pt? -55.16 142.8 29.67 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.169 -1.194 . . . . 0.0 109.502 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -81.06 162.36 59.73 Favored Pre-proline 0 N--CA 1.493 1.68 0 O-C-N 121.183 -0.948 . . . . 0.0 108.721 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -56.56 -174.33 0.04 OUTLIER 'Trans proline' 0 C--N 1.319 -1.001 0 C-N-CA 121.284 1.323 . . . . 0.0 109.798 179.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -171.32 -32.48 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.219 -0.926 . . . . 0.0 109.372 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -61.73 -105.93 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.232 -0.917 . . . . 0.0 109.435 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . 53.68 73.98 0.34 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.197 -0.939 . . . . 0.0 109.446 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.529 ' C ' ' H ' ' A' ' 131' ' ' GLY . . . 52.73 92.59 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.352 -0.842 . . . . 0.0 109.489 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.479 ' N ' ' CD2' ' A' ' 130' ' ' LEU . 0.7 OUTLIER -62.29 2.94 0.21 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.328 -0.857 . . . . 0.0 109.804 -179.871 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . 0.529 ' H ' ' C ' ' A' ' 129' ' ' ALA . . . -171.03 170.65 43.41 Favored Glycine 0 N--CA 1.489 2.196 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . 0.415 ' O ' ' OG ' ' A' ' 133' ' ' SER . 7.9 tp10 -169.98 80.87 0.11 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.329 -1.1 . . . . 0.0 109.43 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' SER . . . . . 0.415 ' OG ' ' O ' ' A' ' 132' ' ' GLU . 52.9 p 50.69 90.76 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.252 -0.905 . . . . 0.0 109.507 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -69.56 74.09 0.44 Allowed Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 43.0 t -62.69 91.33 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.252 -1.146 . . . . 0.0 109.48 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 49.9 m -66.8 -55.48 14.7 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.237 -0.915 . . . . 0.0 109.495 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 24.4 p 52.07 -163.37 0.08 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.272 -0.893 . . . . 0.0 109.555 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 89.3 p -65.41 -62.16 1.69 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.26 -0.9 . . . . 0.0 109.448 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.456 ' NZ ' ' CB ' ' A' ' 139' ' ' LYS . 6.4 ttpm? -60.3 139.79 57.43 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.29 -0.881 . . . . 0.0 109.511 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 3.1 t -171.81 173.05 4.65 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.217 -0.927 . . . . 0.0 109.542 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 43.8 t -64.54 -173.17 0.09 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.273 -0.892 . . . . 0.0 109.455 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 74.6 p -64.03 -169.27 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.293 -0.88 . . . . 0.0 109.446 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 12.7 t-80 52.23 96.8 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.18 -0.95 . . . . 0.0 109.516 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 89.9 p -169.59 29.86 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.217 -0.927 . . . . 0.0 109.42 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 54.1 mttp 52.98 19.92 1.51 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.215 -0.928 . . . . 0.0 109.418 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 52.28 -169.64 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.213 -0.929 . . . . 0.0 109.466 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . 0.446 ' C ' ' H ' ' A' ' 149' ' ' SER . 65.8 m-85 -69.51 -173.52 0.58 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.27 -0.894 . . . . 0.0 109.43 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . 0.492 ' O ' ' N ' ' A' ' 150' ' ' SER . 29.1 m -71.29 8.32 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.26 -0.9 . . . . 0.0 109.529 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' SER . . . . . 0.446 ' H ' ' C ' ' A' ' 147' ' ' PHE . 40.3 t 50.84 -92.27 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.258 -0.901 . . . . 0.0 109.493 -179.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' SER . . . . . 0.492 ' N ' ' O ' ' A' ' 148' ' ' VAL . 93.3 p -163.63 105.39 0.95 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.315 -0.866 . . . . 0.0 109.431 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' SER . . . . . 0.522 ' O ' ' N ' ' A' ' 153' ' ' THR . 79.2 p -171.09 -49.81 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.222 -0.924 . . . . 0.0 109.39 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' THR . . . . . 0.521 ' O ' ' N ' ' A' ' 154' ' ' VAL . 50.7 p 48.52 -90.89 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.345 -0.847 . . . . 0.0 109.812 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' THR . . . . . 0.522 ' N ' ' O ' ' A' ' 151' ' ' SER . 0.0 OUTLIER -47.51 91.04 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.229 -0.919 . . . . 0.0 109.923 -179.699 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.521 ' N ' ' O ' ' A' ' 152' ' ' THR . 5.5 t 57.46 113.01 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.339 -0.85 . . . . 0.0 109.907 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -69.85 82.31 0.46 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.229 -0.92 . . . . 0.0 109.323 179.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 34.7 ttm180 -61.82 -64.63 0.88 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.271 -0.893 . . . . 0.0 109.464 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 75.88 149.65 2.64 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 163.55 135.45 1.82 Allowed Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 96.5 p -75.02 132.73 41.55 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.213 -1.169 . . . . 0.0 109.457 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -151.34 148.57 28.31 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.238 -0.914 . . . . 0.0 109.396 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 15.8 tt -165.83 -18.15 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.213 -0.93 . . . . 0.0 109.481 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.439 ' N ' ' CD ' ' A' ' 162' ' ' GLU . 3.4 mp0 51.3 82.97 0.05 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.318 -0.863 . . . . 0.0 109.452 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.472 ' C ' ' H ' ' A' ' 165' ' ' HIS . 45.5 t -67.99 -168.22 0.1 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.247 -0.908 . . . . 0.0 109.457 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . 0.4 ' N ' ' OG ' ' A' ' 163' ' ' SER . 48.9 tttm -73.53 40.35 0.11 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.221 -0.924 . . . . 0.0 109.33 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . 0.472 ' H ' ' C ' ' A' ' 163' ' ' SER . 73.4 t60 -171.26 94.57 0.18 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.248 -0.907 . . . . 0.0 109.429 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 61.1 t80 . . . . . 0 N--CA 1.489 1.517 0 CA-C-O 118.022 -0.989 . . . . 0.0 109.471 179.991 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.564 ' N ' ' SD ' ' A' ' 1' ' ' MET . 1.8 mpt? . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 61.78 51.02 60.15 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 33.4 m -164.34 111.08 1.05 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.277 -1.131 . . . . 0.0 109.379 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 -74.25 -160.85 0.11 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.241 -0.912 . . . . 0.0 109.412 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -160.6 92.42 0.96 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.128 -0.982 . . . . 0.0 109.381 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -58.62 -30.73 67.48 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.183 -0.948 . . . . 0.0 109.416 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 tm-20 -168.61 139.62 2.57 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.288 -0.882 . . . . 0.0 109.286 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.419 ' O ' ' OG ' ' A' ' 9' ' ' SER . . . 178.75 -58.85 0.09 OUTLIER Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.419 ' OG ' ' O ' ' A' ' 8' ' ' GLY . 24.2 p 53.13 -165.13 0.08 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.269 -1.136 . . . . 0.0 109.471 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.483 ' C ' ' H ' ' A' ' 12' ' ' SER . 29.1 m -61.97 -32.33 53.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.163 -0.961 . . . . 0.0 109.482 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.0 m -68.6 44.49 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.25 -0.906 . . . . 0.0 109.458 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.483 ' H ' ' C ' ' A' ' 10' ' ' VAL . 99.1 p -63.54 113.4 3.28 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.283 -0.886 . . . . 0.0 109.454 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 174.59 178.47 44.51 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 63.7 p -150.89 62.42 0.92 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.228 -1.16 . . . . 0.0 109.346 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.45 ' O ' ' N ' ' A' ' 17' ' ' GLU . 64.5 mttm -150.84 14.01 0.72 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.2 -0.938 . . . . 0.0 109.367 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 63.3 mt-30 -68.36 50.55 0.07 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.253 -0.904 . . . . 0.0 109.489 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.45 ' N ' ' O ' ' A' ' 15' ' ' LYS . 64.1 mt-10 -61.73 -31.66 71.84 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.204 -0.935 . . . . 0.0 109.467 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -66.87 -178.06 0.7 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.249 -0.907 . . . . 0.0 109.472 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.4 t-160 -169.56 -86.64 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.18 -0.95 . . . . 0.0 109.566 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.411 ' O ' ' O ' ' A' ' 21' ' ' GLY . 93.8 m -71.05 -82.53 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.295 -0.878 . . . . 0.0 109.495 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.411 ' O ' ' O ' ' A' ' 20' ' ' THR . . . 63.09 125.2 0.01 OUTLIER Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.448 ' CB ' ' NZ ' ' A' ' 22' ' ' LYS . 6.8 mtpm? -61.35 -9.69 5.8 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.218 -1.166 . . . . 0.0 109.502 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.452 ' CD2' ' N ' ' A' ' 23' ' ' LEU . 4.0 mm? -50.87 163.9 0.17 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.252 -0.905 . . . . 0.0 109.319 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 33.8 m -149.77 -146.72 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 O-C-N 121.315 -0.865 . . . . 0.0 109.101 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.8 t -155.24 149.47 25.92 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.138 -0.976 . . . . 0.0 109.412 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 22.4 m 54.05 86.95 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.194 -0.941 . . . . 0.0 109.493 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.419 ' O ' ' O ' ' A' ' 28' ' ' GLY . 3.9 mmmm -65.92 88.18 0.11 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.24 -0.913 . . . . 0.0 109.411 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.419 ' O ' ' O ' ' A' ' 27' ' ' LYS . . . -58.89 -109.61 0.01 OUTLIER Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -169.65 162.77 9.94 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.2 -1.177 . . . . 0.0 109.484 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -63.35 140.14 58.84 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.303 -0.873 . . . . 0.0 109.4 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -152.29 -32.96 0.14 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.292 -0.88 . . . . 0.0 109.253 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 60.6 tp -70.78 -40.4 72.62 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.245 -0.909 . . . . 0.0 109.128 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.505 ' CD1' ' N ' ' A' ' 33' ' ' LEU . 8.3 mp -70.88 78.74 0.63 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.252 -0.905 . . . . 0.0 109.249 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.447 ' C ' ' H ' ' A' ' 36' ' ' ASN . 17.3 pt -91.58 39.1 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.271 -0.893 . . . . 0.0 109.247 179.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -70.99 45.44 0.09 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.248 -0.908 . . . . 0.0 109.489 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.447 ' H ' ' C ' ' A' ' 34' ' ' ILE . 31.0 m120 -73.7 134.57 43.56 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.336 -0.853 . . . . 0.0 109.381 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -71.91 -126.6 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.195 -0.94 . . . . 0.0 109.392 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt -75.19 95.76 3.18 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.056 -1.027 . . . . 0.0 109.533 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.0 m -70.27 155.78 7.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.224 -0.923 . . . . 0.0 109.513 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 41.3 m -66.83 128.9 38.07 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.218 -0.927 . . . . 0.0 109.493 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.408 ' OG ' ' N ' ' A' ' 42' ' ' GLY . 80.8 p -62.73 -84.04 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.229 -0.92 . . . . 0.0 109.457 179.872 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.408 ' N ' ' OG ' ' A' ' 41' ' ' SER . . . 65.71 17.0 64.34 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 25.2 t60 -169.55 53.12 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.247 -1.149 . . . . 0.0 109.436 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 33.6 m -65.54 102.69 0.74 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.236 -0.915 . . . . 0.0 109.428 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 76.1 p -73.78 83.63 1.64 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.262 -0.898 . . . . 0.0 109.48 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.4 t -70.22 59.78 0.18 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.251 -0.905 . . . . 0.0 109.46 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.7 t -60.05 -16.22 29.51 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.291 -0.881 . . . . 0.0 109.435 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 45.4 ttp180 -145.86 142.74 29.1 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.218 -0.926 . . . . 0.0 109.304 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -103.5 144.71 31.05 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.367 -0.833 . . . . 0.0 109.754 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 68.7 m -66.16 -100.08 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.186 -0.946 . . . . 0.0 109.243 179.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.429 ' O ' ' OG ' ' A' ' 52' ' ' SER . 15.3 t -49.63 135.17 19.05 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.1 -1.0 . . . . 0.0 108.826 179.581 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.429 ' OG ' ' O ' ' A' ' 51' ' ' CYS . 53.0 p 50.43 87.47 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.991 -1.068 . . . . 0.0 108.542 -179.158 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -75.48 104.05 5.87 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.228 -0.92 . . . . 0.0 109.824 -178.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 7.1 p -111.43 114.08 46.07 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 O-C-N 121.526 -0.734 . . . . 0.0 109.569 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.45 ' CD1' ' N ' ' A' ' 55' ' ' ILE . 1.7 mp -107.82 119.93 58.28 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 179.209 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 5.9 m -129.8 113.9 15.26 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.495 -0.753 . . . . 0.0 109.684 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.531 ' N ' ' OG1' ' A' ' 69' ' ' THR . 21.2 mttt -121.99 112.48 18.33 Favored 'General case' 0 N--CA 1.509 2.519 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 178.175 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 44.1 p -118.8 134.76 54.92 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.445 -0.784 . . . . 0.0 109.754 -179.247 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.3 m -132.17 119.69 41.03 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 178.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 42.7 p -110.93 136.54 49.79 Favored 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.523 ' OD1' ' N ' ' A' ' 62' ' ' ALA . 16.5 t30 -161.59 153.37 19.17 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 120.641 -1.287 . . . . 0.0 109.84 179.331 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.523 ' N ' ' OD1' ' A' ' 61' ' ' ASN . . . -74.3 -8.95 58.01 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.707 -1.246 . . . . 0.0 110.536 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -72.95 -1.87 18.69 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.309 -0.869 . . . . 0.0 109.851 -179.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 95.67 9.48 57.51 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 108.891 -1.684 . . . . 0.0 108.891 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 47.7 mtp180 -99.82 89.21 4.01 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.196 -1.179 . . . . 0.0 108.404 179.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.8 m -125.28 72.76 1.26 Allowed 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 73.8 mt-10 -100.87 131.82 46.57 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.454 -0.779 . . . . 0.0 111.727 -177.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.6 m -108.19 112.39 24.87 Favored 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 178.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.531 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 22.4 p -104.25 37.85 2.0 Allowed 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 179.369 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.4 pttm -65.46 61.73 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.676 -0.64 . . . . 0.0 109.463 179.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.506 ' N ' ' O ' ' A' ' 69' ' ' THR . 55.9 mt-10 -82.09 147.56 29.03 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.064 -1.022 . . . . 0.0 109.821 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 22.9 m -127.81 134.94 64.31 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 14.7 t -128.69 118.03 46.24 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 CA-C-O 122.217 1.008 . . . . 0.0 109.264 179.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 44.9 mtmt -77.77 161.21 27.86 Favored 'General case' 0 C--N 1.29 -2.007 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.512 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.472 ' C ' ' H ' ' A' ' 77' ' ' ASP . 49.8 m -65.69 139.98 58.43 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.237 -0.914 . . . . 0.0 109.365 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -76.06 36.35 0.14 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.164 -0.96 . . . . 0.0 109.435 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.472 ' H ' ' C ' ' A' ' 75' ' ' SER . 8.3 t0 -159.0 -70.57 0.08 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.341 -0.849 . . . . 0.0 109.35 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 105.99 29.55 4.86 Favored Glycine 0 N--CA 1.497 2.765 0 N-CA-C 109.343 -1.503 . . . . 0.0 109.343 -179.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 43.5 t -75.52 -16.9 60.23 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.325 -1.103 . . . . 0.0 109.276 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.5 ' O ' ' SG ' ' A' ' 81' ' ' CYS . 11.1 p-10 -166.84 39.19 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.418 -0.801 . . . . 0.0 109.079 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.52 ' O ' ' N ' ' A' ' 83' ' ' ASP . 62.5 m -154.64 159.16 40.63 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.455 -0.778 . . . . 0.0 109.457 179.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 45.81 16.06 0.12 Allowed Glycine 0 N--CA 1.493 2.471 0 N-CA-C 109.984 -1.246 . . . . 0.0 109.984 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.52 ' N ' ' O ' ' A' ' 81' ' ' CYS . 25.2 m-20 -157.93 -172.83 4.08 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.139 -1.213 . . . . 0.0 109.568 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -167.92 8.0 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.327 -0.858 . . . . 0.0 109.409 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 63.0 t0 -167.64 113.63 0.72 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.232 -0.917 . . . . 0.0 109.387 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -75.39 -23.38 57.06 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.281 -0.887 . . . . 0.0 109.493 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -60.65 177.99 0.26 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.201 -0.937 . . . . 0.0 109.498 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . 0.474 ' O ' ' CG ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -169.09 -168.26 0.82 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.285 -0.884 . . . . 0.0 109.343 179.969 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.474 ' CG ' ' O ' ' A' ' 88' ' ' TRP . 96.9 m-70 -155.97 114.28 3.39 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.209 -0.932 . . . . 0.0 109.392 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.0 m-70 -64.74 -78.2 0.05 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.234 -0.916 . . . . 0.0 109.551 -179.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 71.5 p -149.87 146.63 27.22 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.324 -0.86 . . . . 0.0 109.237 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -71.53 150.67 93.75 Favored Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 121.182 -0.949 . . . . 0.0 109.039 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -56.4 -71.47 0.04 OUTLIER 'Trans proline' 0 C--N 1.322 -0.832 0 C-N-CA 120.967 1.111 . . . . 0.0 109.765 179.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 89.4 p -69.0 127.85 34.61 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.267 -0.896 . . . . 0.0 109.478 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.539 HH21 HD22 ' A' ' 97' ' ' ASN . 79.2 mtm180 -66.41 -73.56 0.13 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.252 -0.905 . . . . 0.0 109.398 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -177.88 12.62 0.03 OUTLIER Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.539 HD22 HH21 ' A' ' 95' ' ' ARG . 66.0 m-80 -62.43 140.51 58.57 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.28 -1.13 . . . . 0.0 109.479 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.53 ' N ' ' CD2' ' A' ' 98' ' ' LEU . 3.5 mm? -70.1 98.05 1.27 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.297 -0.877 . . . . 0.0 109.235 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -63.06 148.88 46.51 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.228 -0.92 . . . . 0.0 109.443 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -61.09 161.81 8.08 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.259 -0.901 . . . . 0.0 109.484 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -67.82 -47.11 69.96 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.277 -0.889 . . . . 0.0 109.386 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -69.16 79.08 0.35 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.235 -0.916 . . . . 0.0 109.508 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 9.0 p80 -62.73 -22.81 66.81 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.199 -0.938 . . . . 0.0 109.495 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 62.6 ttt180 -55.67 158.13 3.7 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.228 -0.92 . . . . 0.0 109.447 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -53.81 -59.96 3.94 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.173 -0.954 . . . . 0.0 109.444 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.416 ' O ' ' O ' ' A' ' 107' ' ' ASP . 21.9 pttm -168.99 -149.84 0.08 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.223 -0.923 . . . . 0.0 109.464 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.416 ' O ' ' O ' ' A' ' 106' ' ' LYS . 13.4 t70 55.52 170.1 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.267 -0.896 . . . . 0.0 109.497 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -166.85 174.1 8.85 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.276 -0.89 . . . . 0.0 109.51 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -77.37 -47.5 19.7 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.278 -0.889 . . . . 0.0 109.47 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . 0.471 ' O ' ' CD2' ' A' ' 110' ' ' PHE . 9.0 p90 -74.53 91.31 2.28 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.293 -0.879 . . . . 0.0 109.464 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 70.2 p -79.52 81.93 5.71 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.238 -0.914 . . . . 0.0 109.468 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 61.4 ttt180 -169.16 -75.15 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.248 -0.907 . . . . 0.0 109.467 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.417 ' O ' ' O ' ' A' ' 114' ' ' SER . 33.5 t 49.92 23.42 1.06 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.308 -0.87 . . . . 0.0 109.447 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.445 ' C ' ' H ' ' A' ' 116' ' ' GLU . 4.8 p 62.26 140.07 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.31 -0.869 . . . . 0.0 109.505 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . 0.509 ' HD1' ' NH1' ' A' ' 120' ' ' ARG . 56.2 m80 -75.71 15.04 0.55 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.311 -0.868 . . . . 0.0 109.48 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.445 ' H ' ' C ' ' A' ' 114' ' ' SER . 37.7 mt-10 52.35 52.75 13.59 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.175 -0.953 . . . . 0.0 109.394 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 51.03 -100.95 0.09 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.225 -0.922 . . . . 0.0 109.44 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.448 ' O ' ' N ' ' A' ' 120' ' ' ARG . 30.1 m-20 53.04 -147.76 0.47 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.141 -0.974 . . . . 0.0 109.453 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -59.16 86.8 0.02 OUTLIER Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.509 ' NH1' ' HD1' ' A' ' 115' ' ' HIS . 67.5 ttt180 -168.42 126.09 1.09 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.259 -1.142 . . . . 0.0 109.449 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 69.6 p -68.48 139.8 55.69 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.215 -0.928 . . . . 0.0 109.482 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -73.35 -95.44 0.1 OUTLIER Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.514 ' CD1' ' N ' ' A' ' 123' ' ' LEU . 8.0 mp -65.34 127.22 30.86 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.199 -1.177 . . . . 0.0 109.188 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -78.91 162.5 64.66 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.328 -0.858 . . . . 0.0 108.84 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -55.64 154.2 26.48 Favored 'Trans proline' 0 C--N 1.318 -1.036 0 C-N-CA 121.315 1.343 . . . . 0.0 109.734 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 67.5 mm-40 -80.71 18.06 1.04 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.293 -0.879 . . . . 0.0 109.582 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -146.15 99.66 3.27 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.18 -0.95 . . . . 0.0 109.441 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -77.78 111.28 13.42 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.312 -0.868 . . . . 0.0 109.459 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -79.67 -68.19 0.69 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.371 -0.831 . . . . 0.0 109.496 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.492 ' CD1' ' N ' ' A' ' 130' ' ' LEU . 8.5 mp 53.8 -97.16 0.06 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.435 -0.79 . . . . 0.0 109.238 -179.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 176.29 10.63 0.02 OUTLIER Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . 0.513 ' OE1' ' N ' ' A' ' 132' ' ' GLU . 0.6 OUTLIER -60.02 -11.36 5.65 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.228 -1.16 . . . . 0.0 109.337 179.935 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 89.4 p -171.56 137.17 1.03 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.246 -0.909 . . . . 0.0 109.526 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 177.97 84.65 0.06 OUTLIER Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.314 -1.514 . . . . 0.0 109.314 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 90.0 p -66.16 -24.15 66.6 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.267 -1.137 . . . . 0.0 109.517 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 74.4 m -166.58 176.07 7.54 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.232 -0.918 . . . . 0.0 109.375 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 84.4 p -168.94 33.21 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.328 -0.857 . . . . 0.0 109.309 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 44.0 t -60.14 -61.35 2.67 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.338 -0.851 . . . . 0.0 109.485 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt 51.09 86.44 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.265 -0.897 . . . . 0.0 109.306 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 82.7 p -81.48 154.46 26.32 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.219 -0.926 . . . . 0.0 109.408 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 78.1 p -167.17 12.8 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.262 -0.899 . . . . 0.0 109.507 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 53.2 p -62.42 -149.48 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.3 -0.875 . . . . 0.0 109.496 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . 0.412 ' C ' ' H ' ' A' ' 145' ' ' LYS . 89.1 m-70 -61.04 96.64 0.05 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.275 -0.89 . . . . 0.0 109.379 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 55.3 m -62.58 -4.7 2.11 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.208 -0.932 . . . . 0.0 109.413 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . 0.412 ' H ' ' C ' ' A' ' 143' ' ' HIS . 47.3 mtmt -60.2 129.92 44.11 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.245 -0.909 . . . . 0.0 109.41 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -151.81 -87.58 0.07 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.208 -0.933 . . . . 0.0 109.368 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 53.21 -150.91 0.34 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.217 -0.927 . . . . 0.0 109.567 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . 0.412 ' O ' ' OG ' ' A' ' 149' ' ' SER . 26.8 t -59.33 -25.13 29.84 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.291 -0.881 . . . . 0.0 109.433 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' SER . . . . . 0.412 ' OG ' ' O ' ' A' ' 148' ' ' VAL . 24.1 p 53.23 -168.21 0.06 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.257 -0.902 . . . . 0.0 109.395 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 52.3 m -68.07 110.26 3.87 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.237 -0.914 . . . . 0.0 109.488 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 27.7 t -172.0 141.65 1.36 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.23 -0.919 . . . . 0.0 109.494 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' THR . . . . . 0.424 ' O ' ' OG1' ' A' ' 153' ' ' THR . 74.1 p -65.08 127.1 30.22 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.251 -0.906 . . . . 0.0 109.465 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' THR . . . . . 0.501 ' O ' ' N ' ' A' ' 155' ' ' ASN . 55.1 m -166.34 -65.6 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.276 -0.89 . . . . 0.0 109.503 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . 0.478 ' O ' ' N ' ' A' ' 156' ' ' ARG . 2.8 m -60.8 80.25 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.294 -0.879 . . . . 0.0 109.503 -179.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . 0.501 ' N ' ' O ' ' A' ' 153' ' ' THR . 50.4 t30 -68.43 54.3 0.08 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.222 -0.924 . . . . 0.0 109.236 179.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . 0.478 ' N ' ' O ' ' A' ' 154' ' ' VAL . 81.8 mtm180 -90.6 145.21 25.04 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.334 -0.854 . . . . 0.0 109.418 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -174.47 -150.21 7.58 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -81.23 106.58 2.6 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 31.9 t -168.54 -8.47 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.293 -1.122 . . . . 0.0 109.455 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -173.09 165.86 4.96 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.281 -0.887 . . . . 0.0 109.52 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . 0.434 HG22 HD11 ' A' ' 161' ' ' ILE . 17.4 mm 55.72 -116.25 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.319 -0.863 . . . . 0.0 109.408 179.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -81.45 -167.22 1.39 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 120.908 -1.12 . . . . 0.0 109.435 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 29.7 t -172.9 93.78 0.11 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.262 -0.899 . . . . 0.0 109.491 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -67.8 105.22 1.88 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.266 -0.896 . . . . 0.0 109.475 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 12.0 t-80 -66.3 105.69 1.5 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.25 -0.906 . . . . 0.0 109.501 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 118.02 -0.99 . . . . 0.0 109.477 -179.971 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 mmt . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -75.21 97.64 1.06 Allowed Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.444 -1.463 . . . . 0.0 109.444 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 82.8 p -63.21 -35.12 79.25 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.246 -1.15 . . . . 0.0 109.489 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -73.4 -39.09 65.34 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.289 -0.882 . . . . 0.0 109.46 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -149.42 140.69 23.15 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.236 -0.915 . . . . 0.0 109.426 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.6 tp10 -48.87 -27.49 3.09 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.188 -0.945 . . . . 0.0 109.464 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -168.23 -66.38 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.265 -0.897 . . . . 0.0 109.443 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 67.5 131.83 0.03 OUTLIER Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 78.7 p -168.61 151.44 5.26 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.223 -1.163 . . . . 0.0 109.425 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.427 ' O ' ' OG ' ' A' ' 11' ' ' SER . 30.2 m -67.73 -165.49 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.22 -0.925 . . . . 0.0 109.485 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.427 ' OG ' ' O ' ' A' ' 10' ' ' VAL . 72.6 m -168.0 -100.5 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.327 -0.858 . . . . 0.0 109.471 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.468 ' HG ' ' N ' ' A' ' 13' ' ' GLY . 22.8 t -173.0 177.5 2.76 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.311 -0.868 . . . . 0.0 109.467 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . 0.492 ' C ' ' H ' ' A' ' 15' ' ' LYS . . . 178.04 70.16 0.06 OUTLIER Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 81.0 p -74.15 36.72 0.1 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.264 -1.139 . . . . 0.0 109.496 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.492 ' H ' ' C ' ' A' ' 13' ' ' GLY . 1.0 OUTLIER -172.55 61.88 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.265 -0.897 . . . . 0.0 109.431 179.967 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -163.94 51.28 0.14 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.217 -0.927 . . . . 0.0 109.328 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.439 ' O ' ' O ' ' A' ' 18' ' ' PHE . 15.4 pt-20 -77.41 -35.18 54.45 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.232 -0.918 . . . . 0.0 109.427 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.439 ' O ' ' O ' ' A' ' 17' ' ' GLU . 63.4 m-85 51.75 99.59 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.377 -0.827 . . . . 0.0 109.583 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.439 ' O ' ' CG ' ' A' ' 19' ' ' HIS . 85.2 t60 -148.95 48.87 0.99 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.304 -0.873 . . . . 0.0 109.357 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' A' ' 19' ' ' HIS . 74.0 m -165.91 90.0 0.44 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.351 -0.843 . . . . 0.0 109.34 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -175.87 128.88 1.44 Allowed Glycine 0 N--CA 1.489 2.232 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -98.2 82.36 2.92 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.29 -1.123 . . . . 0.0 109.305 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.487 ' CD1' ' N ' ' A' ' 23' ' ' LEU . 9.0 mp -71.26 145.22 49.71 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.204 -0.935 . . . . 0.0 109.456 -179.795 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.461 ' CG1' ' H ' ' A' ' 25' ' ' THR . 18.7 t -63.43 178.08 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.337 -0.852 . . . . 0.0 109.141 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.461 ' H ' ' CG1' ' A' ' 24' ' ' VAL . 71.7 p -138.34 57.17 1.71 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.364 -0.835 . . . . 0.0 109.254 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 33.4 p -62.33 137.78 58.32 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.2 -0.938 . . . . 0.0 109.411 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -79.44 -44.91 20.46 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.17 -0.956 . . . . 0.0 109.385 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 139.32 -117.52 1.38 Allowed Glycine 0 N--CA 1.496 2.681 0 N-CA-C 109.313 -1.515 . . . . 0.0 109.313 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -172.79 154.23 2.89 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.252 -1.146 . . . . 0.0 109.377 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 41.4 mmtm -63.04 -73.75 0.11 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.231 -0.918 . . . . 0.0 109.438 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -169.63 115.16 0.55 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.272 -0.892 . . . . 0.0 109.465 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.501 ' CD1' ' N ' ' A' ' 32' ' ' LEU . 8.4 mp -77.76 -26.64 50.01 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.21 -0.932 . . . . 0.0 109.321 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 20.7 mt -65.26 120.42 12.72 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.178 -0.951 . . . . 0.0 109.377 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 71.0 mt 52.22 80.19 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.265 -0.897 . . . . 0.0 109.475 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -71.78 171.27 11.94 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.329 -0.857 . . . . 0.0 109.486 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.43 ' O ' ' OE2' ' A' ' 37' ' ' GLU . 10.6 t30 -68.34 75.96 0.25 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.175 -0.953 . . . . 0.0 109.448 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.43 ' OE2' ' O ' ' A' ' 36' ' ' ASN . 66.7 mm-40 -138.67 -156.6 0.7 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.383 -0.823 . . . . 0.0 109.225 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.41 ' CG ' ' H ' ' A' ' 39' ' ' VAL . 0.8 OUTLIER -145.6 -146.3 0.19 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.286 -0.884 . . . . 0.0 109.429 -179.832 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.429 ' O ' ' OG1' ' A' ' 40' ' ' THR . 33.0 m -91.36 156.23 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.203 -0.936 . . . . 0.0 109.531 -179.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.429 ' OG1' ' O ' ' A' ' 39' ' ' VAL . 14.2 m -166.48 61.92 0.1 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.322 -0.861 . . . . 0.0 109.347 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 44.9 m -74.29 -161.86 0.13 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.243 -0.911 . . . . 0.0 109.596 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -176.8 151.08 10.85 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.5 m80 -77.25 59.34 1.77 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.214 -1.169 . . . . 0.0 109.471 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.5 t -68.3 -9.34 47.02 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.243 -0.911 . . . . 0.0 109.42 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 40.5 m -62.78 91.78 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.282 -0.886 . . . . 0.0 109.488 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 26.3 m 51.22 79.22 0.1 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.237 -0.915 . . . . 0.0 109.375 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 59.8 p -64.23 129.8 41.37 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.169 -0.957 . . . . 0.0 109.492 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 5.5 ptp180 -145.78 149.61 34.68 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.242 -0.911 . . . . 0.0 109.299 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -93.88 135.09 35.56 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.241 -0.912 . . . . 0.0 109.818 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.4 m -64.54 176.75 1.03 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.215 -0.928 . . . . 0.0 109.507 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.425 ' O ' ' N ' ' A' ' 53' ' ' LYS . 64.6 m 46.84 -122.77 1.31 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.206 -0.934 . . . . 0.0 108.997 -179.724 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 43.5 t -51.87 99.81 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 178.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.515 ' NZ ' ' OE2' ' A' ' 76' ' ' GLU . 93.7 mttt -77.87 101.43 6.79 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.11 -0.994 . . . . 0.0 110.318 -178.612 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.3 t -106.72 114.13 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 9.4 tp -127.99 126.98 67.41 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.481 -0.762 . . . . 0.0 108.998 179.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.474 ' O ' ' CG2' ' A' ' 56' ' ' THR . 0.8 OUTLIER -128.88 117.91 21.81 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.515 -0.741 . . . . 0.0 109.341 179.839 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 26.5 ttmt -127.08 114.53 17.88 Favored 'General case' 0 N--CA 1.521 3.102 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 178.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.5 m -115.66 131.42 56.94 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.624 -0.673 . . . . 0.0 109.86 -179.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.441 ' O ' ' O ' ' A' ' 65' ' ' ARG . 2.9 m -132.12 119.86 41.78 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.141 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 43.8 p -110.17 134.0 52.65 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -179.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -137.36 172.83 12.4 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.311 -0.868 . . . . 0.0 109.752 179.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.421 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -64.27 -40.33 95.75 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 120.807 -1.183 . . . . 0.0 112.566 -177.291 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.486 ' OD1' ' N ' ' A' ' 63' ' ' ASP . 2.0 m-20 -69.01 4.37 1.58 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.378 -1.451 . . . . 0.0 110.04 -178.437 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.527 ' O ' ' N ' ' A' ' 66' ' ' THR . . . 91.82 8.92 63.13 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 110.041 -1.224 . . . . 0.0 110.041 179.308 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.441 ' O ' ' O ' ' A' ' 59' ' ' VAL . 23.6 ttm180 -63.94 79.5 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.43 0 O-C-N 120.717 -1.461 . . . . 0.0 108.193 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.527 ' N ' ' O ' ' A' ' 64' ' ' GLY . 73.3 p -111.56 72.58 0.78 Allowed 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 -179.716 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -94.27 130.66 40.45 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.369 -0.832 . . . . 0.0 109.936 -178.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.469 ' C ' ' H ' ' A' ' 70' ' ' LYS . 4.0 m -108.55 109.53 20.79 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.49 -0.756 . . . . 0.0 109.656 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.481 ' O ' ' N ' ' A' ' 71' ' ' GLU . 3.8 m -82.29 39.63 0.6 Allowed 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.087 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.469 ' H ' ' C ' ' A' ' 68' ' ' THR . 13.3 ptpt -65.71 55.27 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.073 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.481 ' N ' ' O ' ' A' ' 69' ' ' THR . 54.2 mt-10 -89.28 131.97 35.12 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.091 -1.005 . . . . 0.0 109.983 -179.441 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.4 p -128.3 136.81 59.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 17.5 t -127.95 117.29 45.61 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 CA-C-O 122.012 0.911 . . . . 0.0 109.283 179.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -82.73 -31.55 28.4 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 6.9 m -81.8 -148.28 0.07 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.078 -1.014 . . . . 0.0 109.328 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.546 ' C ' ' H ' ' A' ' 78' ' ' GLY . 53.9 tt0 57.76 75.95 0.35 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.225 -0.922 . . . . 0.0 109.606 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.6 t70 64.61 -6.49 0.3 Allowed 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.33 -0.856 . . . . 0.0 109.562 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.546 ' H ' ' C ' ' A' ' 76' ' ' GLU . . . -86.25 -48.51 4.55 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 179.65 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 79.6 p -50.55 -35.12 28.25 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.242 -1.151 . . . . 0.0 109.074 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -94.37 27.49 2.92 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.405 -0.81 . . . . 0.0 109.451 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 35.0 t -157.99 -57.27 0.07 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.246 -0.908 . . . . 0.0 109.186 179.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.481 ' N ' ' O ' ' A' ' 78' ' ' GLY . . . -68.01 -34.4 81.64 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.52 ' CG ' ' H ' ' A' ' 84' ' ' ALA . 37.0 t0 -64.97 -141.3 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.303 -1.116 . . . . 0.0 109.442 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.52 ' H ' ' CG ' ' A' ' 83' ' ' ASP . . . -172.61 82.71 0.05 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.184 -0.947 . . . . 0.0 109.471 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.424 ' OD2' ' O ' ' A' ' 85' ' ' ASP . 6.4 p-10 40.7 84.03 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.74 -0.6 . . . . 0.0 110.217 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -165.17 95.45 0.67 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.26 -0.9 . . . . 0.0 109.486 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -168.33 95.76 0.39 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.18 -0.95 . . . . 0.0 109.476 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 56.9 t90 -169.2 91.17 0.23 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.297 -0.877 . . . . 0.0 109.474 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.475 ' N ' ' CD2' ' A' ' 89' ' ' HIS . 0.3 OUTLIER -59.9 -170.4 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.215 -0.928 . . . . 0.0 109.439 -179.905 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 69.0 m-70 -72.76 149.03 44.03 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.268 -0.895 . . . . 0.0 109.35 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.508 ' OG1' ' N ' ' A' ' 92' ' ' PHE . 1.2 t -64.07 -169.8 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.191 -0.943 . . . . 0.0 109.441 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.508 ' N ' ' OG1' ' A' ' 91' ' ' THR . 0.1 OUTLIER -159.37 68.64 3.19 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.281 -0.887 . . . . 0.0 109.242 179.932 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -62.78 146.97 95.23 Favored 'Trans proline' 0 C--N 1.318 -1.062 0 C-N-CA 121.336 1.358 . . . . 0.0 109.71 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.491 ' C ' ' H ' ' A' ' 96' ' ' GLY . 38.0 m -78.95 163.76 24.97 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.223 -0.923 . . . . 0.0 109.43 -179.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 28.8 mmt180 -67.78 6.08 0.74 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.231 -0.918 . . . . 0.0 109.383 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.491 ' H ' ' C ' ' A' ' 94' ' ' SER . . . 66.32 16.97 65.64 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 15.1 p-10 -64.08 142.64 58.34 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.234 -1.157 . . . . 0.0 109.447 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 59.57 101.19 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.212 -0.93 . . . . 0.0 109.071 179.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -55.66 141.09 39.2 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.34 -0.85 . . . . 0.0 109.529 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -161.37 -73.72 0.06 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.233 -0.917 . . . . 0.0 109.47 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -68.35 -56.8 7.27 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.195 -0.941 . . . . 0.0 109.399 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -97.12 97.86 9.55 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.4 -0.813 . . . . 0.0 109.302 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -54.37 -22.46 12.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.247 -0.908 . . . . 0.0 109.699 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 55.96 62.57 2.33 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.146 -0.971 . . . . 0.0 109.465 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -163.92 5.19 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.314 -0.866 . . . . 0.0 109.339 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 44.8 tttm 57.82 -127.09 1.64 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.276 -0.89 . . . . 0.0 109.258 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.507 ' CG ' ' H ' ' A' ' 108' ' ' ASP . 24.7 t0 -76.48 -173.45 2.52 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.07 -1.019 . . . . 0.0 109.446 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.507 ' H ' ' CG ' ' A' ' 107' ' ' ASP . 7.5 m-20 -157.46 -24.17 0.09 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.271 -0.893 . . . . 0.0 109.275 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . 0.551 ' O ' ' CG ' ' A' ' 110' ' ' PHE . 91.4 m-85 -79.61 -5.39 54.91 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.366 -0.834 . . . . 0.0 109.528 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . 0.551 ' CG ' ' O ' ' A' ' 109' ' ' PHE . 51.6 p90 42.09 -167.33 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.857 0 CA-C-O 121.455 0.645 . . . . 0.0 110.439 -179.777 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 39.8 p -154.03 -61.79 0.13 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.381 -0.825 . . . . 0.0 109.045 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 30.7 ptt180 -67.16 167.59 11.83 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.339 -0.851 . . . . 0.0 109.412 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 46.0 m -154.84 -69.43 0.13 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.229 -0.919 . . . . 0.0 109.472 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 47.4 t -66.3 96.27 0.34 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.216 -0.928 . . . . 0.0 109.525 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 77.7 m-70 -67.08 -27.75 67.62 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.24 -0.913 . . . . 0.0 109.461 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -67.84 85.45 0.22 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.319 -0.863 . . . . 0.0 109.551 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -67.18 -69.95 0.28 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.243 -0.911 . . . . 0.0 109.476 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -62.54 115.68 4.47 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.211 -0.93 . . . . 0.0 109.441 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.52 ' O ' ' N ' ' A' ' 121' ' ' THR . . . -171.29 -65.19 0.04 OUTLIER Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 58.0 mtt180 64.43 -42.38 0.28 Allowed 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.834 -0.804 . . . . 0.0 110.059 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.52 ' N ' ' O ' ' A' ' 119' ' ' GLY . 6.7 t -67.11 -155.8 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.993 -1.067 . . . . 0.0 109.489 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -172.0 -165.43 29.14 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 14.3 mt -68.85 135.17 50.7 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.157 -1.202 . . . . 0.0 109.37 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -73.8 162.51 73.8 Favored Pre-proline 0 N--CA 1.49 1.56 0 O-C-N 121.236 -0.915 . . . . 0.0 108.838 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -56.53 131.27 44.65 Favored 'Trans proline' 0 C--N 1.319 -0.989 0 C-N-CA 121.293 1.329 . . . . 0.0 109.709 179.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -75.4 8.12 3.03 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.205 -0.934 . . . . 0.0 109.324 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -151.49 70.69 0.97 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.294 -0.878 . . . . 0.0 109.37 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -78.72 -10.55 59.8 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.279 -0.888 . . . . 0.0 109.516 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 54.05 76.93 0.21 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.305 -0.872 . . . . 0.0 109.423 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 15.7 mt -74.79 111.24 9.79 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.311 -0.868 . . . . 0.0 109.458 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -146.63 -49.67 0.03 OUTLIER Glycine 0 N--CA 1.494 2.54 0 N-CA-C 109.464 -1.454 . . . . 0.0 109.464 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -68.08 -76.22 0.09 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.272 -1.134 . . . . 0.0 109.465 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 80.7 p -80.37 108.9 14.36 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.22 -0.925 . . . . 0.0 109.499 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -173.11 -161.39 23.37 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 94.5 p -67.55 118.65 11.14 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.229 -1.159 . . . . 0.0 109.53 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 40.5 t -70.28 -12.79 61.83 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.173 -0.954 . . . . 0.0 109.497 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 69.6 m 51.24 -100.73 0.09 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.283 -0.886 . . . . 0.0 109.462 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 40.3 t 50.82 -99.16 0.07 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.204 -0.935 . . . . 0.0 109.436 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -169.7 158.5 7.61 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.175 -0.953 . . . . 0.0 109.395 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 37.6 m -162.99 118.06 1.74 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.258 -0.901 . . . . 0.0 109.366 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 28.7 t -173.06 -39.67 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.259 -0.901 . . . . 0.0 109.384 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 5.1 m 52.04 47.46 24.71 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.26 -0.9 . . . . 0.0 109.416 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' HIS . . . . . 0.46 ' HD1' ' H ' ' A' ' 143' ' ' HIS . 29.3 p-80 -79.1 -177.21 5.5 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.275 -0.89 . . . . 0.0 109.444 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 30.3 t -169.91 -97.09 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.204 -0.935 . . . . 0.0 109.472 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 38.0 mmtm 55.28 40.91 31.69 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.261 -0.899 . . . . 0.0 109.439 -179.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 17.2 pt20 -58.79 140.09 55.48 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.294 -0.879 . . . . 0.0 109.478 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -77.86 -20.68 52.6 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.188 -0.945 . . . . 0.0 109.458 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 37.7 t -67.84 -41.08 84.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 O-C-N 121.292 -0.88 . . . . 0.0 109.466 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' SER . . . . . 0.433 ' O ' ' O ' ' A' ' 150' ' ' SER . 12.8 t 52.49 55.04 9.67 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.284 -0.885 . . . . 0.0 109.501 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' SER . . . . . 0.433 ' O ' ' O ' ' A' ' 149' ' ' SER . 2.0 m 61.04 144.08 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.327 -0.858 . . . . 0.0 109.557 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' SER . . . . . 0.423 ' O ' ' O ' ' A' ' 152' ' ' THR . 14.1 t -175.21 -65.35 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.224 -0.923 . . . . 0.0 109.509 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' THR . . . . . 0.423 ' O ' ' O ' ' A' ' 151' ' ' SER . 7.5 p 52.01 178.22 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.264 -0.897 . . . . 0.0 109.437 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 66.7 p -73.5 170.81 14.37 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.234 -0.916 . . . . 0.0 109.441 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 5.6 m -150.86 64.08 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 121.27 -0.894 . . . . 0.0 109.311 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 5.7 p-10 -157.06 123.31 4.89 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.293 -0.879 . . . . 0.0 109.388 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 86.2 mtm180 -99.61 -174.61 2.76 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.343 -0.848 . . . . 0.0 109.318 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -49.6 -75.29 0.21 Allowed Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -75.83 143.93 30.65 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 66.1 m -164.66 15.8 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.319 -1.106 . . . . 0.0 109.472 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -171.66 -167.6 0.52 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.3 -0.875 . . . . 0.0 109.449 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 9.7 tt -167.14 92.89 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.212 -0.93 . . . . 0.0 109.486 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 49.1 -146.21 0.36 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.105 -0.997 . . . . 0.0 109.504 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 68.2 m -165.17 42.55 0.08 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.206 -0.934 . . . . 0.0 109.475 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -169.07 67.76 0.06 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.219 -0.926 . . . . 0.0 109.418 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 165' ' ' HIS . . . . . 0.4 ' CG ' ' N ' ' A' ' 166' ' ' PHE . 13.1 p80 -63.42 -46.17 87.58 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.289 -0.882 . . . . 0.0 109.495 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 166' ' ' PHE . . . . . 0.4 ' N ' ' CG ' ' A' ' 165' ' ' HIS . 59.9 t80 . . . . . 0 N--CA 1.49 1.55 0 CA-C-O 118.022 -0.99 . . . . 0.0 109.453 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.58 HH11 ' CG ' ' A' ' 49' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.494 1.774 0 CA-C-O 121.224 0.535 . . . . 0.0 109.585 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.438 ' O ' ' O ' ' A' ' 49' ' ' ARG . 95.9 p -59.82 -150.69 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.341 -0.85 . . . . 0.0 109.621 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.57 ' SG ' ' N ' ' A' ' 52' ' ' SER . 10.3 t 50.84 -100.69 0.09 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.076 -1.015 . . . . 0.0 109.15 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.57 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 16.3 t -71.81 -165.35 0.16 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.223 -0.923 . . . . 0.0 108.967 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.516 ' N ' ' OG ' ' A' ' 52' ' ' SER . 19.4 tptm -120.87 106.17 11.39 Favored 'General case' 0 N--CA 1.498 1.969 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 9.9 t -125.99 117.82 49.99 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.522 -0.736 . . . . 0.0 109.541 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.478 HG23 ' O ' ' A' ' 55' ' ' ILE . 12.1 tt -122.77 119.64 58.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.488 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 71.1 p -131.61 113.46 13.64 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.536 -0.728 . . . . 0.0 109.157 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.551 ' N ' ' OG1' ' A' ' 69' ' ' THR . 11.9 mtpt -121.85 112.73 18.71 Favored 'General case' 0 N--CA 1.513 2.697 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 178.781 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 81.8 p -119.07 128.7 54.58 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.575 -0.703 . . . . 0.0 109.613 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.415 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.7 m -131.63 126.1 57.12 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 178.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.57 133.98 52.81 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.721 -0.612 . . . . 0.0 109.635 -179.781 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -123.42 162.45 22.78 Favored 'General case' 0 N--CA 1.518 2.944 0 O-C-N 121.186 -0.946 . . . . 0.0 109.229 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.46 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -67.22 -41.12 86.27 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.622 -1.299 . . . . 0.0 112.635 -177.383 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.508 ' OD1' ' N ' ' A' ' 63' ' ' ASP . 18.8 p-10 -68.17 8.55 0.42 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.351 -1.468 . . . . 0.0 110.201 -177.568 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.46 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 85.55 9.25 79.14 Favored Glycine 0 N--CA 1.493 2.446 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 179.218 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -83.49 100.65 10.89 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 120.912 -1.346 . . . . 0.0 107.435 178.494 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.4 p -131.68 113.29 13.4 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.469 -0.77 . . . . 0.0 110.068 -178.47 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -94.64 120.53 35.02 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.437 -0.79 . . . . 0.0 109.79 -179.552 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.4 p -101.36 110.58 22.61 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.396 -0.815 . . . . 0.0 109.248 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.551 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 28.0 p -111.21 29.4 7.83 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 179.02 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.4 ptmt -65.44 67.48 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.463 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 69' ' ' THR . 72.0 mm-40 -101.63 156.83 17.25 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.335 -0.853 . . . . 0.0 109.989 -179.249 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.434 ' O ' HG13 ' A' ' 72' ' ' VAL . 7.5 p -128.35 129.78 69.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 179.251 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.444 ' O ' ' O ' ' A' ' 53' ' ' LYS . 96.8 t -113.75 132.18 63.45 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 CA-C-O 122.279 1.037 . . . . 0.0 109.352 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.5 mmmt . . . . . 0 C--N 1.291 -1.966 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 179.594 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.429 ' O ' ' O ' ' A' ' 50' ' ' SER . 20.9 mmm180 . . . . . 0 N--CA 1.503 2.202 0 CA-C-O 121.314 0.578 . . . . 0.0 109.469 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.429 ' O ' ' O ' ' A' ' 49' ' ' ARG . 29.3 m -58.57 -156.81 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.278 -0.889 . . . . 0.0 109.945 -179.796 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.582 ' SG ' ' N ' ' A' ' 52' ' ' SER . 46.0 t 48.86 -119.41 1.19 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.295 -0.878 . . . . 0.0 109.346 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.582 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 42.0 m -60.64 128.09 34.91 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.058 -1.026 . . . . 0.0 108.843 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.442 ' O ' ' O ' ' A' ' 73' ' ' VAL . 0.0 OUTLIER -74.46 102.4 4.45 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.842 -1.161 . . . . 0.0 109.195 -179.419 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.574 HG13 ' O ' ' A' ' 54' ' ' VAL . 10.3 p -126.01 116.02 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 179.409 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.448 HG23 ' O ' ' A' ' 55' ' ' ILE . 17.9 tt -127.71 129.34 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 51.0 p -130.05 114.56 15.94 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.395 -0.816 . . . . 0.0 109.311 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.574 ' N ' ' OG1' ' A' ' 69' ' ' THR . 7.8 mtmt -121.4 113.5 19.97 Favored 'General case' 0 N--CA 1.514 2.771 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 178.692 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 65.9 p -116.38 136.29 53.13 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.479 -0.763 . . . . 0.0 109.886 -179.29 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.426 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.7 m -131.72 124.05 53.13 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 178.538 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -108.97 133.45 52.95 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.763 -0.586 . . . . 0.0 110.196 -179.161 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.479 ' OD1' ' N ' ' A' ' 62' ' ' ALA . 26.3 t-20 -125.46 158.78 33.57 Favored 'General case' 0 N--CA 1.516 2.827 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.479 ' N ' ' OD1' ' A' ' 61' ' ' ASN . . . -71.66 -31.52 66.92 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 120.365 -1.459 . . . . 0.0 112.445 -177.744 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -69.88 8.57 0.68 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.499 -1.376 . . . . 0.0 109.638 -178.803 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.442 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 85.36 5.27 85.3 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.722 -1.351 . . . . 0.0 109.722 179.505 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 64.0 ttt180 -83.43 103.02 12.46 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.77 -1.43 . . . . 0.0 107.929 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 12.2 p -132.66 108.54 9.11 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.473 -0.767 . . . . 0.0 109.703 -178.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -94.92 130.52 41.5 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.226 -0.922 . . . . 0.0 109.933 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.5 p -108.96 107.52 17.93 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.479 -0.763 . . . . 0.0 109.407 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.574 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 30.8 p -97.78 33.01 2.18 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 178.627 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 74.2 mttt -66.71 67.63 0.06 Allowed 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 179.048 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.48 ' N ' ' O ' ' A' ' 69' ' ' THR . 74.3 mt-10 -98.0 149.85 22.0 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.169 -0.957 . . . . 0.0 110.142 -179.05 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.6 t -129.04 117.16 43.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.442 ' O ' ' O ' ' A' ' 53' ' ' LYS . 59.4 t -114.79 126.85 72.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 CA-C-O 122.105 0.955 . . . . 0.0 109.349 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 50.8 mttp . . . . . 0 C--N 1.289 -2.041 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 179.5 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.529 HH11 ' CG ' ' A' ' 49' ' ' ARG . 0.9 OUTLIER . . . . . 0 N--CA 1.499 2.018 0 CA-C-O 121.2 0.524 . . . . 0.0 109.621 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 36.8 t -62.39 -105.01 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.266 -0.896 . . . . 0.0 109.234 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 5.6 t -49.75 146.11 4.68 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.145 -0.972 . . . . 0.0 108.818 179.474 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 40.3 t 50.54 87.49 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.007 -1.058 . . . . 0.0 108.342 -179.13 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -75.84 104.84 6.56 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.307 -0.87 . . . . 0.0 110.292 -178.626 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.599 HG13 ' O ' ' A' ' 54' ' ' VAL . 11.7 p -115.61 113.6 43.84 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.528 HG23 ' O ' ' A' ' 55' ' ' ILE . 10.1 tp -128.52 125.44 63.69 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 65.4 p -128.89 111.41 13.03 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.359 -0.838 . . . . 0.0 109.278 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.522 ' H ' ' HB ' ' A' ' 69' ' ' THR . 0.1 OUTLIER -124.55 113.59 18.28 Favored 'General case' 0 N--CA 1.51 2.561 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 178.767 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.0 p -110.95 130.22 55.65 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.467 -0.771 . . . . 0.0 109.67 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.497 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.8 m -132.55 120.3 41.77 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.14 0 O-C-N 121.481 -0.762 . . . . 0.0 109.207 178.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 33.9 p -109.11 133.86 52.46 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 37.6 t-20 -128.37 162.33 27.36 Favored 'General case' 0 N--CA 1.514 2.769 0 O-C-N 121.46 -0.775 . . . . 0.0 109.317 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.414 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -71.91 -32.38 67.32 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 120.559 -1.338 . . . . 0.0 112.558 -177.641 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -69.21 5.59 1.21 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.372 -1.455 . . . . 0.0 109.953 -178.541 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.414 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 90.79 4.76 69.33 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 110.08 -1.208 . . . . 0.0 110.08 179.227 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 11.2 mpt_? -80.67 94.24 6.3 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 120.636 -1.508 . . . . 0.0 107.86 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 31.0 p -120.36 89.66 3.17 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -94.73 122.21 37.11 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.268 -0.895 . . . . 0.0 110.051 -178.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.408 ' C ' ' H ' ' A' ' 70' ' ' LYS . 40.8 p -101.19 109.18 21.01 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.329 -0.857 . . . . 0.0 109.581 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.524 ' O ' ' N ' ' A' ' 71' ' ' GLU . 5.2 m -87.4 31.19 0.75 Allowed 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 178.781 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.408 ' H ' ' C ' ' A' ' 68' ' ' THR . 16.5 ptmt -64.84 59.01 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.774 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.524 ' N ' ' O ' ' A' ' 69' ' ' THR . 13.7 mm-40 -96.3 136.78 36.33 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.053 -1.029 . . . . 0.0 109.481 -179.709 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.486 ' O ' HG23 ' A' ' 72' ' ' VAL . 10.4 m -128.15 129.8 69.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 179.598 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 15.1 t -129.08 114.32 31.89 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 CA-C-O 122.057 0.932 . . . . 0.0 108.946 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.292 -1.928 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.604 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.475 ' O ' ' O ' ' A' ' 52' ' ' SER . 22.6 mmt180 . . . . . 0 N--CA 1.499 2.013 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.497 ' C ' ' H ' ' A' ' 52' ' ' SER . 29.5 t -78.71 -36.84 42.83 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.063 -1.023 . . . . 0.0 110.22 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 25.9 p -56.02 -4.02 0.11 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.029 -1.044 . . . . 0.0 109.744 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.524 ' OG ' ' N ' ' A' ' 53' ' ' LYS . 0.9 OUTLIER -166.26 -175.17 3.17 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 -179.78 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.524 ' N ' ' OG ' ' A' ' 52' ' ' SER . 44.6 tptt -103.89 101.67 11.46 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 120.95 -1.094 . . . . 0.0 108.049 179.176 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 21.7 t -127.63 114.73 37.03 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.875 0 O-C-N 121.479 -0.763 . . . . 0.0 109.975 -179.308 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.491 ' CG2' ' NZ ' ' A' ' 57' ' ' LYS . 35.9 mm -117.84 113.64 42.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 179.19 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 81.7 p -130.34 112.97 13.79 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.223 -0.923 . . . . 0.0 109.937 -179.585 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.57 ' N ' ' OG1' ' A' ' 69' ' ' THR . 10.9 mmtp -123.86 114.19 19.52 Favored 'General case' 0 N--CA 1.515 2.777 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 178.762 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 53.3 m -119.5 124.43 46.44 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.609 -0.682 . . . . 0.0 109.613 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.42 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.8 m -131.48 124.88 55.47 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.187 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.011 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' THR . . . . . 0.513 ' O ' HG23 ' A' ' 60' ' ' THR . 8.0 t -109.23 122.93 48.38 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.757 -0.589 . . . . 0.0 110.323 -179.465 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -110.56 144.94 38.66 Favored 'General case' 0 N--CA 1.513 2.685 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.464 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -62.82 -34.7 77.86 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 120.084 -1.635 . . . . 0.0 112.944 -177.422 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -66.24 5.63 0.52 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.355 -1.466 . . . . 0.0 110.045 -178.318 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.464 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 90.83 5.49 68.41 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 110.423 -1.071 . . . . 0.0 110.423 178.836 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 41.2 ttm180 -90.54 111.98 23.47 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.644 -1.504 . . . . 0.0 107.834 178.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.8 p -138.47 116.95 12.04 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.255 -0.903 . . . . 0.0 109.81 -179.01 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -94.35 119.51 33.21 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.281 -0.887 . . . . 0.0 109.77 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.0 p -103.46 109.0 20.49 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.431 -0.793 . . . . 0.0 109.395 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.57 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 4.6 p -111.62 26.72 10.35 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 107.383 -1.339 . . . . 0.0 107.383 178.759 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 36.4 pttt -65.36 65.9 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' A' ' 69' ' ' THR . 46.5 mt-10 -102.34 156.69 17.42 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.373 -0.83 . . . . 0.0 110.26 -179.121 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.3 p -127.56 136.32 60.8 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.449 ' O ' ' CB ' ' A' ' 74' ' ' LYS . 20.1 t -129.44 117.53 42.98 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.101 0 CA-C-O 121.972 0.891 . . . . 0.0 109.921 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.449 ' CB ' ' O ' ' A' ' 73' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.497 1.884 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.427 ' O ' ' O ' ' A' ' 50' ' ' SER . 32.9 ttp180 . . . . . 0 N--CA 1.496 1.849 0 CA-C-O 121.43 0.634 . . . . 0.0 110.286 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.427 ' O ' ' O ' ' A' ' 49' ' ' ARG . 11.9 m 53.45 171.36 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.338 -0.851 . . . . 0.0 110.206 179.358 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.448 ' SG ' ' N ' ' A' ' 52' ' ' SER . 6.2 p -58.88 -62.05 2.17 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.387 -0.821 . . . . 0.0 109.165 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.448 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 9.0 t -49.27 146.05 4.02 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.077 -1.015 . . . . 0.0 108.764 179.507 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -84.1 102.02 12.24 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 120.999 -1.063 . . . . 0.0 109.689 -179.47 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.603 HG13 ' O ' ' A' ' 54' ' ' VAL . 13.6 p -125.82 117.12 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 CA-C-O 121.576 0.703 . . . . 0.0 109.107 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 7.3 tp -128.36 138.4 54.75 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 49.0 m -128.07 113.31 15.62 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.35 -0.844 . . . . 0.0 109.518 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.54 ' H ' ' HB ' ' A' ' 69' ' ' THR . 5.5 mtmm -125.14 116.26 21.76 Favored 'General case' 0 N--CA 1.511 2.61 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 178.582 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.4 t -116.81 141.29 48.4 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.395 -0.816 . . . . 0.0 109.92 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.493 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.8 m -132.31 120.8 44.29 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.16 0 O-C-N 121.554 -0.716 . . . . 0.0 109.311 179.067 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 32.0 p -110.16 133.36 53.3 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.836 -0.54 . . . . 0.0 109.841 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.429 ' OD1' ' N ' ' A' ' 62' ' ' ALA . 16.2 t-20 -137.55 172.18 13.36 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.367 -0.833 . . . . 0.0 109.734 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.429 ' N ' ' OD1' ' A' ' 61' ' ' ASN . . . -63.32 -39.96 96.0 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.85 -1.156 . . . . 0.0 112.621 -177.357 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 35.9 m-20 -68.8 6.04 0.97 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.445 -1.409 . . . . 0.0 109.929 -178.429 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.519 ' O ' ' N ' ' A' ' 66' ' ' THR . . . 89.22 8.69 68.28 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.865 -1.294 . . . . 0.0 109.865 179.286 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.418 ' O ' ' O ' ' A' ' 59' ' ' VAL . 12.8 tpt180 -64.09 79.94 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.35 0 O-C-N 120.728 -1.454 . . . . 0.0 108.139 179.306 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.519 ' N ' ' O ' ' A' ' 64' ' ' GLY . 72.9 p -112.2 72.32 0.77 Allowed 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 -179.69 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -94.79 128.33 41.43 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.341 -0.85 . . . . 0.0 109.775 -179.013 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.525 ' C ' ' H ' ' A' ' 70' ' ' LYS . 31.3 p -100.01 109.8 22.12 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.323 -0.861 . . . . 0.0 109.675 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.54 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 5.3 m -78.7 36.39 0.26 Allowed 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 178.503 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.525 ' H ' ' C ' ' A' ' 68' ' ' THR . 40.7 pttt -65.07 62.65 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 179.098 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.531 ' N ' ' O ' ' A' ' 69' ' ' THR . 45.8 mt-10 -85.36 139.91 31.19 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.097 -1.002 . . . . 0.0 110.07 -179.364 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.549 ' O ' HG23 ' A' ' 72' ' ' VAL . 16.2 m -128.41 124.14 61.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 21.6 t -126.04 117.41 48.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 CA-C-O 122.16 0.981 . . . . 0.0 109.077 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 96.1 mttt . . . . . 0 C--N 1.29 -2.001 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.545 179.943 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 . . . . . 0 N--CA 1.496 1.842 0 CA-C-O 121.232 0.539 . . . . 0.0 109.654 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.2 m 67.86 169.78 0.27 Allowed 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.472 -0.767 . . . . 0.0 110.194 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.444 ' O ' ' O ' ' A' ' 52' ' ' SER . 1.6 m -56.91 -65.15 0.66 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.267 -0.895 . . . . 0.0 109.431 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.553 ' OG ' ' N ' ' A' ' 53' ' ' LYS . 12.7 t -58.64 -157.37 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.553 ' N ' ' OG ' ' A' ' 52' ' ' SER . 89.2 tttt -122.42 100.47 6.96 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.145 -0.972 . . . . 0.0 108.612 179.02 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.588 HG13 ' O ' ' A' ' 54' ' ' VAL . 11.3 p -126.65 120.37 55.92 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.709 -0.619 . . . . 0.0 109.58 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 2.3 pt -126.4 134.15 67.06 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.53 -0.731 . . . . 0.0 109.037 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 46.8 p -132.42 114.51 14.43 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.404 -0.81 . . . . 0.0 109.384 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.569 ' H ' ' HB ' ' A' ' 69' ' ' THR . 22.1 mttt -121.47 113.06 19.3 Favored 'General case' 0 N--CA 1.513 2.686 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.664 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 29.7 p -119.76 138.29 53.42 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.638 -0.664 . . . . 0.0 109.934 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.403 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.9 m -131.47 125.69 56.93 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.135 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.849 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 48.7 p -107.77 110.39 22.19 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.7 -0.625 . . . . 0.0 110.373 -179.027 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.44 ' N ' ' ND2' ' A' ' 61' ' ' ASN . 1.0 OUTLIER -100.24 144.08 29.68 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.354 -0.841 . . . . 0.0 108.769 179.395 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.445 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -67.03 -32.64 73.99 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 120.047 -1.658 . . . . 0.0 112.908 -177.425 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -65.74 4.28 0.63 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.291 -1.505 . . . . 0.0 110.006 -178.21 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.445 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 95.64 6.47 59.56 Favored Glycine 0 N--CA 1.496 2.693 0 N-CA-C 110.778 -0.929 . . . . 0.0 110.778 178.405 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 60.1 ttt180 -92.94 112.31 24.23 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.677 -1.484 . . . . 0.0 107.794 178.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.5 p -138.73 113.89 9.44 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.227 -0.921 . . . . 0.0 109.769 -178.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -99.83 130.23 46.0 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.319 -0.863 . . . . 0.0 109.993 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -107.07 108.93 20.66 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.586 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.569 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 4.5 m -96.31 28.7 3.14 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 107.531 -1.285 . . . . 0.0 107.531 179.087 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.1 pttp -64.81 67.74 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.515 ' N ' ' O ' ' A' ' 69' ' ' THR . 50.8 mt-10 -104.26 157.09 17.37 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.312 -0.868 . . . . 0.0 110.046 -179.239 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.468 ' O ' HG13 ' A' ' 72' ' ' VAL . 7.4 p -128.16 125.42 64.34 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.437 ' O ' ' O ' ' A' ' 53' ' ' LYS . 79.0 t -107.19 135.44 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 CA-C-O 121.922 0.868 . . . . 0.0 109.434 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 65.1 tttt . . . . . 0 N--CA 1.505 2.301 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.399 179.918 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 . . . . . 0 N--CA 1.493 1.715 0 CA-C-O 121.339 0.59 . . . . 0.0 109.831 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.3 m 57.97 174.22 0.06 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.364 -0.835 . . . . 0.0 109.969 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 39.1 t -59.53 -75.4 0.06 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.347 -0.845 . . . . 0.0 109.511 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 3.0 t -47.17 141.12 4.66 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.204 -0.935 . . . . 0.0 109.191 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -73.92 103.51 4.46 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 120.998 -1.064 . . . . 0.0 109.599 -179.006 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.596 HG13 ' O ' ' A' ' 54' ' ' VAL . 10.7 p -126.57 118.08 49.99 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.776 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.545 HG23 ' O ' ' A' ' 55' ' ' ILE . 6.6 tt -126.99 122.45 60.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.531 -0.731 . . . . 0.0 109.125 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 17.9 m -129.21 111.86 13.33 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.437 -0.789 . . . . 0.0 109.671 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.526 ' H ' ' HB ' ' A' ' 69' ' ' THR . 31.1 mmtt -126.03 113.35 17.0 Favored 'General case' 0 N--CA 1.515 2.775 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 178.065 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 96.6 m -110.3 125.03 52.72 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.533 -0.729 . . . . 0.0 109.489 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.4 m -132.49 119.98 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.3 m -109.52 133.68 52.8 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.713 -0.617 . . . . 0.0 109.842 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -125.24 159.01 32.65 Favored 'General case' 0 N--CA 1.516 2.861 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.88 -33.96 68.78 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 120.538 -1.351 . . . . 0.0 112.477 -177.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.508 ' OD2' ' NH2' ' A' ' 65' ' ' ARG . 11.6 p30 -70.69 2.34 4.25 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.445 -1.409 . . . . 0.0 110.411 -178.417 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 98.32 1.07 58.09 Favored Glycine 0 N--CA 1.494 2.525 0 N-CA-C 109.629 -1.388 . . . . 0.0 109.629 179.592 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.508 ' NH2' ' OD2' ' A' ' 63' ' ' ASP . 1.3 mpp_? -76.8 85.55 3.4 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 178.543 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 93.4 m -122.18 93.35 3.96 Favored 'General case' 0 N--CA 1.492 1.665 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 -178.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -100.0 129.78 46.1 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.427 -0.796 . . . . 0.0 109.909 -179.153 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 40.1 p -106.04 109.76 21.81 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.413 -0.804 . . . . 0.0 109.609 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.526 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 3.5 m -88.95 30.5 0.93 Allowed 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 178.706 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.404 ' NZ ' ' CB ' ' A' ' 70' ' ' LYS . 0.3 OUTLIER -66.75 58.12 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 109.02 -0.734 . . . . 0.0 109.02 179.623 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.501 ' N ' ' O ' ' A' ' 69' ' ' THR . 79.8 mt-10 -101.07 141.45 33.94 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.221 -0.925 . . . . 0.0 109.833 -179.585 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.404 HG13 ' O ' ' A' ' 72' ' ' VAL . 7.7 p -128.17 131.53 69.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 15.7 t -129.87 116.05 36.13 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.942 0 CA-C-O 122.146 0.974 . . . . 0.0 109.418 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.288 -2.067 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.42 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.435 ' O ' ' O ' ' A' ' 50' ' ' SER . 44.6 ttm180 . . . . . 0 N--CA 1.494 1.729 0 CA-C-O 121.261 0.553 . . . . 0.0 109.599 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.435 ' O ' ' O ' ' A' ' 49' ' ' ARG . 73.3 m -45.98 -94.48 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.337 -0.852 . . . . 0.0 109.876 -179.85 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 1.9 t -58.28 162.51 3.55 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.247 -0.908 . . . . 0.0 109.315 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 4.5 p 61.82 152.4 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.25 -0.906 . . . . 0.0 109.492 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -95.71 112.33 24.07 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.323 -0.861 . . . . 0.0 109.08 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 96.6 t -126.94 116.4 44.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.489 -0.757 . . . . 0.0 109.358 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.496 ' O ' HD12 ' A' ' 55' ' ' ILE . 2.4 pp -127.81 121.64 56.98 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 67.9 p -130.74 112.61 13.23 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.355 -0.84 . . . . 0.0 109.625 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.5 ' H ' ' HB ' ' A' ' 69' ' ' THR . 0.7 OUTLIER -123.38 111.51 16.45 Favored 'General case' 0 N--CA 1.51 2.549 0 N-CA-C 108.72 -0.845 . . . . 0.0 108.72 178.791 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 70.4 p -120.63 126.13 49.49 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.604 -0.685 . . . . 0.0 109.198 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.538 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.8 m -131.71 118.68 39.49 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.214 0 O-C-N 121.399 -0.813 . . . . 0.0 109.476 179.268 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 69.3 p -113.48 135.72 53.58 Favored 'General case' 0 N--CA 1.499 1.979 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.647 ' ND2' ' H ' ' A' ' 62' ' ' ALA . 4.5 t-20 -164.52 165.05 21.61 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.651 -1.281 . . . . 0.0 110.25 179.331 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.647 ' H ' ' ND2' ' A' ' 61' ' ' ASN . . . -74.81 -11.42 60.14 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 120.97 -1.081 . . . . 0.0 111.189 -179.432 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -74.71 8.95 2.05 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.122 -0.986 . . . . 0.0 109.591 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.42 10.08 84.0 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 108.9 -1.68 . . . . 0.0 108.9 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -91.7 97.2 10.87 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.059 -1.259 . . . . 0.0 108.705 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 48.4 p -129.79 66.12 1.48 Allowed 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 107.659 -1.238 . . . . 0.0 107.659 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -94.15 122.04 36.27 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.688 0.756 . . . . 0.0 111.195 -177.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.2 p -101.29 111.55 23.8 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 178.44 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.515 ' O ' ' N ' ' A' ' 71' ' ' GLU . 4.3 m -112.97 25.62 11.24 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 179.653 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 26.9 pttt -66.2 68.76 0.05 Allowed 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 179.179 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.515 ' N ' ' O ' ' A' ' 69' ' ' THR . 43.8 mm-40 -105.41 149.92 25.71 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.423 -0.798 . . . . 0.0 109.696 -179.455 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 24.1 m -127.43 142.99 42.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 16.5 t -128.62 119.84 51.07 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 CA-C-O 121.945 0.879 . . . . 0.0 109.012 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 62.6 tttp . . . . . 0 C--N 1.291 -1.974 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.523 -179.996 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.1 mmm180 . . . . . 0 N--CA 1.494 1.768 0 CA-C-O 121.282 0.563 . . . . 0.0 109.709 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.445 ' O ' ' O ' ' A' ' 51' ' ' CYS . 41.7 t -67.02 -67.82 0.42 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.222 -0.924 . . . . 0.0 109.668 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.445 ' O ' ' O ' ' A' ' 50' ' ' SER . 41.7 t -47.73 -93.39 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.157 -0.964 . . . . 0.0 109.235 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 48.7 m -55.47 149.79 12.9 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 22.9 tptp -95.56 100.4 12.14 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 120.959 -1.088 . . . . 0.0 108.438 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 41.2 t -128.45 116.2 40.83 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.647 -0.658 . . . . 0.0 109.562 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.519 HG23 ' O ' ' A' ' 55' ' ' ILE . 17.0 tt -127.89 124.92 63.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 179.545 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.6 m -128.19 111.65 13.67 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.365 -0.835 . . . . 0.0 109.488 -179.338 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.525 ' H ' ' HB ' ' A' ' 69' ' ' THR . 10.0 mtmt -124.3 114.42 19.54 Favored 'General case' 0 N--CA 1.512 2.652 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 178.203 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.9 p -118.96 126.63 52.2 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.433 -0.792 . . . . 0.0 109.752 -179.506 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.6 m -132.35 122.93 49.12 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.13 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 178.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' THR . . . . . 0.539 ' O ' HG23 ' A' ' 60' ' ' THR . 7.9 t -107.57 120.17 41.46 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.561 -0.712 . . . . 0.0 109.98 -179.43 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.462 ' ND2' ' O ' ' A' ' 65' ' ' ARG . 2.5 m-20 -111.82 145.45 39.41 Favored 'General case' 0 N--CA 1.51 2.553 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.418 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -69.96 -30.26 67.58 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 120.07 -1.644 . . . . 0.0 112.737 -177.554 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 11.5 p30 -67.07 3.99 1.0 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.249 -1.532 . . . . 0.0 109.863 -178.587 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.418 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 96.83 5.6 58.51 Favored Glycine 0 N--CA 1.496 2.654 0 N-CA-C 110.664 -0.974 . . . . 0.0 110.664 178.6 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.462 ' O ' ' ND2' ' A' ' 61' ' ' ASN . 11.7 mpt_? -91.68 104.82 17.24 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.568 -1.548 . . . . 0.0 108.043 178.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 28.7 p -130.1 104.53 7.38 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.536 -0.728 . . . . 0.0 109.128 -179.489 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -94.58 127.61 40.63 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.154 -0.966 . . . . 0.0 109.979 -179.18 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.409 HG22 ' H ' ' A' ' 70' ' ' LYS . 73.3 m -108.68 108.37 19.2 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.546 -0.721 . . . . 0.0 109.286 179.571 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.525 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 5.8 m -102.08 27.14 6.86 Favored 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 178.776 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.409 ' H ' HG22 ' A' ' 68' ' ' THR . 86.7 tttt -70.09 69.04 0.33 Allowed 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -106.26 143.98 33.61 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.552 -0.718 . . . . 0.0 109.275 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 43.1 t -128.11 129.19 69.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 179.496 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 17.2 t -130.12 116.93 38.76 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 CA-C-O 122.072 0.939 . . . . 0.0 108.95 179.224 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 58.1 mttp . . . . . 0 C--N 1.287 -2.109 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.614 -179.901 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.574 HH11 ' CG ' ' A' ' 49' ' ' ARG . 0.4 OUTLIER . . . . . 0 N--CA 1.5 2.055 0 CA-C-O 121.316 0.579 . . . . 0.0 109.995 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.446 ' O ' ' O ' ' A' ' 51' ' ' CYS . 31.0 m -70.45 -55.67 8.46 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.261 -0.899 . . . . 0.0 110.217 -179.749 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.446 ' O ' ' O ' ' A' ' 50' ' ' SER . 45.8 t -56.69 -107.88 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.214 -0.929 . . . . 0.0 109.346 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.3 t -51.06 165.89 0.11 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.867 -1.146 . . . . 0.0 108.469 179.476 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 16.4 mmmt -107.53 99.68 9.16 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.268 -0.895 . . . . 0.0 109.524 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.611 HG13 ' O ' ' A' ' 54' ' ' VAL . 9.6 p -129.28 115.79 37.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 179.301 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.9 mm -127.11 118.43 50.16 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.0 m -129.4 112.41 13.79 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.424 -0.797 . . . . 0.0 109.068 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.54 ' N ' ' OG1' ' A' ' 69' ' ' THR . 17.3 mttp -123.1 113.39 18.93 Favored 'General case' 0 N--CA 1.514 2.759 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 178.568 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 58.1 m -114.84 127.05 55.49 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.469 -0.769 . . . . 0.0 109.521 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.432 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.8 m -131.56 123.84 53.17 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.144 0 O-C-N 121.486 -0.759 . . . . 0.0 109.051 179.081 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 73.2 p -108.37 120.61 42.9 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.703 -0.623 . . . . 0.0 110.006 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.545 ' N ' ' OD1' ' A' ' 61' ' ' ASN . 0.7 OUTLIER -108.53 144.16 36.56 Favored 'General case' 0 N--CA 1.512 2.675 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.692 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.426 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -66.66 -31.08 71.52 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 119.949 -1.719 . . . . 0.0 112.474 -177.683 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.433 ' OD1' ' N ' ' A' ' 63' ' ' ASP . 16.1 p-10 -66.96 3.58 1.06 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.295 -1.503 . . . . 0.0 109.798 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.426 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 94.61 5.34 61.61 Favored Glycine 0 N--CA 1.497 2.719 0 N-CA-C 110.586 -1.006 . . . . 0.0 110.586 178.746 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.429 ' O ' ' OD1' ' A' ' 61' ' ' ASN . 63.0 ttt180 -92.3 109.5 20.88 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.608 -1.525 . . . . 0.0 108.086 178.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 17.6 p -134.19 112.5 11.15 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.31 -0.869 . . . . 0.0 109.48 -179.307 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -94.35 130.9 40.48 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.326 -0.859 . . . . 0.0 109.827 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.494 ' O ' ' CG2' ' A' ' 68' ' ' THR . 1.1 t -111.52 110.33 20.7 Favored 'General case' 0 N--CA 1.5 2.052 0 CA-C-O 122.013 0.911 . . . . 0.0 109.525 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.54 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 68.4 p -110.68 28.65 8.47 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 179.727 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.47 ' HB2' ' HZ3' ' A' ' 70' ' ' LYS . 18.4 mtmm -65.68 63.28 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.583 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.527 ' N ' ' O ' ' A' ' 69' ' ' THR . 56.5 mt-10 -102.23 140.83 35.99 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.447 -0.783 . . . . 0.0 109.502 -179.52 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.407 ' O ' HG23 ' A' ' 72' ' ' VAL . 17.9 m -127.78 136.29 60.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 179.499 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 13.2 t -129.79 116.51 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 CA-C-O 121.863 0.839 . . . . 0.0 109.077 179.178 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 96.1 mttt . . . . . 0 C--N 1.287 -2.115 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 -179.977 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 . . . . . 0 N--CA 1.502 2.153 0 CA-C-O 121.196 0.522 . . . . 0.0 109.721 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.444 ' O ' ' O ' ' A' ' 51' ' ' CYS . 50.7 m -63.55 -52.66 60.15 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.215 -0.928 . . . . 0.0 109.862 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.444 ' O ' ' O ' ' A' ' 50' ' ' SER . 36.8 t -48.01 -93.85 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.147 -0.971 . . . . 0.0 109.187 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 11.3 t -63.09 138.29 58.51 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.053 -1.029 . . . . 0.0 108.369 179.354 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -73.06 104.81 4.27 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 120.918 -1.114 . . . . 0.0 109.543 -179.065 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 21.1 t -125.12 116.19 46.28 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 41.5 mm -126.64 121.6 58.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 22.8 m -128.17 110.59 12.58 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.445 -0.784 . . . . 0.0 109.193 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.528 ' H ' ' HB ' ' A' ' 69' ' ' THR . 7.3 mtmt -124.9 113.91 18.48 Favored 'General case' 0 N--CA 1.511 2.624 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 178.435 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 59.0 p -114.31 132.43 56.18 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.551 -0.718 . . . . 0.0 109.776 -179.455 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.445 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.8 m -131.58 122.79 50.98 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.156 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.896 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 65.2 p -107.41 122.96 47.66 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.731 -0.605 . . . . 0.0 110.015 -179.406 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.444 ' ND2' ' O ' ' A' ' 65' ' ' ARG . 3.4 m-20 -113.2 145.16 41.46 Favored 'General case' 0 N--CA 1.511 2.61 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 179.68 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.59 -28.33 64.78 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 119.956 -1.715 . . . . 0.0 112.319 -177.775 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -67.33 2.38 1.7 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.536 -1.353 . . . . 0.0 109.827 -178.892 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.25 7.27 58.4 Favored Glycine 0 N--CA 1.496 2.681 0 N-CA-C 110.519 -1.032 . . . . 0.0 110.519 178.786 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.444 ' O ' ' ND2' ' A' ' 61' ' ' ASN . 16.0 mmm180 -95.98 109.46 21.84 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.876 -1.367 . . . . 0.0 108.344 179.058 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.7 p -134.67 109.24 8.49 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.347 -0.846 . . . . 0.0 109.336 -179.251 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -96.8 132.02 42.94 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.28 -0.887 . . . . 0.0 110.221 -179.069 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.522 HG22 ' H ' ' A' ' 70' ' ' LYS . 81.1 m -108.82 107.25 17.6 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.468 -0.77 . . . . 0.0 109.495 179.698 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.528 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 6.3 m -94.31 32.29 1.57 Allowed 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 178.626 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.522 ' H ' HG22 ' A' ' 68' ' ' THR . 55.0 tttm -73.54 68.83 1.19 Allowed 'General case' 0 N--CA 1.504 2.249 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.276 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -107.5 147.44 30.5 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.529 -0.732 . . . . 0.0 109.598 -179.756 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 38.6 t -128.08 125.99 65.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 20.5 t -128.19 116.06 40.81 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 CA-C-O 122.238 1.018 . . . . 0.0 109.351 179.649 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 1.1 ptpp? . . . . . 0 C--N 1.287 -2.115 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.593 -179.86 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.568 HH11 ' CG ' ' A' ' 49' ' ' ARG . 3.6 mtt-85 . . . . . 0 N--CA 1.495 1.8 0 CA-C-O 121.336 0.589 . . . . 0.0 109.806 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.4 m 54.42 175.42 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.286 -0.884 . . . . 0.0 110.151 179.462 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 32.3 t -62.35 -73.27 0.11 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.375 -0.828 . . . . 0.0 109.398 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 76.6 p -47.59 144.66 3.04 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.207 -0.933 . . . . 0.0 108.912 179.596 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.415 ' O ' ' O ' ' A' ' 73' ' ' VAL . 24.9 mtpp -75.19 102.65 5.06 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 120.895 -1.128 . . . . 0.0 109.794 -178.98 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.578 HG13 ' O ' ' A' ' 54' ' ' VAL . 11.4 p -124.67 120.51 59.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.429 HG23 ' O ' ' A' ' 55' ' ' ILE . 15.8 tt -126.29 130.52 71.98 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 24.4 m -128.57 117.89 22.04 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.546 -0.721 . . . . 0.0 109.483 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.544 ' H ' ' HB ' ' A' ' 69' ' ' THR . 26.4 ttpt -126.52 114.33 17.98 Favored 'General case' 0 N--CA 1.519 3.015 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 177.828 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 54.7 m -119.13 137.51 53.54 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.547 -0.721 . . . . 0.0 109.902 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.49 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.8 m -132.25 120.79 44.4 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.78 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 33.9 p -109.66 133.5 53.04 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.739 -0.6 . . . . 0.0 109.555 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 18.2 t30 -134.65 169.59 17.08 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 121.352 -0.843 . . . . 0.0 109.424 179.463 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.13 -42.78 99.15 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.811 -1.18 . . . . 0.0 112.552 -177.244 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -68.8 2.65 2.41 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.393 -1.442 . . . . 0.0 110.457 -177.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.537 ' O ' ' N ' ' A' ' 66' ' ' THR . . . 95.01 10.89 57.08 Favored Glycine 0 N--CA 1.494 2.511 0 N-CA-C 110.059 -1.217 . . . . 0.0 110.059 179.123 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.582 HH11 ' CG ' ' A' ' 65' ' ' ARG . 0.1 OUTLIER -64.34 78.64 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.42 0 O-C-N 120.785 -1.421 . . . . 0.0 107.926 179.133 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.537 ' N ' ' O ' ' A' ' 64' ' ' GLY . 71.0 p -109.68 75.85 0.96 Allowed 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 -179.209 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -93.3 115.89 28.46 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.439 -0.788 . . . . 0.0 109.097 -179.098 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.7 m -97.74 109.99 22.64 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.186 -0.946 . . . . 0.0 109.703 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.544 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 3.6 m -85.27 35.09 0.58 Allowed 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 178.8 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 40.4 pttt -64.45 61.53 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.536 ' N ' ' O ' ' A' ' 69' ' ' THR . 13.2 mm-40 -88.09 150.21 23.5 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.061 -1.025 . . . . 0.0 109.547 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 15.8 t -129.0 116.24 39.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.415 ' O ' ' O ' ' A' ' 53' ' ' LYS . 98.7 t -109.71 129.82 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 CA-C-O 122.142 0.973 . . . . 0.0 109.151 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 21.9 pttp . . . . . 0 C--N 1.29 -2.018 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.527 179.974 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 . . . . . 0 N--CA 1.494 1.728 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.425 ' O ' ' O ' ' A' ' 51' ' ' CYS . 87.8 p -66.72 163.0 20.07 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.244 -0.91 . . . . 0.0 109.308 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.425 ' O ' ' O ' ' A' ' 50' ' ' SER . 4.3 t 62.3 139.17 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.324 -0.86 . . . . 0.0 109.395 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.435 ' OG ' ' N ' ' A' ' 53' ' ' LYS . 10.1 t 51.61 178.25 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.283 -0.886 . . . . 0.0 109.425 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.435 ' N ' ' OG ' ' A' ' 52' ' ' SER . 56.7 mttp -113.86 111.64 22.06 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.527 -0.733 . . . . 0.0 109.536 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 91.7 t -126.68 117.17 47.34 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.452 -0.78 . . . . 0.0 109.565 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 29.1 mm -111.3 116.04 51.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.945 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 179.403 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.6 m -129.27 113.49 15.07 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.423 -0.798 . . . . 0.0 109.593 -179.59 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.516 ' N ' ' OG1' ' A' ' 69' ' ' THR . 1.5 mtmm -122.73 111.64 16.96 Favored 'General case' 0 N--CA 1.511 2.587 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 178.294 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 63.4 m -119.36 135.37 54.75 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.477 -0.765 . . . . 0.0 109.446 -179.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.523 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.9 m -131.81 118.93 39.99 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.212 0 O-C-N 121.544 -0.722 . . . . 0.0 109.571 179.123 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 81.2 p -112.8 136.46 52.39 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 179.402 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.521 ' OD1' ' N ' ' A' ' 62' ' ' ALA . 7.0 t30 -163.91 163.88 23.49 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 120.586 -1.322 . . . . 0.0 110.095 179.356 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.521 ' N ' ' OD1' ' A' ' 61' ' ' ASN . . . -74.68 -10.45 59.54 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.013 -1.055 . . . . 0.0 110.898 -179.346 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.408 ' CB ' ' ND2' ' A' ' 61' ' ' ASN . 26.7 t70 -75.25 6.25 4.61 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.187 -0.946 . . . . 0.0 109.752 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.19 10.89 79.54 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 108.91 -1.676 . . . . 0.0 108.91 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -92.61 97.56 10.88 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.936 -1.332 . . . . 0.0 108.779 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 54.1 p -127.41 68.77 1.29 Allowed 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 179.693 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -94.24 129.46 40.86 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.523 -0.736 . . . . 0.0 111.053 -178.027 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -111.28 111.76 23.05 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 178.712 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.516 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 22.4 p -109.91 37.22 2.73 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 179.167 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 45.4 pttt -65.72 61.39 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.906 0 C-N-CA 120.252 -0.579 . . . . 0.0 109.46 179.287 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.514 ' N ' ' O ' ' A' ' 69' ' ' THR . 50.0 mt-10 -84.92 146.78 27.08 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.169 -0.957 . . . . 0.0 109.609 -179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 22.4 m -127.44 143.23 41.31 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 12.3 t -128.55 119.17 49.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.027 0 CA-C-O 122.029 0.918 . . . . 0.0 109.064 179.319 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 21.0 pttp . . . . . 0 C--N 1.291 -1.954 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.542 -179.869 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.428 ' O ' ' O ' ' A' ' 50' ' ' SER . 95.5 mtt180 . . . . . 0 N--CA 1.495 1.787 0 CA-C-O 121.233 0.54 . . . . 0.0 109.614 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.428 ' O ' ' O ' ' A' ' 49' ' ' ARG . 47.1 t -59.07 -156.65 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.234 -0.916 . . . . 0.0 109.494 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.429 ' O ' ' O ' ' A' ' 52' ' ' SER . 4.8 t 50.74 -118.24 1.2 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.101 -0.999 . . . . 0.0 108.716 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.491 ' OG ' ' N ' ' A' ' 53' ' ' LYS . 26.6 t -56.97 -167.11 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.502 0 O-C-N 120.712 -1.242 . . . . 0.0 108.966 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.491 ' N ' ' OG ' ' A' ' 52' ' ' SER . 50.5 mttp -126.4 103.65 7.75 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.326 -0.858 . . . . 0.0 109.45 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 51.0 t -127.66 116.15 42.28 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.569 -0.707 . . . . 0.0 109.192 179.678 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.473 HG23 ' O ' ' A' ' 55' ' ' ILE . 14.8 tt -128.66 125.25 63.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.564 -0.71 . . . . 0.0 109.415 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 81.0 p -127.85 113.33 15.78 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.402 -0.811 . . . . 0.0 109.323 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.505 ' H ' ' HB ' ' A' ' 69' ' ' THR . 41.7 tttm -127.59 113.64 16.36 Favored 'General case' 0 N--CA 1.519 3.022 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.314 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 91.5 m -108.94 125.22 51.79 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.496 -0.752 . . . . 0.0 109.436 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.5 m -132.56 119.92 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.178 0 O-C-N 121.45 -0.781 . . . . 0.0 109.071 178.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 60.8 m -109.65 134.44 51.96 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.753 -0.592 . . . . 0.0 109.655 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -127.19 162.29 26.51 Favored 'General case' 0 N--CA 1.516 2.85 0 O-C-N 121.385 -0.822 . . . . 0.0 109.347 179.416 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.44 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -71.59 -33.37 68.99 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.538 -1.351 . . . . 0.0 112.6 -177.531 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -69.48 7.26 0.85 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.453 -1.405 . . . . 0.0 109.813 -178.521 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.44 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 87.84 5.02 78.29 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.412 HH11 ' CG ' ' A' ' 65' ' ' ARG . 1.9 ttt-85 -81.15 96.55 7.24 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 120.705 -1.468 . . . . 0.0 107.865 178.811 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.6 p -122.08 94.89 4.45 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.607 -0.683 . . . . 0.0 109.196 -179.069 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -94.66 119.64 33.62 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.228 -0.92 . . . . 0.0 109.864 -179.105 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.487 ' OG1' ' NZ ' ' A' ' 70' ' ' LYS . 40.7 p -102.36 108.53 19.91 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.377 -0.827 . . . . 0.0 109.631 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.545 ' O ' ' N ' ' A' ' 71' ' ' GLU . 3.2 m -87.87 31.38 0.78 Allowed 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 178.693 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.487 ' NZ ' ' OG1' ' A' ' 68' ' ' THR . 22.0 pttm -65.13 56.7 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 179.831 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.545 ' N ' ' O ' ' A' ' 69' ' ' THR . 75.0 mt-10 -93.8 135.94 34.59 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.962 -1.086 . . . . 0.0 109.943 -179.621 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 47.8 t -128.03 129.17 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 179.239 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.422 ' O ' ' OG ' ' A' ' 52' ' ' SER . 16.6 t -128.61 116.2 40.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 CA-C-O 121.946 0.879 . . . . 0.0 109.236 179.677 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 45.9 mtmt . . . . . 0 C--N 1.289 -2.052 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 179.946 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 53.6 mtp180 . . . . . 0 N--CA 1.493 1.698 0 CA-C-O 121.374 0.607 . . . . 0.0 110.059 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.9 m 58.22 169.99 0.05 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.383 -0.823 . . . . 0.0 110.149 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.44 ' SG ' ' N ' ' A' ' 52' ' ' SER . 31.2 p -66.83 -38.08 85.74 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.436 -0.79 . . . . 0.0 109.397 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.527 ' OG ' ' N ' ' A' ' 53' ' ' LYS . 15.0 t -58.09 -161.36 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.371 -0.831 . . . . 0.0 108.984 179.807 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.527 ' N ' ' OG ' ' A' ' 52' ' ' SER . 36.1 ttpt -121.83 102.01 7.93 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.263 -0.898 . . . . 0.0 109.252 179.393 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 74.5 t -129.33 117.81 44.14 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.409 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.6 ' O ' HD12 ' A' ' 55' ' ' ILE . 1.0 OUTLIER -127.28 132.0 69.99 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 O-C-N 121.431 -0.793 . . . . 0.0 109.077 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 69.4 p -129.22 114.9 16.85 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.381 -0.824 . . . . 0.0 109.185 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.584 ' H ' ' HB ' ' A' ' 69' ' ' THR . 9.1 ttmm -127.19 113.99 17.08 Favored 'General case' 0 N--CA 1.52 3.056 0 N-CA-C 109.3 -0.629 . . . . 0.0 109.3 178.671 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 33.7 p -119.76 132.06 55.53 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.494 -0.754 . . . . 0.0 109.429 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.5 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.8 m -132.54 120.25 41.63 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.177 0 O-C-N 121.383 -0.823 . . . . 0.0 109.534 179.133 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 35.9 p -109.77 133.01 53.62 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.781 -0.574 . . . . 0.0 109.523 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -136.3 170.23 16.37 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.263 -0.898 . . . . 0.0 109.674 179.74 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.42 -40.78 98.1 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.88 -1.138 . . . . 0.0 112.766 -177.275 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.425 ' OD1' ' N ' ' A' ' 63' ' ' ASP . 18.6 p-10 -68.54 5.24 1.09 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.38 -1.45 . . . . 0.0 110.065 -178.305 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.528 ' O ' ' N ' ' A' ' 66' ' ' THR . . . 90.51 8.9 65.38 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.978 -1.249 . . . . 0.0 109.978 179.098 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 36.4 ttp180 -65.21 78.77 0.05 Allowed 'General case' 0 N--CA 1.486 1.343 0 O-C-N 120.689 -1.477 . . . . 0.0 107.915 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.528 ' N ' ' O ' ' A' ' 64' ' ' GLY . 70.3 p -110.03 77.65 1.07 Allowed 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 -179.356 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.0 tm-20 -92.78 119.81 32.52 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.418 -0.801 . . . . 0.0 109.214 -179.28 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 12.7 p -99.31 109.71 22.31 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.353 -0.842 . . . . 0.0 109.677 -179.531 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.584 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 4.2 m -97.02 25.41 5.41 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 107.173 -1.418 . . . . 0.0 107.173 178.561 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -65.76 70.13 0.05 Allowed 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 179.143 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.504 ' N ' ' O ' ' A' ' 69' ' ' THR . 81.2 mt-10 -110.13 155.04 22.46 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.538 -0.726 . . . . 0.0 110.043 -179.052 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.418 ' O ' HG23 ' A' ' 72' ' ' VAL . 21.9 m -127.78 134.85 64.54 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 179.251 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 16.4 t -128.91 116.32 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 CA-C-O 121.996 0.903 . . . . 0.0 109.382 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.4 ptmm? . . . . . 0 C--N 1.289 -2.023 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 179.852 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.467 ' N ' ' CD ' ' A' ' 49' ' ' ARG . 11.1 mpt_? . . . . . 0 N--CA 1.493 1.686 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.413 ' O ' ' O ' ' A' ' 51' ' ' CYS . 98.6 p -58.24 -62.48 1.8 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.292 -0.88 . . . . 0.0 109.663 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.415 ' SG ' ' N ' ' A' ' 52' ' ' SER . 36.8 t -50.81 -97.14 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.213 -0.929 . . . . 0.0 109.703 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.415 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 30.8 t -51.1 150.12 3.36 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.294 -0.879 . . . . 0.0 109.721 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -85.2 105.01 15.59 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.28 -0.888 . . . . 0.0 109.106 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 99.4 t -126.55 119.68 54.3 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.517 -0.739 . . . . 0.0 110.021 -179.46 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.453 HG23 ' O ' ' A' ' 55' ' ' ILE . 19.3 tt -127.13 128.74 70.73 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 179.204 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 48.7 p -130.42 120.71 24.64 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.247 -0.908 . . . . 0.0 110.357 -179.013 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.481 ' H ' ' HB ' ' A' ' 69' ' ' THR . 9.6 mttp -121.04 111.34 17.34 Favored 'General case' 0 N--CA 1.509 2.506 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 177.947 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 52.0 p -119.26 139.43 51.9 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.377 -0.827 . . . . 0.0 109.498 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.8 m -132.48 121.12 44.74 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 O-C-N 121.542 -0.724 . . . . 0.0 109.184 178.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -109.49 135.55 50.32 Favored 'General case' 0 N--CA 1.497 1.909 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 179.607 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.423 ' OD1' ' N ' ' A' ' 62' ' ' ALA . 30.6 t-20 -153.11 153.49 32.92 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 120.661 -1.274 . . . . 0.0 109.536 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.423 ' N ' ' OD1' ' A' ' 61' ' ' ASN . . . -74.36 -11.9 60.38 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 120.498 -1.376 . . . . 0.0 112.091 -178.556 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 11.7 p30 -74.32 2.19 9.87 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.043 -1.036 . . . . 0.0 109.743 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.78 11.16 62.24 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 36.9 ttm180 -96.08 99.09 10.88 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.011 -1.288 . . . . 0.0 109.123 179.734 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 68.4 p -125.8 83.4 2.16 Favored 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -94.99 129.76 41.92 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.348 -0.845 . . . . 0.0 111.065 -178.327 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.1 p -108.45 112.43 24.83 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 179.022 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.522 ' O ' ' N ' ' A' ' 71' ' ' GLU . 3.6 m -106.47 31.06 5.47 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 179.106 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.9 mttm -64.13 70.79 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 119.808 -0.757 . . . . 0.0 109.388 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.522 ' N ' ' O ' ' A' ' 69' ' ' THR . 51.7 mt-10 -89.55 140.18 29.8 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.242 -0.911 . . . . 0.0 109.274 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.409 ' O ' HG23 ' A' ' 72' ' ' VAL . 23.6 m -127.39 136.31 60.94 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 17.2 t -128.2 117.38 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.976 0 CA-C-O 122.186 0.993 . . . . 0.0 109.122 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 94.1 mttt . . . . . 0 C--N 1.291 -1.949 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.561 -179.963 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 11.3 tpp180 . . . . . 0 N--CA 1.497 1.885 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 89.3 p -60.28 -166.33 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.162 -0.961 . . . . 0.0 109.171 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 4.4 t 48.87 -125.67 1.99 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.104 -0.997 . . . . 0.0 109.048 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 25.0 t -50.18 132.08 23.75 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.802 -1.186 . . . . 0.0 109.059 179.517 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.443 ' O ' ' O ' ' A' ' 73' ' ' VAL . 59.3 tttm -76.9 105.3 7.88 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.86 -1.15 . . . . 0.0 109.558 -179.489 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 47.5 t -123.88 116.08 46.98 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 O-C-N 121.484 -0.76 . . . . 0.0 109.454 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 43.7 mm -122.91 115.97 47.39 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.628 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 75.4 p -128.6 111.6 13.39 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.328 -0.858 . . . . 0.0 109.243 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.498 ' N ' ' OG1' ' A' ' 69' ' ' THR . 7.3 mtmt -124.67 113.46 18.03 Favored 'General case' 0 N--CA 1.515 2.775 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.793 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 58.9 p -119.4 131.84 55.73 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.549 -0.719 . . . . 0.0 109.117 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.406 ' CG2' ' OE1' ' A' ' 67' ' ' GLU . 2.8 m -133.47 126.79 52.58 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.2 0 O-C-N 121.476 -0.765 . . . . 0.0 109.605 179.421 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' THR . . . . . 0.404 HG23 ' O ' ' A' ' 60' ' ' THR . 8.6 t -108.13 134.16 51.39 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.429 -0.795 . . . . 0.0 109.34 179.753 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -125.89 162.02 26.13 Favored 'General case' 0 N--CA 1.516 2.875 0 O-C-N 121.503 -0.748 . . . . 0.0 109.304 179.802 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.05 -36.4 66.88 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.648 -1.283 . . . . 0.0 111.895 -178.238 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -72.83 7.05 2.17 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.571 -1.33 . . . . 0.0 109.874 -179.053 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.19 7.49 83.1 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.334 -1.506 . . . . 0.0 109.334 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 18.0 tpt180 -82.8 109.32 16.84 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 120.949 -1.324 . . . . 0.0 107.818 178.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.9 p -140.42 151.42 44.9 Favored 'General case' 0 C--N 1.306 -1.301 0 O-C-N 121.217 -0.927 . . . . 0.0 108.678 -178.616 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.406 ' OE1' ' CG2' ' A' ' 59' ' ' VAL . 24.4 mp0 -131.43 117.43 18.84 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 179.428 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.8 p -100.89 105.97 17.28 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.189 -0.944 . . . . 0.0 110.16 -179.24 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.504 ' O ' ' N ' ' A' ' 71' ' ' GLU . 78.3 p -109.82 30.51 6.62 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 178.626 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.0 ptpt -66.74 66.0 0.06 Allowed 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 179.663 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.504 ' N ' ' O ' ' A' ' 69' ' ' THR . 63.2 mm-40 -108.17 151.59 25.71 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.425 -0.797 . . . . 0.0 110.147 -179.152 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.413 ' O ' HG23 ' A' ' 72' ' ' VAL . 12.7 m -127.97 135.11 63.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 179.368 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.443 ' O ' ' O ' ' A' ' 53' ' ' LYS . 16.4 t -129.34 115.64 36.22 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 CA-C-O 122.235 1.017 . . . . 0.0 109.625 179.662 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 45.5 mttp . . . . . 0 C--N 1.289 -2.027 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.428 179.806 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.4 mmt180 . . . . . 0 N--CA 1.5 2.059 0 CA-C-O 121.337 0.589 . . . . 0.0 109.839 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.464 ' O ' ' O ' ' A' ' 51' ' ' CYS . 18.7 m -71.53 -61.22 1.86 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.2 -0.937 . . . . 0.0 110.52 -179.444 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.587 ' SG ' ' N ' ' A' ' 52' ' ' SER . 32.5 t -56.23 -108.74 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.194 -0.942 . . . . 0.0 109.526 -179.542 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.587 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 62.0 m -52.57 113.91 1.21 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 120.944 -1.097 . . . . 0.0 108.2 179.35 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.436 ' O ' ' O ' ' A' ' 73' ' ' VAL . 18.0 tptm -74.2 100.83 3.79 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.75 -1.219 . . . . 0.0 109.553 -178.602 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.62 HG13 ' O ' ' A' ' 54' ' ' VAL . 8.3 p -128.55 116.12 40.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 179.421 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.599 ' O ' HD12 ' A' ' 55' ' ' ILE . 1.0 OUTLIER -127.97 130.87 69.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 179.841 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 16.6 m -128.56 111.96 13.8 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.378 -0.826 . . . . 0.0 108.896 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.532 ' H ' ' HB ' ' A' ' 69' ' ' THR . 14.9 mttm -124.19 113.37 18.22 Favored 'General case' 0 N--CA 1.511 2.583 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 178.623 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 71.6 p -113.04 134.73 54.39 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.49 -0.756 . . . . 0.0 109.742 -179.492 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.422 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.8 m -131.49 123.98 53.67 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.047 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 178.828 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 42.4 p -107.2 120.39 41.98 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.683 -0.635 . . . . 0.0 110.252 -179.026 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.461 ' OD1' ' N ' ' A' ' 61' ' ' ASN . 1.2 m-20 -107.62 143.97 35.33 Favored 'General case' 0 N--CA 1.51 2.544 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 179.209 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.434 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -69.51 -28.95 66.48 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 119.976 -1.702 . . . . 0.0 112.331 -177.645 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.456 ' OD1' ' N ' ' A' ' 63' ' ' ASP . 0.6 OUTLIER -67.36 4.19 1.06 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.527 -1.358 . . . . 0.0 109.75 -178.969 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.434 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 96.52 6.16 58.64 Favored Glycine 0 N--CA 1.497 2.706 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 178.997 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -92.39 110.49 21.89 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.725 -1.456 . . . . 0.0 107.857 179.022 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 23.8 p -135.16 102.92 5.35 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.418 -0.801 . . . . 0.0 109.32 -179.307 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -96.91 128.64 44.07 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.21 -0.931 . . . . 0.0 110.185 -179.144 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.525 ' OG1' ' NZ ' ' A' ' 70' ' ' LYS . 40.0 p -106.36 108.96 20.74 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.532 -0.73 . . . . 0.0 109.489 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.532 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 5.6 m -88.43 33.14 0.75 Allowed 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 179.005 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.525 ' NZ ' ' OG1' ' A' ' 68' ' ' THR . 21.0 pttm -66.14 60.99 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.286 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.499 ' N ' ' O ' ' A' ' 69' ' ' THR . 86.9 mt-10 -96.13 141.93 28.92 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 120.968 -1.083 . . . . 0.0 110.079 -179.37 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.561 ' O ' HG23 ' A' ' 72' ' ' VAL . 5.9 m -129.16 122.39 56.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 179.115 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.436 ' O ' ' O ' ' A' ' 53' ' ' LYS . 20.6 t -128.96 115.44 36.58 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.996 0 CA-C-O 122.323 1.058 . . . . 0.0 109.47 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 66.4 tttm . . . . . 0 C--N 1.287 -2.129 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.433 179.996 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 . . . . . 0 N--CA 1.499 2.024 0 CA-C-O 121.281 0.562 . . . . 0.0 109.754 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 68.7 m -66.16 -100.08 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.186 -0.946 . . . . 0.0 109.243 179.744 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 15.3 t -49.63 135.17 19.05 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.1 -1.0 . . . . 0.0 108.826 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.418 ' O ' ' OG ' ' A' ' 52' ' ' SER . 53.0 p 50.43 87.47 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.991 -1.068 . . . . 0.0 108.542 -179.158 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -75.48 104.05 5.87 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.228 -0.92 . . . . 0.0 109.824 -178.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.577 ' C ' HD12 ' A' ' 55' ' ' ILE . 7.1 p -111.43 114.08 46.07 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 O-C-N 121.526 -0.734 . . . . 0.0 109.569 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.602 ' N ' HD12 ' A' ' 55' ' ' ILE . 1.7 mp -107.82 119.93 58.28 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 179.209 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 5.9 m -129.8 113.9 15.26 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.495 -0.753 . . . . 0.0 109.684 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.521 ' N ' ' OG1' ' A' ' 69' ' ' THR . 21.2 mttt -121.99 112.48 18.33 Favored 'General case' 0 N--CA 1.509 2.519 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 178.175 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 44.1 p -118.8 134.76 54.92 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.445 -0.784 . . . . 0.0 109.754 -179.247 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.3 m -132.17 119.69 41.03 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 178.708 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 42.7 p -110.93 136.54 49.79 Favored 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.523 ' OD1' ' N ' ' A' ' 62' ' ' ALA . 16.5 t30 -161.59 153.37 19.17 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 120.641 -1.287 . . . . 0.0 109.84 179.331 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.523 ' N ' ' OD1' ' A' ' 61' ' ' ASN . . . -74.3 -8.95 58.01 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.707 -1.246 . . . . 0.0 110.536 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.412 ' HB2' HD21 ' A' ' 61' ' ' ASN . 29.2 t70 -72.95 -1.87 18.69 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.309 -0.869 . . . . 0.0 109.851 -179.732 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 95.67 9.48 57.51 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 108.891 -1.684 . . . . 0.0 108.891 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 47.7 mtp180 -99.82 89.21 4.01 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.196 -1.179 . . . . 0.0 108.404 179.324 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.8 m -125.28 72.76 1.26 Allowed 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 73.8 mt-10 -100.87 131.82 46.57 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.454 -0.779 . . . . 0.0 111.727 -177.716 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.6 m -108.19 112.39 24.87 Favored 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 178.315 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.521 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 22.4 p -104.25 37.85 2.0 Allowed 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 179.369 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.4 pttm -65.46 61.73 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.676 -0.64 . . . . 0.0 109.463 179.223 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.506 ' N ' ' O ' ' A' ' 69' ' ' THR . 55.9 mt-10 -82.09 147.56 29.03 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.064 -1.022 . . . . 0.0 109.821 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.426 ' O ' HG23 ' A' ' 72' ' ' VAL . 22.9 m -127.81 134.94 64.31 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.584 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 14.7 t -128.69 118.03 46.24 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 CA-C-O 122.217 1.008 . . . . 0.0 109.264 179.521 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 44.9 mtmt . . . . . 0 C--N 1.29 -2.007 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.512 -179.955 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 . . . . . 0 N--CA 1.497 1.879 0 CA-C-O 121.281 0.562 . . . . 0.0 109.818 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.4 m -64.54 176.75 1.03 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.215 -0.928 . . . . 0.0 109.507 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.425 ' O ' ' N ' ' A' ' 53' ' ' LYS . 64.6 m 46.84 -122.77 1.31 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.206 -0.934 . . . . 0.0 108.997 -179.724 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 43.5 t -51.87 99.81 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 178.772 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.425 ' N ' ' O ' ' A' ' 51' ' ' CYS . 93.7 mttt -77.87 101.43 6.79 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.11 -0.994 . . . . 0.0 110.318 -178.612 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.3 t -106.72 114.13 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.029 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.498 HG23 ' O ' ' A' ' 55' ' ' ILE . 9.4 tp -127.99 126.98 67.41 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.481 -0.762 . . . . 0.0 108.998 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.474 ' O ' ' CG2' ' A' ' 56' ' ' THR . 0.8 OUTLIER -128.88 117.91 21.81 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.515 -0.741 . . . . 0.0 109.341 179.839 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.513 ' H ' ' HB ' ' A' ' 69' ' ' THR . 26.5 ttmt -127.08 114.53 17.88 Favored 'General case' 0 N--CA 1.521 3.102 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 178.568 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.5 m -115.66 131.42 56.94 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.624 -0.673 . . . . 0.0 109.86 -179.595 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.494 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.9 m -132.12 119.86 41.78 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.141 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.813 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 43.8 p -110.17 134.0 52.65 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -179.858 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -137.36 172.83 12.4 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.311 -0.868 . . . . 0.0 109.752 179.601 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.27 -40.33 95.75 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 120.807 -1.183 . . . . 0.0 112.566 -177.291 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.486 ' OD1' ' N ' ' A' ' 63' ' ' ASP . 2.0 m-20 -69.01 4.37 1.58 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.378 -1.451 . . . . 0.0 110.04 -178.437 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.527 ' O ' ' N ' ' A' ' 66' ' ' THR . . . 91.82 8.92 63.13 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 110.041 -1.224 . . . . 0.0 110.041 179.308 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.441 ' O ' ' O ' ' A' ' 59' ' ' VAL . 23.6 ttm180 -63.94 79.5 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.43 0 O-C-N 120.717 -1.461 . . . . 0.0 108.193 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.527 ' N ' ' O ' ' A' ' 64' ' ' GLY . 73.3 p -111.56 72.58 0.78 Allowed 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 -179.716 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -94.27 130.66 40.45 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.369 -0.832 . . . . 0.0 109.936 -178.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.41 ' C ' ' H ' ' A' ' 70' ' ' LYS . 4.0 m -108.55 109.53 20.79 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.49 -0.756 . . . . 0.0 109.656 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.528 ' O ' ' N ' ' A' ' 71' ' ' GLU . 3.8 m -82.29 39.63 0.6 Allowed 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.087 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.41 ' H ' ' C ' ' A' ' 68' ' ' THR . 13.3 ptpt -65.71 55.27 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.073 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.528 ' N ' ' O ' ' A' ' 69' ' ' THR . 54.2 mt-10 -89.28 131.97 35.12 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.091 -1.005 . . . . 0.0 109.983 -179.441 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.4 p -128.3 136.81 59.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 17.5 t -127.95 117.29 45.61 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 CA-C-O 122.012 0.911 . . . . 0.0 109.283 179.646 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt . . . . . 0 C--N 1.292 -1.916 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 -179.884 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 mmt . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 121.304 0.574 . . . . 0.0 109.49 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 65.69 118.17 0.01 OUTLIER Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.481 -1.448 . . . . 0.0 109.481 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.448 ' O ' ' N ' ' A' ' 5' ' ' ARG . 62.0 p -76.16 -36.51 58.7 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.285 -1.126 . . . . 0.0 109.424 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 50.93 -94.49 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.2 -0.937 . . . . 0.0 109.595 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.586 ' CG ' HH11 ' A' ' 5' ' ' ARG . 3.7 mtt-85 -149.69 19.62 0.91 Allowed 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.3 -0.875 . . . . 0.0 109.364 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.428 ' OE2' ' N ' ' A' ' 7' ' ' GLU . 3.4 tm-20 -61.55 132.7 54.18 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.316 -0.865 . . . . 0.0 109.248 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.428 ' N ' ' OE2' ' A' ' 6' ' ' GLU . 36.4 mt-10 -152.87 -25.34 0.16 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.253 -0.905 . . . . 0.0 109.382 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -178.85 -58.0 0.07 OUTLIER Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.505 ' O ' ' N ' ' A' ' 11' ' ' SER . 47.2 t -169.81 57.03 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.291 -1.123 . . . . 0.0 109.506 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.408 HG22 ' H ' ' A' ' 10' ' ' VAL . 4.3 m -65.17 69.47 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.271 -0.893 . . . . 0.0 109.525 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.505 ' N ' ' O ' ' A' ' 9' ' ' SER . 90.2 p -159.25 -161.37 0.93 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.352 -0.842 . . . . 0.0 109.414 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.5 m -159.53 154.94 25.54 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.216 -0.927 . . . . 0.0 109.515 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 64.75 148.81 0.05 OUTLIER Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 73.4 p -53.94 -21.74 8.64 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.216 -1.167 . . . . 0.0 109.381 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 19.1 tptp -167.82 124.08 1.08 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.26 -0.9 . . . . 0.0 109.382 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -59.6 112.51 1.82 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.254 -0.904 . . . . 0.0 109.444 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.519 ' O ' ' CG ' ' A' ' 18' ' ' PHE . 84.3 mt-10 -70.69 -38.93 73.76 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.325 -0.859 . . . . 0.0 109.477 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.519 ' CG ' ' O ' ' A' ' 17' ' ' GLU . 90.0 m-85 -157.27 47.88 0.42 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.283 -0.886 . . . . 0.0 109.426 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 13.7 m170 53.82 177.69 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.212 -0.93 . . . . 0.0 109.451 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.6 t -54.53 161.53 1.42 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.238 -0.914 . . . . 0.0 109.403 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -174.15 27.62 0.08 OUTLIER Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 18.2 tptm -163.26 127.81 2.96 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.245 -1.15 . . . . 0.0 109.453 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 18.4 mt -86.68 -62.82 1.42 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.248 -0.908 . . . . 0.0 109.581 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.2 t -109.81 119.07 58.25 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.483 -0.76 . . . . 0.0 109.449 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 78.1 p -84.24 -24.32 30.04 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.222 -0.924 . . . . 0.0 109.491 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.447 ' OG1' ' N ' ' A' ' 27' ' ' LYS . 63.4 p -63.32 -100.13 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.236 -0.915 . . . . 0.0 109.521 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.447 ' N ' ' OG1' ' A' ' 26' ' ' THR . 15.7 ptpt -55.64 168.57 0.4 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.295 -0.878 . . . . 0.0 109.515 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 160.96 1.92 0.06 OUTLIER Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.446 -1.461 . . . . 0.0 109.446 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.468 ' N ' ' OD1' ' A' ' 29' ' ' ASP . 25.9 p-10 -63.06 131.16 47.66 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.216 -1.167 . . . . 0.0 109.379 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -153.11 6.8 0.38 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.2 -0.937 . . . . 0.0 109.293 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -172.85 4.38 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.333 -0.854 . . . . 0.0 109.417 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.504 HD23 ' O ' ' A' ' 32' ' ' LEU . 0.8 OUTLIER -69.25 -14.14 62.79 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.261 -0.9 . . . . 0.0 108.951 -179.921 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 14.6 mt -68.58 6.63 0.78 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.172 -0.955 . . . . 0.0 109.442 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.447 ' H ' ' C ' ' A' ' 32' ' ' LEU . 17.1 tt -48.39 153.5 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.193 -0.942 . . . . 0.0 109.563 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.97 120.37 11.25 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.256 -0.903 . . . . 0.0 109.475 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -78.59 -52.2 8.81 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.274 -0.891 . . . . 0.0 109.515 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.632 ' CD ' ' H ' ' A' ' 37' ' ' GLU . 1.5 pm0 -62.02 -27.46 68.89 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.281 -0.887 . . . . 0.0 109.542 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.409 ' O ' ' O ' ' A' ' 37' ' ' GLU . 68.1 mttm 53.23 174.28 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.307 -0.87 . . . . 0.0 109.514 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.427 HG22 ' H ' ' A' ' 39' ' ' VAL . 2.9 m -74.45 79.12 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.259 -0.9 . . . . 0.0 109.555 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 4.5 m -160.77 -126.52 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.222 -0.924 . . . . 0.0 109.315 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 37.3 t -56.07 128.07 33.63 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.178 -0.951 . . . . 0.0 109.47 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.512 ' O ' ' CG ' ' A' ' 43' ' ' HIS . . . -179.35 94.15 0.09 OUTLIER Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.512 ' CG ' ' O ' ' A' ' 42' ' ' GLY . 78.2 m80 -157.76 167.27 30.51 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.357 -1.084 . . . . 0.0 109.376 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 67.5 p -84.29 154.48 22.93 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.109 -0.994 . . . . 0.0 109.438 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 79.2 p -147.34 -45.43 0.17 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.188 -0.945 . . . . 0.0 109.397 -179.676 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.8 p -65.8 -34.18 77.58 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.337 -0.852 . . . . 0.0 109.429 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 31.9 m -72.49 -57.52 4.1 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.307 -0.871 . . . . 0.0 109.445 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 32.5 ptt180 -145.84 143.46 29.65 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.248 -0.907 . . . . 0.0 109.364 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.58 ' CG ' HH11 ' A' ' 49' ' ' ARG . 0.3 OUTLIER -94.08 127.48 39.91 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.288 -0.882 . . . . 0.0 109.585 180.0 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.438 ' O ' ' O ' ' A' ' 49' ' ' ARG . 95.9 p -59.82 -150.69 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.341 -0.85 . . . . 0.0 109.621 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.57 ' SG ' ' N ' ' A' ' 52' ' ' SER . 10.3 t 50.84 -100.69 0.09 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.076 -1.015 . . . . 0.0 109.15 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.57 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 16.3 t -71.81 -165.35 0.16 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.223 -0.923 . . . . 0.0 108.967 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.516 ' N ' ' OG ' ' A' ' 52' ' ' SER . 19.4 tptm -120.87 106.17 11.39 Favored 'General case' 0 N--CA 1.498 1.969 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 9.9 t -125.99 117.82 49.99 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.522 -0.736 . . . . 0.0 109.541 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.478 HG23 ' O ' ' A' ' 55' ' ' ILE . 12.1 tt -122.77 119.64 58.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.488 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 71.1 p -131.61 113.46 13.64 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.536 -0.728 . . . . 0.0 109.157 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.551 ' N ' ' OG1' ' A' ' 69' ' ' THR . 11.9 mtpt -121.85 112.73 18.71 Favored 'General case' 0 N--CA 1.513 2.697 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 178.781 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 81.8 p -119.07 128.7 54.58 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.575 -0.703 . . . . 0.0 109.613 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.415 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.7 m -131.63 126.1 57.12 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 178.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.57 133.98 52.81 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.721 -0.612 . . . . 0.0 109.635 -179.781 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -123.42 162.45 22.78 Favored 'General case' 0 N--CA 1.518 2.944 0 O-C-N 121.186 -0.946 . . . . 0.0 109.229 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.46 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -67.22 -41.12 86.27 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.622 -1.299 . . . . 0.0 112.635 -177.383 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.508 ' N ' ' OD1' ' A' ' 63' ' ' ASP . 18.8 p-10 -68.17 8.55 0.42 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.351 -1.468 . . . . 0.0 110.201 -177.568 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.46 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 85.55 9.25 79.14 Favored Glycine 0 N--CA 1.493 2.446 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 179.218 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -83.49 100.65 10.89 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 120.912 -1.346 . . . . 0.0 107.435 178.494 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.4 p -131.68 113.29 13.4 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.469 -0.77 . . . . 0.0 110.068 -178.47 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -94.64 120.53 35.02 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.437 -0.79 . . . . 0.0 109.79 -179.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.4 p -101.36 110.58 22.61 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.396 -0.815 . . . . 0.0 109.248 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.551 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 28.0 p -111.21 29.4 7.83 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 179.02 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.4 ptmt -65.44 67.48 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.463 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 69' ' ' THR . 72.0 mm-40 -101.63 156.83 17.25 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.335 -0.853 . . . . 0.0 109.989 -179.249 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.434 ' O ' HG13 ' A' ' 72' ' ' VAL . 7.5 p -128.35 129.78 69.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 179.251 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.444 ' O ' ' O ' ' A' ' 53' ' ' LYS . 96.8 t -113.75 132.18 63.45 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 CA-C-O 122.279 1.037 . . . . 0.0 109.352 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.5 mmmt -56.4 -175.47 0.01 OUTLIER 'General case' 0 C--N 1.291 -1.966 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 85.6 p -52.94 163.68 0.47 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.128 -0.982 . . . . 0.0 109.533 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -86.4 -45.51 11.11 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.263 -0.898 . . . . 0.0 109.11 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 54.4 m-20 -156.63 22.41 0.34 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.295 -0.878 . . . . 0.0 109.162 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 63.72 45.03 95.43 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.422 -1.471 . . . . 0.0 109.422 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 49.0 m -67.37 -46.23 73.95 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.318 -1.107 . . . . 0.0 109.512 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 42.5 m-20 -157.87 36.84 0.26 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.233 -0.917 . . . . 0.0 109.399 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.454 ' C ' ' H ' ' A' ' 83' ' ' ASP . 98.5 m -150.16 -71.1 0.18 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.247 -0.908 . . . . 0.0 109.388 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.05 39.43 0.81 Allowed Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.521 -1.431 . . . . 0.0 109.521 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.454 ' H ' ' C ' ' A' ' 81' ' ' CYS . 29.5 m-20 -69.33 177.19 2.93 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.289 -1.124 . . . . 0.0 109.425 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . 53.38 70.83 0.55 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.225 -0.922 . . . . 0.0 109.481 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.527 ' O ' ' N ' ' A' ' 87' ' ' ASP . 25.4 t0 -168.18 -57.17 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.208 -0.932 . . . . 0.0 109.533 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 52.0 -88.58 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.248 -0.908 . . . . 0.0 109.508 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.527 ' N ' ' O ' ' A' ' 85' ' ' ASP . 8.7 p-10 -154.09 145.23 22.83 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.206 -0.934 . . . . 0.0 109.41 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 37.7 p90 -69.0 143.68 54.3 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.329 -0.857 . . . . 0.0 109.487 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -168.95 -33.69 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.246 -0.908 . . . . 0.0 109.347 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.433 ' ND1' ' N ' ' A' ' 90' ' ' HIS . 2.1 m-70 53.03 179.35 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.334 -0.854 . . . . 0.0 109.59 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 35.5 m -161.83 138.48 8.2 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.348 -0.845 . . . . 0.0 109.205 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -69.0 149.6 97.8 Favored Pre-proline 0 N--CA 1.489 1.483 0 O-C-N 121.11 -0.994 . . . . 0.0 108.96 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -58.03 -70.23 0.04 OUTLIER 'Trans proline' 0 C--N 1.324 -0.758 0 C-N-CA 120.941 1.094 . . . . 0.0 109.762 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 14.7 t -171.54 101.82 0.19 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.292 -0.88 . . . . 0.0 109.429 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 65.1 mtm180 -65.54 176.76 1.36 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.184 -0.948 . . . . 0.0 109.559 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -69.65 -123.03 0.04 OUTLIER Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.534 ' ND2' ' H ' ' A' ' 98' ' ' LEU . 5.4 p-10 -173.6 -63.57 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.273 -1.134 . . . . 0.0 109.431 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.534 ' H ' ' ND2' ' A' ' 97' ' ' ASN . 3.9 tp 58.58 -150.79 0.43 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.278 -0.889 . . . . 0.0 109.192 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -84.93 -179.55 7.1 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.141 -0.974 . . . . 0.0 109.361 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -68.15 145.24 54.54 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.164 -0.96 . . . . 0.0 109.47 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -71.5 -31.02 66.63 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.336 -0.853 . . . . 0.0 109.434 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 82.9 t80 -167.28 -19.74 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.234 -0.916 . . . . 0.0 109.457 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.409 ' O ' ' ND1' ' A' ' 103' ' ' HIS . 5.5 t-80 -57.79 -34.69 69.87 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.276 -0.89 . . . . 0.0 109.445 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.531 HH21 ' CG ' ' A' ' 108' ' ' ASP . 15.5 tpt180 54.85 66.24 1.29 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.312 -0.867 . . . . 0.0 109.432 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.407 ' O ' ' O ' ' A' ' 104' ' ' ARG . 19.4 t70 -51.23 -95.77 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.331 -0.856 . . . . 0.0 109.437 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 65.6 tttm -73.86 117.18 15.34 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.264 -0.897 . . . . 0.0 109.398 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.489 ' CG ' ' H ' ' A' ' 108' ' ' ASP . 29.7 t70 -72.21 -171.24 0.72 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.294 -0.879 . . . . 0.0 109.352 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.531 ' CG ' HH21 ' A' ' 104' ' ' ARG . 30.7 p-10 -158.93 156.9 30.35 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.244 -0.91 . . . . 0.0 109.335 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -69.58 -37.28 76.89 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.208 -0.932 . . . . 0.0 109.518 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 53.8 m-85 -64.71 94.1 0.12 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.217 -0.927 . . . . 0.0 109.535 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 68.4 p -75.41 -160.04 0.11 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.28 -0.887 . . . . 0.0 109.467 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.591 ' CG ' HH11 ' A' ' 112' ' ' ARG . 3.9 mtt-85 -73.22 132.76 43.57 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.242 -0.911 . . . . 0.0 109.484 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 49.9 m -75.32 69.31 2.12 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.33 -0.856 . . . . 0.0 109.545 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 44.2 t -73.77 116.24 14.14 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.29 -0.881 . . . . 0.0 109.525 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -72.44 46.66 0.15 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.189 -0.944 . . . . 0.0 109.483 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -65.62 -148.96 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.275 -0.891 . . . . 0.0 109.338 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -151.11 70.51 0.98 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.205 -0.935 . . . . 0.0 109.257 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -73.14 4.98 3.79 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.336 -0.852 . . . . 0.0 109.448 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -62.25 157.34 36.55 Favored Glycine 0 N--CA 1.489 2.228 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.3 ptp180 -168.86 -18.13 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.289 -1.124 . . . . 0.0 109.655 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 56.3 m -73.4 150.04 42.03 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.127 -0.983 . . . . 0.0 109.337 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -163.93 64.56 0.24 Allowed Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.898 -1.281 . . . . 0.0 109.898 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.55 ' N ' HD12 ' A' ' 123' ' ' LEU . 10.5 mp -52.24 136.46 30.43 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.213 -1.169 . . . . 0.0 108.946 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.51 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -89.15 161.91 39.08 Favored Pre-proline 0 N--CA 1.494 1.753 0 O-C-N 121.335 -0.853 . . . . 0.0 108.958 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.51 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 1.4 Cg_endo -58.15 -50.72 9.25 Favored 'Trans proline' 0 C--N 1.32 -0.947 0 C-N-CA 121.238 1.292 . . . . 0.0 109.561 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 61.9 tt0 -165.51 134.13 3.22 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.302 -0.874 . . . . 0.0 109.358 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -59.83 97.99 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.248 -0.907 . . . . 0.0 109.522 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -78.97 84.47 4.98 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.234 -0.916 . . . . 0.0 109.467 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -167.39 -88.18 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.202 -0.936 . . . . 0.0 109.509 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.556 ' N ' HD12 ' A' ' 130' ' ' LEU . 8.9 mp -60.72 -70.62 0.17 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.34 -0.85 . . . . 0.0 109.286 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' GLY . . . . . 0.425 ' C ' ' H ' ' A' ' 133' ' ' SER . . . 68.84 24.04 75.68 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.466 -1.454 . . . . 0.0 109.466 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -65.22 0.91 1.18 Allowed 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.272 -1.134 . . . . 0.0 109.432 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' SER . . . . . 0.425 ' H ' ' C ' ' A' ' 131' ' ' GLY . 95.3 p -62.68 -145.86 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.282 -0.886 . . . . 0.0 109.445 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 72.49 -101.44 1.07 Allowed Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 30.3 t -169.55 46.16 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.203 -1.175 . . . . 0.0 109.504 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.403 ' O ' ' OG ' ' A' ' 137' ' ' SER . 25.1 p 52.21 60.71 3.63 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.249 -0.907 . . . . 0.0 109.47 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' SER . . . . . 0.403 ' OG ' ' O ' ' A' ' 136' ' ' SER . 69.6 m -166.88 138.83 3.43 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.223 -0.923 . . . . 0.0 109.387 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 67.5 m -166.39 -20.12 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.255 -0.903 . . . . 0.0 109.475 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -65.09 -25.5 67.82 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.22 -0.925 . . . . 0.0 109.465 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' THR . . . . . 0.443 ' O ' HG23 ' A' ' 140' ' ' THR . 7.2 t -64.13 127.38 31.2 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.254 -0.904 . . . . 0.0 109.52 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 11.6 p -175.34 -94.1 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.17 -0.957 . . . . 0.0 109.431 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 47.7 m -74.75 -15.35 60.77 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.291 -0.881 . . . . 0.0 109.376 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 26.8 m80 52.89 58.99 4.78 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.294 -0.879 . . . . 0.0 109.5 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' SER . . . . . 0.462 ' C ' ' H ' ' A' ' 146' ' ' GLN . 88.2 p -69.36 167.94 15.44 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.234 -0.916 . . . . 0.0 109.512 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 9.9 ptmm? -75.18 31.15 0.1 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.345 -0.847 . . . . 0.0 109.442 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' GLN . . . . . 0.462 ' H ' ' C ' ' A' ' 144' ' ' SER . 9.5 tp-100 -62.78 -39.5 94.4 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.155 -0.965 . . . . 0.0 109.457 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -64.04 124.13 20.81 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.233 -0.917 . . . . 0.0 109.41 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 34.2 t -72.12 141.93 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.3 -0.875 . . . . 0.0 109.452 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 42.5 t -167.66 96.56 0.46 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.177 -0.952 . . . . 0.0 109.42 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 82.9 p -171.37 -15.14 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.272 -0.892 . . . . 0.0 109.495 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 40.9 t -76.26 104.96 7.04 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.263 -0.898 . . . . 0.0 109.49 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -169.7 -37.24 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.23 -0.919 . . . . 0.0 109.53 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 153' ' ' THR . . . . . 0.401 ' C ' ' H ' ' A' ' 155' ' ' ASN . 60.3 p -50.72 -35.17 30.03 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.239 -0.913 . . . . 0.0 109.489 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 26.9 m -66.54 1.12 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.258 -0.901 . . . . 0.0 109.418 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 155' ' ' ASN . . . . . 0.401 ' H ' ' C ' ' A' ' 153' ' ' THR . 41.1 p-10 -62.02 -164.51 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.253 -0.904 . . . . 0.0 109.442 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 16.2 tpt180 -57.14 146.73 26.89 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.248 -0.907 . . . . 0.0 109.454 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -60.26 148.87 43.15 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -71.87 -5.36 61.15 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 159' ' ' SER . . . . . 0.401 ' OG ' ' N ' ' A' ' 160' ' ' ALA . 77.5 p -169.41 -85.35 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.264 -1.139 . . . . 0.0 109.454 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.401 ' N ' ' OG ' ' A' ' 159' ' ' SER . . . -169.42 154.19 5.59 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.271 -0.893 . . . . 0.0 109.471 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 16.4 tt -69.58 144.22 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.19 -0.944 . . . . 0.0 109.488 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 50.1 tt0 -168.6 90.4 0.26 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.204 -0.935 . . . . 0.0 109.484 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 45.5 t -66.08 103.79 1.03 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.278 -0.889 . . . . 0.0 109.47 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm -67.82 -76.82 0.08 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.298 -0.876 . . . . 0.0 109.299 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -68.1 -164.1 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.223 -0.923 . . . . 0.0 109.496 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 166' ' ' PHE . . . . . 0.442 ' CD1' ' O ' ' A' ' 166' ' ' PHE . 61.9 t80 . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 118.029 -0.986 . . . . 0.0 109.529 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.1 mmt . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -176.69 -121.84 0.69 Allowed Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.513 ' OG1' ' CE2' ' A' ' 4' ' ' PHE . 69.6 p -67.44 -168.14 0.08 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.304 -1.115 . . . . 0.0 109.501 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.513 ' CE2' ' OG1' ' A' ' 3' ' ' THR . 33.8 m-85 56.76 -144.42 0.66 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.34 -0.85 . . . . 0.0 109.453 -179.732 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -164.33 75.95 0.32 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.278 -0.889 . . . . 0.0 109.552 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 46.3 mm-40 -72.72 -24.73 61.03 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.256 -0.902 . . . . 0.0 109.366 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -71.43 94.69 1.28 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.233 -0.917 . . . . 0.0 109.532 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -68.62 -152.53 0.45 Allowed Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.8 m -59.95 120.83 10.39 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.306 -1.114 . . . . 0.0 109.478 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 95.1 t -67.89 -88.92 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.266 -0.896 . . . . 0.0 109.511 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 89.5 p -171.31 -154.83 0.1 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.246 -0.909 . . . . 0.0 109.421 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 28.4 t -171.98 -102.7 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.217 -0.927 . . . . 0.0 109.445 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 56.7 82.37 0.06 OUTLIER Glycine 0 N--CA 1.489 2.232 0 N-CA-C 109.629 -1.388 . . . . 0.0 109.629 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 16.7 p 48.54 -170.14 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.324 -1.103 . . . . 0.0 109.589 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 54.1 pttt -171.34 -29.24 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.315 -0.865 . . . . 0.0 109.444 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 57.78 8.66 0.73 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.328 -0.857 . . . . 0.0 109.226 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -59.58 -28.01 66.76 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.215 -0.928 . . . . 0.0 109.525 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -132.38 178.25 6.96 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.391 -0.818 . . . . 0.0 109.275 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 45.3 t-80 -164.74 -62.77 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.307 -0.871 . . . . 0.0 109.41 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 80.5 p -70.1 -37.55 75.4 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.298 -0.876 . . . . 0.0 109.518 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -62.71 162.02 30.91 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -69.91 -164.24 0.07 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.172 -1.193 . . . . 0.0 109.237 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.59 HD23 ' N ' ' A' ' 23' ' ' LEU . 0.6 OUTLIER -168.18 -165.96 0.66 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.217 -0.927 . . . . 0.0 109.557 179.973 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 30.5 t -54.42 -61.47 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.267 -0.895 . . . . 0.0 109.452 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 51.1 p -72.59 -144.39 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.239 -0.913 . . . . 0.0 109.511 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.8 t -170.67 40.74 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.196 -0.94 . . . . 0.0 109.427 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -71.17 -25.25 62.46 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.305 -0.872 . . . . 0.0 109.433 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 71.22 168.25 8.52 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.464 -1.454 . . . . 0.0 109.464 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -65.68 -89.21 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.278 -1.13 . . . . 0.0 109.446 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.48 ' C ' ' H ' ' A' ' 32' ' ' LEU . 15.8 pttp -170.54 77.0 0.08 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.201 -0.937 . . . . 0.0 109.501 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 58.83 3.03 0.28 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.236 -0.915 . . . . 0.0 109.323 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.48 ' H ' ' C ' ' A' ' 30' ' ' LYS . 8.0 tp -69.4 -18.7 63.79 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.228 -0.92 . . . . 0.0 109.404 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 11.0 tp -56.33 110.61 0.79 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.256 -0.902 . . . . 0.0 109.489 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.446 ' C ' ' H ' ' A' ' 36' ' ' ASN . 4.0 pt -81.37 -105.37 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.122 -0.987 . . . . 0.0 109.299 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.8 t70 57.4 5.7 0.32 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.228 -0.92 . . . . 0.0 109.505 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.491 ' ND2' ' O ' ' A' ' 36' ' ' ASN . 1.4 p-10 -80.23 120.86 24.89 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.246 -0.909 . . . . 0.0 109.393 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.428 ' O ' ' OE1' ' A' ' 37' ' ' GLU . 3.0 pp20? -73.99 18.18 0.15 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.256 -0.903 . . . . 0.0 109.683 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.479 ' O ' ' ND2' ' A' ' 36' ' ' ASN . 33.2 ttmt -144.61 147.2 32.82 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.286 -0.884 . . . . 0.0 109.572 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.427 HG13 ' N ' ' A' ' 40' ' ' THR . 8.8 p -161.5 -37.22 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 O-C-N 121.296 -0.878 . . . . 0.0 109.474 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.427 ' N ' HG13 ' A' ' 39' ' ' VAL . 1.6 t -70.6 173.56 6.95 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.171 -0.955 . . . . 0.0 109.453 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.8 t -170.81 -172.82 1.23 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.2 -0.937 . . . . 0.0 109.509 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -176.25 178.34 47.66 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 18.5 p80 -170.28 -162.05 0.28 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.26 -1.141 . . . . 0.0 109.448 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 69.8 p -149.87 115.83 5.65 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.212 -0.93 . . . . 0.0 109.276 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 32.8 m -59.74 -67.37 0.39 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.281 -0.887 . . . . 0.0 109.338 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.484 ' H ' HG22 ' A' ' 46' ' ' THR . 0.0 OUTLIER -64.12 104.09 0.69 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.274 -0.891 . . . . 0.0 109.508 -179.984 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 60.3 p -67.02 71.82 0.09 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.284 -0.885 . . . . 0.0 109.574 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.451 ' N ' ' O ' ' A' ' 46' ' ' THR . 55.1 mtp180 -144.54 142.29 30.11 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.159 -0.963 . . . . 0.0 109.242 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.429 ' O ' ' O ' ' A' ' 50' ' ' SER . 20.9 mmm180 -120.29 134.39 55.27 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.663 -0.648 . . . . 0.0 109.469 179.804 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.429 ' O ' ' O ' ' A' ' 49' ' ' ARG . 29.3 m -58.57 -156.81 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.278 -0.889 . . . . 0.0 109.945 -179.796 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.582 ' SG ' ' N ' ' A' ' 52' ' ' SER . 46.0 t 48.86 -119.41 1.19 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.295 -0.878 . . . . 0.0 109.346 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.582 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 42.0 m -60.64 128.09 34.91 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.058 -1.026 . . . . 0.0 108.843 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.442 ' O ' ' O ' ' A' ' 73' ' ' VAL . 0.0 OUTLIER -74.46 102.4 4.45 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.842 -1.161 . . . . 0.0 109.195 -179.419 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.574 HG13 ' O ' ' A' ' 54' ' ' VAL . 10.3 p -126.01 116.02 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 179.409 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.448 HG23 ' O ' ' A' ' 55' ' ' ILE . 17.9 tt -127.71 129.34 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 51.0 p -130.05 114.56 15.94 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.395 -0.816 . . . . 0.0 109.311 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.574 ' N ' ' OG1' ' A' ' 69' ' ' THR . 7.8 mtmt -121.4 113.5 19.97 Favored 'General case' 0 N--CA 1.514 2.771 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 178.692 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 65.9 p -116.38 136.29 53.13 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.479 -0.763 . . . . 0.0 109.886 -179.29 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 59' ' ' VAL . 2.7 m -131.72 124.05 53.13 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 178.538 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -108.97 133.45 52.95 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.763 -0.586 . . . . 0.0 110.196 -179.161 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.479 ' OD1' ' N ' ' A' ' 62' ' ' ALA . 26.3 t-20 -125.46 158.78 33.57 Favored 'General case' 0 N--CA 1.516 2.827 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.479 ' N ' ' OD1' ' A' ' 61' ' ' ASN . . . -71.66 -31.52 66.92 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 120.365 -1.459 . . . . 0.0 112.445 -177.744 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -69.88 8.57 0.68 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.499 -1.376 . . . . 0.0 109.638 -178.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.442 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 85.36 5.27 85.3 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.722 -1.351 . . . . 0.0 109.722 179.505 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 64.0 ttt180 -83.43 103.02 12.46 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.77 -1.43 . . . . 0.0 107.929 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 12.2 p -132.66 108.54 9.11 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.473 -0.767 . . . . 0.0 109.703 -178.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -94.92 130.52 41.5 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.226 -0.922 . . . . 0.0 109.933 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.5 p -108.96 107.52 17.93 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.479 -0.763 . . . . 0.0 109.407 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.574 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 30.8 p -97.78 33.01 2.18 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 178.627 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 74.2 mttt -66.71 67.63 0.06 Allowed 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 179.048 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.48 ' N ' ' O ' ' A' ' 69' ' ' THR . 74.3 mt-10 -98.0 149.85 22.0 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.169 -0.957 . . . . 0.0 110.142 -179.05 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.6 t -129.04 117.16 43.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.442 ' O ' ' O ' ' A' ' 53' ' ' LYS . 59.4 t -114.79 126.85 72.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 CA-C-O 122.105 0.955 . . . . 0.0 109.349 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 50.8 mttp -54.02 -95.89 0.0 OUTLIER 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 179.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.435 ' H ' ' HB2' ' A' ' 84' ' ' ALA . 38.3 p -153.5 69.72 0.82 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.177 -0.952 . . . . 0.0 109.206 179.528 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -66.5 -28.13 68.32 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.254 -0.904 . . . . 0.0 108.87 179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -140.46 12.74 2.35 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.35 -169.99 22.66 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 48.1 t -86.48 46.46 1.35 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.375 -1.074 . . . . 0.0 108.419 179.413 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 56.52 34.7 24.8 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 -179.272 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 2.8 t -78.06 14.59 1.1 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.281 -0.887 . . . . 0.0 109.329 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -169.78 -9.71 0.03 OUTLIER Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.407 -1.477 . . . . 0.0 109.407 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 53.17 75.87 0.23 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.284 -1.127 . . . . 0.0 109.553 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.435 ' HB2' ' H ' ' A' ' 75' ' ' SER . . . -74.67 175.91 7.46 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.268 -0.895 . . . . 0.0 109.521 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.445 ' N ' ' OD1' ' A' ' 85' ' ' ASP . 19.9 p-10 -172.21 120.39 0.43 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.191 -0.943 . . . . 0.0 109.52 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -61.13 -63.78 1.17 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.281 -0.887 . . . . 0.0 109.442 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 52.37 22.35 2.03 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.317 -0.864 . . . . 0.0 109.562 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -107.97 -71.27 0.76 Allowed 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.474 -0.766 . . . . 0.0 109.33 179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 29.2 t-80 -171.0 77.87 0.07 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.229 -0.92 . . . . 0.0 109.467 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 57.2 t-80 -170.07 -30.23 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.241 -0.912 . . . . 0.0 109.465 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 63.5 p -67.58 117.77 9.97 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.257 -0.902 . . . . 0.0 109.433 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -169.25 68.01 0.65 Allowed Pre-proline 0 N--CA 1.49 1.565 0 O-C-N 121.258 -0.901 . . . . 0.0 109.628 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.99 151.6 80.41 Favored 'Trans proline' 0 C--N 1.318 -1.047 0 C-N-CA 121.403 1.402 . . . . 0.0 109.803 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.479 ' O ' ' N ' ' A' ' 96' ' ' GLY . 41.2 t -170.82 41.94 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.343 -0.848 . . . . 0.0 109.407 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 -68.18 62.32 0.09 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.23 -0.919 . . . . 0.0 109.485 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.479 ' N ' ' O ' ' A' ' 94' ' ' SER . . . 178.41 153.15 11.0 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -168.25 -59.46 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.338 -1.095 . . . . 0.0 109.429 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 16.0 mt -68.99 -64.87 0.79 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.236 -0.915 . . . . 0.0 109.511 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -72.51 -162.42 0.1 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.297 -0.877 . . . . 0.0 109.403 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 53.01 14.91 0.51 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.223 -0.923 . . . . 0.0 109.425 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.411 ' C ' ' H ' ' A' ' 103' ' ' HIS . 79.4 t80 -64.5 -36.44 84.2 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.235 -0.915 . . . . 0.0 109.494 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 27.4 p90 -69.2 4.28 1.73 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.271 -0.893 . . . . 0.0 109.415 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.411 ' H ' ' C ' ' A' ' 101' ' ' PHE . 4.6 t60 -67.27 -43.43 81.84 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.202 -0.937 . . . . 0.0 109.464 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.524 ' NH1' ' O ' ' A' ' 106' ' ' LYS . 0.3 OUTLIER -167.92 93.46 0.38 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.269 -0.895 . . . . 0.0 108.928 179.992 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.466 ' CG ' ' H ' ' A' ' 106' ' ' LYS . 3.1 p-10 -81.72 -70.36 0.55 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.186 -0.946 . . . . 0.0 109.738 -179.679 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.524 ' O ' ' NH1' ' A' ' 104' ' ' ARG . 93.1 mttt -148.18 -51.88 0.18 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.125 -0.984 . . . . 0.0 109.47 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.428 ' O ' ' O ' ' A' ' 108' ' ' ASP . 6.6 p-10 -169.8 71.5 0.07 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.208 -0.933 . . . . 0.0 109.583 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.428 ' O ' ' O ' ' A' ' 107' ' ' ASP . 62.2 t0 52.59 99.11 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.254 -0.904 . . . . 0.0 109.568 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.493 ' O ' ' CD2' ' A' ' 109' ' ' PHE . 67.2 t80 -59.94 -6.16 1.22 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.295 -0.878 . . . . 0.0 109.404 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' PHE . . . . . 0.523 ' O ' ' CD2' ' A' ' 110' ' ' PHE . 52.4 t80 -72.67 16.42 0.15 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.293 -0.88 . . . . 0.0 109.439 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' THR . . . . . 0.478 ' H ' ' C ' ' A' ' 109' ' ' PHE . 67.3 p -149.93 89.12 1.58 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.22 -0.925 . . . . 0.0 109.352 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 51.0 mtp180 -51.74 137.14 26.23 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.264 -0.897 . . . . 0.0 109.507 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 29.2 t -171.33 18.8 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.359 -0.838 . . . . 0.0 109.482 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 95.5 p -60.23 141.49 55.96 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.256 -0.902 . . . . 0.0 109.476 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 59.6 t-80 -72.22 129.22 37.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.285 -0.884 . . . . 0.0 109.428 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -167.53 145.6 4.68 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.303 -0.873 . . . . 0.0 109.515 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -74.41 83.79 1.96 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.254 -0.904 . . . . 0.0 109.475 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 52.12 -147.84 0.43 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.253 -0.904 . . . . 0.0 109.493 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -166.61 -76.2 0.03 OUTLIER Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 31.7 ptt180 -171.76 5.43 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.208 -1.172 . . . . 0.0 109.428 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 43.3 m -71.68 -10.8 60.32 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.123 -0.986 . . . . 0.0 109.427 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -62.27 -120.64 0.01 OUTLIER Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 16.0 mt -64.71 128.93 37.84 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.345 -1.091 . . . . 0.0 109.365 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.512 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -76.64 161.56 73.79 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.227 -0.921 . . . . 0.0 108.764 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.512 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 1.6 Cg_endo -57.8 -69.76 0.04 OUTLIER 'Trans proline' 0 C--N 1.319 -0.985 0 C-N-CA 121.331 1.354 . . . . 0.0 109.926 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.615 ' H ' ' CD ' ' A' ' 126' ' ' GLU . 1.1 pm0 -58.03 85.26 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.273 -0.892 . . . . 0.0 109.699 -179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' PHE . . . . . 0.482 ' N ' ' O ' ' A' ' 125' ' ' PRO . 95.7 m-85 -53.89 -81.61 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.225 -0.922 . . . . 0.0 109.328 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -165.72 -149.28 0.11 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.213 -0.929 . . . . 0.0 109.368 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -164.9 115.41 1.14 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.265 -0.897 . . . . 0.0 109.43 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.59 ' N ' HD12 ' A' ' 130' ' ' LEU . 7.9 mp -72.92 -55.94 5.88 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.196 -0.94 . . . . 0.0 109.388 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 76.86 -82.34 1.1 Allowed Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -170.53 139.94 1.7 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.316 -1.108 . . . . 0.0 109.451 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 50.5 m -77.94 -44.56 26.5 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.217 -0.927 . . . . 0.0 109.491 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 75.3 43.44 25.37 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 94.3 p -72.84 149.51 43.49 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.25 -1.147 . . . . 0.0 109.48 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 38.6 t -74.51 79.89 1.95 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.201 -0.937 . . . . 0.0 109.449 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 41.1 p -172.33 -119.68 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.26 -0.9 . . . . 0.0 109.416 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 22.2 p 53.72 -161.72 0.12 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.139 -0.976 . . . . 0.0 109.512 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.44 ' CB ' ' NZ ' ' A' ' 139' ' ' LYS . 2.7 ttmp? -64.88 146.55 54.76 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.3 -0.875 . . . . 0.0 109.53 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 140' ' ' THR . . . . . 0.463 ' OG1' ' N ' ' A' ' 141' ' ' SER . 1.6 t -162.36 -175.18 4.4 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.24 -0.912 . . . . 0.0 109.517 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' SER . . . . . 0.463 ' N ' ' OG1' ' A' ' 140' ' ' THR . 12.4 t 53.11 -142.14 0.81 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.278 -0.889 . . . . 0.0 109.478 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 142' ' ' THR . . . . . 0.456 ' C ' ' H ' ' A' ' 144' ' ' SER . 24.3 m 53.75 88.6 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.285 -0.884 . . . . 0.0 109.436 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 64.9 m-70 -76.01 24.73 0.13 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.202 -0.936 . . . . 0.0 109.433 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' SER . . . . . 0.456 ' H ' ' C ' ' A' ' 142' ' ' THR . 41.4 t -167.26 94.4 0.45 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.244 -0.91 . . . . 0.0 109.493 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 56.1 pttt -70.9 159.75 34.08 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.295 -0.878 . . . . 0.0 109.437 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 52.39 -132.12 2.0 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.247 -0.908 . . . . 0.0 109.456 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -160.56 119.41 2.63 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.264 -0.898 . . . . 0.0 109.418 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 28.8 m -149.07 -151.53 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.273 -0.892 . . . . 0.0 109.328 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 10.3 m 53.83 32.69 15.47 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.139 -0.976 . . . . 0.0 109.476 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 48.8 m -59.59 116.77 4.24 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.27 -0.894 . . . . 0.0 109.51 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 70.5 m -164.59 98.64 0.79 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.309 -0.869 . . . . 0.0 109.391 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 73.9 p -150.29 82.94 1.37 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.331 -0.856 . . . . 0.0 109.358 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 75.7 p -150.63 40.03 0.74 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.231 -0.918 . . . . 0.0 109.295 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 28.2 m -59.57 144.18 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.226 -0.921 . . . . 0.0 109.598 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 52.0 t-20 -66.83 125.43 25.87 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.263 -0.898 . . . . 0.0 109.425 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 89.8 mtm180 -64.21 -65.25 0.7 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.323 -0.86 . . . . 0.0 109.398 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 63.67 109.49 0.01 OUTLIER Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -66.37 -145.5 0.06 OUTLIER Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 11.9 m 53.18 26.71 5.24 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.248 -1.148 . . . . 0.0 109.367 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -63.47 -68.11 0.37 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.367 -0.833 . . . . 0.0 109.467 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 75.9 mt -64.75 -75.96 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.285 -0.884 . . . . 0.0 109.541 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 47.5 tt0 -68.27 142.88 55.46 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.3 -0.875 . . . . 0.0 109.46 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 31.2 t -171.21 66.8 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.329 -0.857 . . . . 0.0 109.424 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.428 ' O ' ' O ' ' A' ' 165' ' ' HIS . 63.4 mttm 52.54 -117.77 1.22 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.205 -0.934 . . . . 0.0 109.365 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 165' ' ' HIS . . . . . 0.428 ' O ' ' O ' ' A' ' 164' ' ' LYS . 0.8 OUTLIER 54.89 103.11 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.157 -0.964 . . . . 0.0 109.547 -179.958 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 52.2 p90 . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 117.923 -1.037 . . . . 0.0 109.483 179.959 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 73.19 129.57 0.13 Allowed Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.519 ' O ' ' CD2' ' A' ' 4' ' ' PHE . 0.1 OUTLIER -79.03 132.16 36.53 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.199 -1.177 . . . . 0.0 109.413 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.519 ' CD2' ' O ' ' A' ' 3' ' ' THR . 65.8 m-85 -160.34 35.37 0.17 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.258 -0.901 . . . . 0.0 109.488 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 80.3 mtm180 -60.44 -11.67 7.46 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.311 -0.868 . . . . 0.0 109.471 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.497 ' CD ' ' N ' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -168.92 169.23 9.84 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.256 -0.902 . . . . 0.0 109.512 179.938 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -170.36 145.18 2.64 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.301 -0.874 . . . . 0.0 109.533 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.4 ' C ' ' N ' ' A' ' 10' ' ' VAL . . . 173.45 -79.26 0.08 OUTLIER Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.5 m 53.92 12.27 0.42 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.207 -1.172 . . . . 0.0 109.463 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.4 ' N ' ' C ' ' A' ' 8' ' ' GLY . 23.9 t -62.28 -11.37 6.27 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.227 -0.921 . . . . 0.0 109.403 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 29.4 t -158.76 -80.17 0.06 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.271 -0.893 . . . . 0.0 109.362 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.3 t -62.69 130.58 45.6 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.209 -0.932 . . . . 0.0 109.486 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -173.06 -11.7 0.02 OUTLIER Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.423 ' O ' ' O ' ' A' ' 15' ' ' LYS . 41.1 p -152.88 87.68 1.3 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.28 -1.13 . . . . 0.0 109.278 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.423 ' O ' ' O ' ' A' ' 14' ' ' THR . 31.1 ttmt 59.39 154.69 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.415 -0.803 . . . . 0.0 109.482 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -72.61 116.12 12.7 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.224 -0.922 . . . . 0.0 109.611 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 50.7 tt0 -62.6 -27.18 69.02 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.278 -0.889 . . . . 0.0 109.405 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 40.5 p90 -163.46 176.17 10.04 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.407 -0.808 . . . . 0.0 109.218 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.455 ' C ' ' HG1' ' A' ' 20' ' ' THR . 2.1 t60 -168.32 -59.36 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.108 -0.995 . . . . 0.0 109.695 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.522 ' OG1' ' N ' ' A' ' 21' ' ' GLY . 45.4 p 48.58 -103.27 0.1 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.165 -0.959 . . . . 0.0 109.482 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.522 ' N ' ' OG1' ' A' ' 20' ' ' THR . . . -151.56 32.07 0.92 Allowed Glycine 0 N--CA 1.494 2.541 0 N-CA-C 109.496 -1.441 . . . . 0.0 109.496 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 18.8 mmmt -82.59 97.1 8.3 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.203 -1.175 . . . . 0.0 109.407 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.575 ' N ' HD12 ' A' ' 23' ' ' LEU . 10.0 mp -79.43 85.01 5.26 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.249 -0.907 . . . . 0.0 109.199 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 8.3 p -64.79 145.58 13.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.169 -0.957 . . . . 0.0 109.571 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.8 t -50.36 158.78 0.55 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.285 -0.884 . . . . 0.0 109.52 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.5 t -172.59 3.72 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.372 -0.83 . . . . 0.0 109.472 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 57.0 mttp 52.75 -174.84 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.217 -0.927 . . . . 0.0 109.526 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 174.49 -68.27 0.1 OUTLIER Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -171.01 81.29 0.08 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.26 -1.141 . . . . 0.0 109.493 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.4 tttm -69.93 73.98 0.44 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.306 -0.871 . . . . 0.0 109.505 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.461 ' C ' ' H ' ' A' ' 33' ' ' LEU . 31.8 tt0 -65.61 165.2 12.81 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.249 -0.907 . . . . 0.0 109.33 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.4 ' O ' ' O ' ' A' ' 33' ' ' LEU . 18.1 mt -56.24 -6.52 0.27 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.215 -0.928 . . . . 0.0 109.314 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.461 ' H ' ' C ' ' A' ' 31' ' ' GLU . 50.4 tp 50.58 94.02 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.329 -0.857 . . . . 0.0 109.305 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.413 HG22 ' N ' ' A' ' 35' ' ' ASP . 79.0 mt -67.82 155.93 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.239 -0.913 . . . . 0.0 109.413 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.413 ' N ' HG22 ' A' ' 34' ' ' ILE . 17.0 t0 -167.71 -101.22 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.237 -0.915 . . . . 0.0 109.418 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 -157.18 -6.73 0.09 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.323 -0.86 . . . . 0.0 109.412 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 55.53 -127.38 2.14 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.198 -0.939 . . . . 0.0 109.344 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.9 mmtm -53.75 -84.92 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.203 -0.936 . . . . 0.0 109.406 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.49 ' O ' HG13 ' A' ' 39' ' ' VAL . 3.6 p -167.81 88.84 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.207 -0.933 . . . . 0.0 109.583 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.503 ' OG1' ' N ' ' A' ' 41' ' ' SER . 6.0 t 35.02 -153.35 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.122 0 CA-C-O 121.219 0.533 . . . . 0.0 110.954 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.503 ' N ' ' OG1' ' A' ' 40' ' ' THR . 32.5 m -166.28 -139.05 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.324 -0.86 . . . . 0.0 109.529 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 168.99 -136.64 4.15 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.417 -1.473 . . . . 0.0 109.417 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.607 ' CG ' ' H ' ' A' ' 44' ' ' THR . 0.0 OUTLIER -59.5 -103.28 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.184 -1.186 . . . . 0.0 109.368 179.947 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.607 ' H ' ' CG ' ' A' ' 43' ' ' HIS . 3.9 p 58.74 117.81 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.451 -0.781 . . . . 0.0 109.862 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.45 ' C ' ' H ' ' A' ' 47' ' ' THR . 12.1 p 52.56 72.39 0.41 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.171 -0.955 . . . . 0.0 109.475 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 81.4 p -76.07 33.34 0.12 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.201 -0.937 . . . . 0.0 109.466 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.45 ' H ' ' C ' ' A' ' 45' ' ' THR . 3.0 m 59.31 10.66 1.84 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.241 -0.912 . . . . 0.0 109.366 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 42.9 ttp180 -146.05 148.18 32.41 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.206 -0.934 . . . . 0.0 109.142 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.529 ' CG ' HH11 ' A' ' 49' ' ' ARG . 0.9 OUTLIER -97.19 139.18 33.55 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.145 -0.972 . . . . 0.0 109.621 179.888 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 36.8 t -62.39 -105.01 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.266 -0.896 . . . . 0.0 109.234 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.49 ' SG ' ' O ' ' A' ' 81' ' ' CYS . 5.6 t -49.75 146.11 4.68 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.145 -0.972 . . . . 0.0 108.818 179.474 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 40.3 t 50.54 87.49 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.007 -1.058 . . . . 0.0 108.342 -179.13 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -75.84 104.84 6.56 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.307 -0.87 . . . . 0.0 110.292 -178.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.599 HG13 ' O ' ' A' ' 54' ' ' VAL . 11.7 p -115.61 113.6 43.84 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.528 HG23 ' O ' ' A' ' 55' ' ' ILE . 10.1 tp -128.52 125.44 63.69 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 65.4 p -128.89 111.41 13.03 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.359 -0.838 . . . . 0.0 109.278 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.522 ' H ' ' HB ' ' A' ' 69' ' ' THR . 0.1 OUTLIER -124.55 113.59 18.28 Favored 'General case' 0 N--CA 1.51 2.561 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 178.767 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.0 p -110.95 130.22 55.65 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.467 -0.771 . . . . 0.0 109.67 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 59' ' ' VAL . 2.8 m -132.55 120.3 41.77 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.14 0 O-C-N 121.481 -0.762 . . . . 0.0 109.207 178.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 33.9 p -109.11 133.86 52.46 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 37.6 t-20 -128.37 162.33 27.36 Favored 'General case' 0 N--CA 1.514 2.769 0 O-C-N 121.46 -0.775 . . . . 0.0 109.317 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.414 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -71.91 -32.38 67.32 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 120.559 -1.338 . . . . 0.0 112.558 -177.641 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -69.21 5.59 1.21 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.372 -1.455 . . . . 0.0 109.953 -178.541 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.414 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 90.79 4.76 69.33 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 110.08 -1.208 . . . . 0.0 110.08 179.227 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 11.2 mpt_? -80.67 94.24 6.3 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 120.636 -1.508 . . . . 0.0 107.86 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 31.0 p -120.36 89.66 3.17 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -94.73 122.21 37.11 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.268 -0.895 . . . . 0.0 110.051 -178.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.408 ' C ' ' H ' ' A' ' 70' ' ' LYS . 40.8 p -101.19 109.18 21.01 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.329 -0.857 . . . . 0.0 109.581 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.524 ' O ' ' N ' ' A' ' 71' ' ' GLU . 5.2 m -87.4 31.19 0.75 Allowed 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 178.781 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.408 ' H ' ' C ' ' A' ' 68' ' ' THR . 16.5 ptmt -64.84 59.01 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.774 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.524 ' N ' ' O ' ' A' ' 69' ' ' THR . 13.7 mm-40 -96.3 136.78 36.33 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.053 -1.029 . . . . 0.0 109.481 -179.709 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' ' 72' ' ' VAL . 10.4 m -128.15 129.8 69.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 179.598 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 15.1 t -129.08 114.32 31.89 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 CA-C-O 122.057 0.932 . . . . 0.0 108.946 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -97.38 -16.04 20.42 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.604 -179.84 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.406 ' C ' ' N ' ' A' ' 77' ' ' ASP . 50.8 m -158.92 -127.33 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.146 -0.971 . . . . 0.0 109.533 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.454 ' N ' ' CD ' ' A' ' 76' ' ' GLU . 19.4 mp0 51.56 15.67 0.37 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.285 -0.884 . . . . 0.0 109.325 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.406 ' N ' ' C ' ' A' ' 75' ' ' SER . 25.5 t70 -166.4 27.54 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.241 -0.912 . . . . 0.0 109.386 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.482 ' C ' ' H ' ' A' ' 80' ' ' ASP . . . -153.38 -52.15 0.01 OUTLIER Glycine 0 N--CA 1.493 2.458 0 N-CA-C 109.453 -1.459 . . . . 0.0 109.453 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 13.9 m 50.34 11.19 0.07 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.309 -1.113 . . . . 0.0 109.272 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.482 ' H ' ' C ' ' A' ' 78' ' ' GLY . 3.5 p30 -169.78 32.96 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.308 -0.87 . . . . 0.0 109.464 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.49 ' O ' ' SG ' ' A' ' 51' ' ' CYS . 8.5 t -113.35 29.6 7.86 Favored 'General case' 0 N--CA 1.499 1.99 0 N-CA-C 108.976 -0.749 . . . . 0.0 108.976 179.542 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.445 ' C ' ' H ' ' A' ' 84' ' ' ALA . . . -177.67 -32.36 0.05 OUTLIER Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -68.81 42.76 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.221 -1.164 . . . . 0.0 109.407 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.445 ' H ' ' C ' ' A' ' 82' ' ' GLY . . . -68.16 -177.77 0.92 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.287 -0.883 . . . . 0.0 109.506 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 46.0 t0 53.43 58.59 5.06 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.224 -0.922 . . . . 0.0 109.451 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -170.84 -25.42 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.269 -0.895 . . . . 0.0 109.472 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -79.0 24.53 0.31 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.198 -0.939 . . . . 0.0 109.5 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 43.8 m95 -75.98 9.19 2.57 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.263 -0.898 . . . . 0.0 109.501 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.524 ' O ' ' CG ' ' A' ' 90' ' ' HIS . 0.7 OUTLIER -76.41 117.91 18.55 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.25 -0.906 . . . . 0.0 109.504 -179.887 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.524 ' CG ' ' O ' ' A' ' 89' ' ' HIS . 93.7 m-70 -158.13 -48.32 0.06 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.298 -0.876 . . . . 0.0 109.337 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 4.5 p 57.5 25.76 11.86 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.319 -0.863 . . . . 0.0 109.773 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 57.3 t80 52.71 75.35 0.65 Allowed Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 121.191 -0.943 . . . . 0.0 109.674 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -63.48 -172.03 0.14 Allowed 'Trans proline' 0 C--N 1.317 -1.114 0 C-N-CA 121.449 1.433 . . . . 0.0 109.741 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.438 ' O ' ' N ' ' A' ' 96' ' ' GLY . 30.4 t -164.45 -176.4 4.35 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.207 -0.933 . . . . 0.0 109.531 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.563 ' H ' ' NE ' ' A' ' 95' ' ' ARG . 0.1 OUTLIER -65.98 76.95 0.09 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.158 -0.964 . . . . 0.0 109.164 179.952 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 94' ' ' SER . . . 166.89 55.61 0.03 OUTLIER Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -67.89 -56.26 9.75 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.268 -1.136 . . . . 0.0 109.457 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.406 ' O ' ' O ' ' A' ' 99' ' ' ASP . 16.4 mt -69.22 176.57 3.21 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.18 -0.95 . . . . 0.0 109.446 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.406 ' O ' ' O ' ' A' ' 98' ' ' LEU . 20.7 m-20 54.73 101.08 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.258 -0.901 . . . . 0.0 109.449 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.43 ' N ' ' OD1' ' A' ' 100' ' ' ASP . 23.4 p-10 -161.8 -12.13 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.272 -0.892 . . . . 0.0 109.566 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -68.14 -20.65 64.92 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.21 -0.931 . . . . 0.0 109.479 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 66.3 t80 46.3 64.84 1.35 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.281 -0.887 . . . . 0.0 109.63 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.504 ' O ' ' N ' ' A' ' 105' ' ' ASP . 39.4 p-80 -76.25 -23.08 54.48 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.303 -0.873 . . . . 0.0 109.501 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 75.9 mtm180 -68.04 62.38 0.08 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.263 -0.898 . . . . 0.0 109.37 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.504 ' N ' ' O ' ' A' ' 103' ' ' HIS . 19.1 p-10 -79.17 10.05 3.94 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.249 -0.907 . . . . 0.0 109.35 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -72.06 52.03 0.24 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.324 -0.86 . . . . 0.0 109.358 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -69.75 163.56 25.47 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.26 -0.9 . . . . 0.0 109.443 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -169.31 73.88 0.09 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.264 -0.898 . . . . 0.0 109.519 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -72.69 -49.61 30.3 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.211 -0.931 . . . . 0.0 109.415 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -70.82 114.48 8.94 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.292 -0.88 . . . . 0.0 109.452 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 74.9 p -67.38 -25.72 66.11 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.276 -0.89 . . . . 0.0 109.42 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 54.5 mtp180 -68.35 147.95 51.4 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.231 -0.918 . . . . 0.0 109.472 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 91.5 p -72.79 -5.9 41.11 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.244 -0.91 . . . . 0.0 109.51 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 50.4 m 51.63 -106.84 0.28 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.285 -0.885 . . . . 0.0 109.517 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -170.97 103.06 0.22 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.246 -0.909 . . . . 0.0 109.48 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.453 ' CD ' ' N ' ' A' ' 116' ' ' GLU . 2.0 mp0 -76.47 83.17 3.18 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.316 -0.865 . . . . 0.0 109.538 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -74.68 128.67 36.12 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.25 -0.906 . . . . 0.0 109.496 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.444 ' N ' ' OD1' ' A' ' 118' ' ' ASP . 20.3 p-10 -170.45 163.09 8.47 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.262 -0.899 . . . . 0.0 109.514 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -72.32 84.07 0.53 Allowed Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.582 ' CG ' HH11 ' A' ' 120' ' ' ARG . 0.3 OUTLIER -169.19 89.37 0.2 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.199 -1.177 . . . . 0.0 109.434 179.929 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 52.4 p -66.61 129.16 38.95 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.301 -0.874 . . . . 0.0 109.537 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -68.19 -127.4 0.03 OUTLIER Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.443 -1.463 . . . . 0.0 109.443 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.591 ' N ' HD12 ' A' ' 123' ' ' LEU . 8.5 mp -64.08 126.53 27.99 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.181 -1.188 . . . . 0.0 109.09 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.529 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -67.31 162.05 58.93 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.108 -0.995 . . . . 0.0 108.924 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.529 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 1.3 Cg_endo -58.11 -15.26 22.24 Favored 'Trans proline' 0 C--N 1.32 -0.962 0 C-N-CA 121.404 1.403 . . . . 0.0 109.854 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 67.8 mm-40 50.94 25.63 2.3 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.251 -0.906 . . . . 0.0 109.362 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 55.58 58.46 4.53 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.348 -0.845 . . . . 0.0 109.388 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.91 -161.29 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.311 -0.868 . . . . 0.0 109.471 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -171.37 -167.21 0.51 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.157 -0.964 . . . . 0.0 109.441 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.579 ' N ' HD12 ' A' ' 130' ' ' LEU . 8.5 mp -75.79 164.44 26.24 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.2 -0.938 . . . . 0.0 109.248 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -65.75 -67.65 1.94 Allowed Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 52.37 92.09 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.217 -1.166 . . . . 0.0 109.528 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 98.6 p -67.87 -26.66 66.13 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.263 -0.898 . . . . 0.0 109.456 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 68.56 -97.65 0.49 Allowed Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 49.2 m -60.57 152.33 26.43 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.286 -1.126 . . . . 0.0 109.444 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 68.9 m -166.4 157.58 12.98 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.3 -0.875 . . . . 0.0 109.467 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 55.7 m -64.53 -68.21 0.37 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.272 -0.893 . . . . 0.0 109.474 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.496 ' OG ' ' N ' ' A' ' 139' ' ' LYS . 24.3 p 52.95 -134.86 1.61 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.282 -0.886 . . . . 0.0 109.463 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.496 ' N ' ' OG ' ' A' ' 138' ' ' SER . 55.2 pttt -161.6 -6.88 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.202 -0.937 . . . . 0.0 109.457 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 43.8 m -64.43 132.43 50.01 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.21 -0.931 . . . . 0.0 109.431 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' SER . . . . . 0.426 ' O ' ' O ' ' A' ' 142' ' ' THR . 42.6 t -166.86 162.88 16.18 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.164 -0.96 . . . . 0.0 109.434 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' THR . . . . . 0.426 ' O ' ' O ' ' A' ' 141' ' ' SER . 19.4 m 53.98 100.96 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.234 -0.916 . . . . 0.0 109.496 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 -159.65 82.54 0.74 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.204 -0.935 . . . . 0.0 109.468 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' SER . . . . . 0.515 ' O ' ' N ' ' A' ' 146' ' ' GLN . 78.5 p -167.28 123.5 1.13 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.269 -0.894 . . . . 0.0 109.515 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 145' ' ' LYS . . . . . 0.422 ' C ' ' H ' ' A' ' 147' ' ' PHE . 16.2 pttp -62.12 76.66 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.222 -0.924 . . . . 0.0 109.388 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 146' ' ' GLN . . . . . 0.515 ' N ' ' O ' ' A' ' 144' ' ' SER . 76.3 mt-30 -53.75 -10.63 0.31 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.256 -0.902 . . . . 0.0 109.497 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 147' ' ' PHE . . . . . 0.422 ' H ' ' C ' ' A' ' 145' ' ' LYS . 60.3 t80 -67.83 -34.44 76.73 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.233 -0.917 . . . . 0.0 109.457 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 23.0 t 52.44 95.19 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.226 -0.921 . . . . 0.0 109.475 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 49.0 m -67.63 -62.04 1.6 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.234 -0.917 . . . . 0.0 109.397 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 49.3 m -58.51 115.46 3.02 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.293 -0.879 . . . . 0.0 109.49 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 90.6 p -169.95 -56.52 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.295 -0.878 . . . . 0.0 109.496 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 1.8 t -172.98 174.56 3.47 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.289 -0.882 . . . . 0.0 109.499 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' THR . . . . . 0.422 HG22 ' H ' ' A' ' 153' ' ' THR . 0.0 OUTLIER -53.37 124.17 14.0 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.183 -0.948 . . . . 0.0 109.52 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.419 ' O ' ' O ' ' A' ' 155' ' ' ASN . 27.6 m -71.61 145.54 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.194 -0.941 . . . . 0.0 109.504 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 155' ' ' ASN . . . . . 0.419 ' O ' ' O ' ' A' ' 154' ' ' VAL . 6.1 m120 50.88 -179.7 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.228 -0.92 . . . . 0.0 109.559 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 54.6 mtp180 -77.03 -12.78 59.98 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.225 -0.922 . . . . 0.0 109.472 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 68.05 24.24 74.54 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 66.61 -149.74 51.53 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 88.6 p -171.37 22.69 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.255 -1.144 . . . . 0.0 109.428 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -71.9 -54.15 10.94 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.269 -0.895 . . . . 0.0 109.465 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 161' ' ' ILE . . . . . 0.5 HG23 ' O ' ' A' ' 161' ' ' ILE . 13.8 tt -74.0 118.13 19.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.207 -0.933 . . . . 0.0 109.577 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 6.1 tm-20 -165.33 115.8 1.09 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.194 -0.941 . . . . 0.0 109.284 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 163' ' ' SER . . . . . 0.478 ' O ' ' N ' ' A' ' 165' ' ' HIS . 30.0 t -165.57 -31.87 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.302 -0.874 . . . . 0.0 109.46 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 48.5 mtmt 51.31 -92.47 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.281 -0.887 . . . . 0.0 109.424 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 165' ' ' HIS . . . . . 0.478 ' N ' ' O ' ' A' ' 163' ' ' SER . 0.0 OUTLIER -169.34 69.3 0.06 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.298 -0.876 . . . . 0.0 109.432 -179.984 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 48.7 p90 . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 118.012 -0.995 . . . . 0.0 109.462 179.955 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.0 ptt? . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 164.55 166.1 22.92 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.0 t -65.68 146.67 54.51 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.211 -1.17 . . . . 0.0 109.459 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -167.56 71.61 0.1 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.236 -0.915 . . . . 0.0 109.397 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 59.8 mtm180 -149.9 142.97 24.96 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.314 -0.866 . . . . 0.0 109.375 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -170.64 -29.06 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.232 -0.917 . . . . 0.0 109.429 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -170.63 85.22 0.1 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.298 -0.876 . . . . 0.0 109.415 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.422 ' O ' ' O ' ' A' ' 9' ' ' SER . . . 152.24 48.28 0.02 OUTLIER Glycine 0 N--CA 1.493 2.45 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.422 ' O ' ' O ' ' A' ' 8' ' ' GLY . 29.7 t -55.68 -103.78 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.253 -1.145 . . . . 0.0 109.513 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 43.5 t -74.92 -76.07 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.188 -0.945 . . . . 0.0 109.496 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 89.4 p -75.27 125.54 29.17 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.18 -0.95 . . . . 0.0 109.547 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.0 m -60.59 -158.35 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.232 -0.917 . . . . 0.0 109.465 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -60.24 -165.89 0.23 Allowed Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 37.6 m -61.02 132.83 55.1 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.213 -1.169 . . . . 0.0 109.519 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -59.23 -71.12 0.13 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.323 -0.86 . . . . 0.0 109.535 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -66.03 111.07 3.18 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.239 -0.913 . . . . 0.0 109.473 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -59.77 -41.84 91.98 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.183 -0.948 . . . . 0.0 109.479 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -67.44 -156.87 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.298 -0.877 . . . . 0.0 109.498 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.408 ' O ' ' OG1' ' A' ' 20' ' ' THR . 1.7 p80 -174.62 10.65 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.253 -0.905 . . . . 0.0 109.508 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.408 ' OG1' ' O ' ' A' ' 19' ' ' HIS . 91.3 m -166.38 -64.82 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.204 -0.935 . . . . 0.0 109.465 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 165.28 -161.77 35.14 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.541 -1.423 . . . . 0.0 109.541 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 22.7 pttm -166.47 132.8 2.44 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.183 -1.187 . . . . 0.0 109.474 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.585 ' N ' HD12 ' A' ' 23' ' ' LEU . 8.9 mp 50.0 76.29 0.14 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.204 -0.935 . . . . 0.0 109.266 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.0 t -56.46 -47.71 81.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.314 -0.866 . . . . 0.0 109.44 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 68.6 p -76.37 112.46 12.89 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.24 -0.913 . . . . 0.0 109.415 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 4.2 t -167.28 137.13 2.87 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.269 -0.895 . . . . 0.0 109.466 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -80.71 -87.97 0.08 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.23 -0.919 . . . . 0.0 109.429 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 171.02 69.88 0.04 OUTLIER Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -169.3 79.26 0.12 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.323 -1.104 . . . . 0.0 109.412 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' A' ' 32' ' ' LEU . 61.8 mttp -75.55 96.89 3.6 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.296 -0.877 . . . . 0.0 109.464 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 82.9 mt-10 -69.48 48.62 0.08 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.21 -0.931 . . . . 0.0 109.389 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.541 ' O ' HD13 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -65.01 -36.25 83.79 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.271 -0.893 . . . . 0.0 109.063 -179.962 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.428 ' O ' ' O ' ' A' ' 34' ' ' ILE . 15.1 mt -67.22 5.82 0.66 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.197 -0.939 . . . . 0.0 109.517 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.449 ' H ' ' C ' ' A' ' 32' ' ' LEU . 88.2 mt 51.65 98.01 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.254 -0.904 . . . . 0.0 109.53 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.41 ' O ' ' O ' ' A' ' 34' ' ' ILE . 15.4 p-10 -62.79 -123.66 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.251 -0.906 . . . . 0.0 109.404 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 59.1 t30 53.01 38.27 26.84 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.184 -0.947 . . . . 0.0 109.426 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -68.21 116.26 8.61 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.214 -0.929 . . . . 0.0 109.441 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -68.51 -145.48 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.28 -0.888 . . . . 0.0 109.436 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 28.1 m -56.87 147.93 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.204 -0.935 . . . . 0.0 109.439 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 48.4 m -165.31 -53.42 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.237 -0.915 . . . . 0.0 109.47 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 40.7 t -61.64 -59.66 4.85 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.228 -0.92 . . . . 0.0 109.444 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -178.16 116.36 0.53 Allowed Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.432 ' O ' ' ND1' ' A' ' 43' ' ' HIS . 14.3 p80 -60.78 100.56 0.11 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.218 -1.166 . . . . 0.0 109.532 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.1 m -165.16 154.45 12.64 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.273 -0.892 . . . . 0.0 109.394 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -173.02 139.67 0.84 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.167 -0.958 . . . . 0.0 109.508 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 36.6 m -66.99 124.52 23.25 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.15 -0.969 . . . . 0.0 109.329 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 74.2 p -152.98 -136.9 0.06 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.315 -0.866 . . . . 0.0 108.833 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -146.6 142.36 27.88 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.188 -0.945 . . . . 0.0 108.958 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.475 ' O ' ' O ' ' A' ' 52' ' ' SER . 22.6 mmt180 -99.79 122.25 42.48 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.232 -0.917 . . . . 0.0 109.488 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.497 ' C ' ' H ' ' A' ' 52' ' ' SER . 29.5 t -78.71 -36.84 42.83 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.063 -1.023 . . . . 0.0 110.22 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 25.9 p -56.02 -4.02 0.11 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.029 -1.044 . . . . 0.0 109.744 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.524 ' OG ' ' N ' ' A' ' 53' ' ' LYS . 0.9 OUTLIER -166.26 -175.17 3.17 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 -179.78 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.524 ' N ' ' OG ' ' A' ' 52' ' ' SER . 44.6 tptt -103.89 101.67 11.46 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 120.95 -1.094 . . . . 0.0 108.049 179.176 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 21.7 t -127.63 114.73 37.03 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.875 0 O-C-N 121.479 -0.763 . . . . 0.0 109.975 -179.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.491 ' CG2' ' NZ ' ' A' ' 57' ' ' LYS . 35.9 mm -117.84 113.64 42.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 179.19 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 81.7 p -130.34 112.97 13.79 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.223 -0.923 . . . . 0.0 109.937 -179.585 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.57 ' N ' ' OG1' ' A' ' 69' ' ' THR . 10.9 mmtp -123.86 114.19 19.52 Favored 'General case' 0 N--CA 1.515 2.777 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 178.762 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 53.3 m -119.5 124.43 46.44 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.609 -0.682 . . . . 0.0 109.613 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 59' ' ' VAL . 2.8 m -131.48 124.88 55.47 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.187 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.011 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' THR . . . . . 0.513 HG23 ' O ' ' A' ' 60' ' ' THR . 8.0 t -109.23 122.93 48.38 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.757 -0.589 . . . . 0.0 110.323 -179.465 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -110.56 144.94 38.66 Favored 'General case' 0 N--CA 1.513 2.685 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.464 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -62.82 -34.7 77.86 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 120.084 -1.635 . . . . 0.0 112.944 -177.422 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -66.24 5.63 0.52 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.355 -1.466 . . . . 0.0 110.045 -178.318 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.464 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 90.83 5.49 68.41 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 110.423 -1.071 . . . . 0.0 110.423 178.836 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 41.2 ttm180 -90.54 111.98 23.47 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.644 -1.504 . . . . 0.0 107.834 178.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.8 p -138.47 116.95 12.04 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.255 -0.903 . . . . 0.0 109.81 -179.01 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -94.35 119.51 33.21 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.281 -0.887 . . . . 0.0 109.77 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.0 p -103.46 109.0 20.49 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.431 -0.793 . . . . 0.0 109.395 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.57 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 4.6 p -111.62 26.72 10.35 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 107.383 -1.339 . . . . 0.0 107.383 178.759 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 36.4 pttt -65.36 65.9 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' A' ' 69' ' ' THR . 46.5 mt-10 -102.34 156.69 17.42 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.373 -0.83 . . . . 0.0 110.26 -179.121 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.3 p -127.56 136.32 60.8 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.449 ' O ' ' CB ' ' A' ' 74' ' ' LYS . 20.1 t -129.44 117.53 42.98 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.101 0 CA-C-O 121.972 0.891 . . . . 0.0 109.921 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.449 ' CB ' ' O ' ' A' ' 73' ' ' VAL . 0.1 OUTLIER 161.44 -68.02 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 179.627 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 97.1 p -160.94 -137.89 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.402 -0.812 . . . . 0.0 109.307 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -66.45 -50.33 63.72 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.185 -0.947 . . . . 0.0 109.282 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.411 ' O ' ' OD1' ' A' ' 77' ' ' ASP . 60.7 t0 -166.19 47.82 0.08 Allowed 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.313 -0.867 . . . . 0.0 109.198 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.493 ' C ' ' H ' ' A' ' 80' ' ' ASP . . . 89.82 83.06 1.34 Allowed Glycine 0 N--CA 1.494 2.529 0 N-CA-C 109.396 -1.482 . . . . 0.0 109.396 -179.732 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 49.5 m -61.15 -0.01 0.29 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.301 -1.117 . . . . 0.0 109.464 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.493 ' H ' ' C ' ' A' ' 78' ' ' GLY . 39.2 m-20 -151.79 45.57 0.77 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.262 -0.899 . . . . 0.0 109.354 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.408 ' SG ' ' C ' ' A' ' 80' ' ' ASP . 25.6 m -150.84 -58.86 0.17 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.299 -0.875 . . . . 0.0 109.284 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -145.72 42.69 0.96 Allowed Glycine 0 N--CA 1.496 2.641 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.486 ' CG ' ' H ' ' A' ' 84' ' ' ALA . 13.5 t70 -171.05 -170.09 0.82 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.259 -1.142 . . . . 0.0 109.518 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.486 ' H ' ' CG ' ' A' ' 83' ' ' ASP . . . -160.79 146.88 14.9 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.269 -0.895 . . . . 0.0 109.34 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.483 ' OD1' ' N ' ' A' ' 86' ' ' PHE . 57.4 t0 -167.35 137.97 2.98 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.229 -0.92 . . . . 0.0 109.345 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.483 ' N ' ' OD1' ' A' ' 85' ' ' ASP . 47.7 m-85 -60.25 93.32 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.235 -0.915 . . . . 0.0 109.437 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -68.83 -41.51 78.47 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.256 -0.903 . . . . 0.0 109.48 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 -85.07 56.43 3.94 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.193 -0.942 . . . . 0.0 109.352 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.469 ' HD1' ' C ' ' A' ' 89' ' ' HIS . 0.2 OUTLIER -69.51 158.4 35.29 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.298 -0.876 . . . . 0.0 109.443 -179.952 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 30.4 p80 -168.05 137.37 2.5 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.251 -0.906 . . . . 0.0 109.319 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 80.5 p -76.38 -163.4 0.31 Allowed 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.177 -0.952 . . . . 0.0 109.547 -179.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.437 ' CD2' ' O ' ' A' ' 92' ' ' PHE . 82.2 t80 -168.6 67.95 0.72 Allowed Pre-proline 0 N--CA 1.49 1.545 0 O-C-N 121.3 -0.875 . . . . 0.0 109.594 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -61.59 131.78 37.37 Favored 'Trans proline' 0 C--N 1.317 -1.08 0 C-N-CA 121.367 1.378 . . . . 0.0 109.815 -179.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 92.1 p -93.48 130.22 39.4 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.333 -0.854 . . . . 0.0 109.356 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.542 ' CG ' HH11 ' A' ' 95' ' ' ARG . 4.1 mtt-85 -68.3 -60.3 2.56 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.209 -0.932 . . . . 0.0 109.307 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 74.08 -154.81 48.51 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.417 -1.473 . . . . 0.0 109.417 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 17.8 p-10 -172.24 166.64 5.94 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.226 -1.161 . . . . 0.0 109.583 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -154.6 167.85 28.75 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.289 -0.882 . . . . 0.0 109.317 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.454 ' C ' ' H ' ' A' ' 101' ' ' PHE . 26.4 t70 -168.21 30.31 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.248 -0.908 . . . . 0.0 109.508 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -75.85 31.65 0.11 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.246 -0.909 . . . . 0.0 109.35 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.454 ' H ' ' C ' ' A' ' 99' ' ' ASP . 67.2 t80 -70.83 -32.48 69.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.276 -0.89 . . . . 0.0 109.406 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -61.94 -36.03 80.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.267 -0.896 . . . . 0.0 109.465 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 6.7 m80 -60.89 -47.93 84.14 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.214 -0.929 . . . . 0.0 109.439 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.441 ' HG2' ' H ' ' A' ' 106' ' ' LYS . 38.9 ttp180 -86.28 110.35 19.58 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.317 -0.864 . . . . 0.0 109.393 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.96 1.58 20.29 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.331 -0.855 . . . . 0.0 109.457 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.441 ' H ' ' HG2' ' A' ' 104' ' ' ARG . 85.5 tttt 51.8 70.9 0.5 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.283 -0.886 . . . . 0.0 109.48 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.403 ' C ' ' O ' ' A' ' 106' ' ' LYS . 2.7 p30 41.94 -158.99 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.667 -0.645 . . . . 0.0 110.173 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.403 ' N ' ' OD1' ' A' ' 107' ' ' ASP . 18.3 t70 -167.9 -31.99 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.267 -0.896 . . . . 0.0 109.509 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.446 ' O ' ' N ' ' A' ' 111' ' ' THR . 69.9 t80 -66.28 -19.48 65.83 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.243 -0.911 . . . . 0.0 109.466 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' PHE . . . . . 0.511 ' O ' ' CD2' ' A' ' 110' ' ' PHE . 75.1 t80 -70.57 52.27 0.14 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.311 -0.868 . . . . 0.0 109.465 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' THR . . . . . 0.446 ' N ' ' O ' ' A' ' 109' ' ' PHE . 42.9 m -165.11 81.42 0.35 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.258 -0.901 . . . . 0.0 109.475 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -64.05 130.96 46.08 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.327 -0.858 . . . . 0.0 109.465 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 93.5 p -70.14 -65.01 0.78 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.219 -0.925 . . . . 0.0 109.453 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 49.7 m -62.48 147.02 50.07 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.255 -0.903 . . . . 0.0 109.5 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 7.1 m-70 -67.41 174.59 3.25 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.245 -0.91 . . . . 0.0 109.515 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -67.23 -73.51 0.14 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.247 -0.908 . . . . 0.0 109.475 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -68.04 75.71 0.22 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.258 -0.902 . . . . 0.0 109.478 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -74.08 -21.26 59.99 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.238 -0.914 . . . . 0.0 109.504 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 69.23 94.87 0.05 OUTLIER Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -67.46 118.89 11.4 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.283 -1.128 . . . . 0.0 109.459 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 69.9 p -68.18 -158.23 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.233 -0.917 . . . . 0.0 109.479 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -175.87 -45.27 0.06 OUTLIER Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.578 ' N ' HD12 ' A' ' 123' ' ' LEU . 7.7 mp -76.3 129.59 36.87 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.213 -1.169 . . . . 0.0 109.264 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.524 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -70.05 162.37 69.31 Favored Pre-proline 0 N--CA 1.49 1.535 0 O-C-N 121.172 -0.955 . . . . 0.0 108.759 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.524 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 2.1 Cg_endo -56.47 114.16 1.78 Allowed 'Trans proline' 0 C--N 1.32 -0.963 0 C-N-CA 121.344 1.363 . . . . 0.0 109.763 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -66.41 148.82 51.32 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.223 -0.923 . . . . 0.0 109.468 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -81.55 10.61 5.63 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.227 -0.921 . . . . 0.0 109.408 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -76.41 -71.67 0.38 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.242 -0.911 . . . . 0.0 109.46 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -67.31 -166.53 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.239 -0.913 . . . . 0.0 109.436 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 13.9 mt 54.37 -177.37 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.269 -0.894 . . . . 0.0 109.438 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 171.04 88.83 0.07 OUTLIER Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.581 -1.407 . . . . 0.0 109.581 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 22.6 tp10 -168.82 -75.05 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.222 -1.164 . . . . 0.0 109.49 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 45.6 t -72.72 139.31 47.12 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.208 -0.933 . . . . 0.0 109.452 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 177.34 138.44 3.0 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' SER . . . . . 0.428 ' O ' ' N ' ' A' ' 137' ' ' SER . 87.6 p -170.0 33.26 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.272 -1.134 . . . . 0.0 109.45 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.465 ' O ' ' N ' ' A' ' 138' ' ' SER . 88.5 p -69.99 54.3 0.13 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.283 -0.886 . . . . 0.0 109.478 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' SER . . . . . 0.428 ' N ' ' O ' ' A' ' 135' ' ' SER . 52.5 m -69.61 55.61 0.12 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.283 -0.886 . . . . 0.0 109.526 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.465 ' N ' ' O ' ' A' ' 136' ' ' SER . 92.1 p -66.95 114.77 6.01 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.323 -0.86 . . . . 0.0 109.537 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 61.8 mttm -70.47 58.37 0.19 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.247 -0.908 . . . . 0.0 109.45 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 2.8 t -61.99 159.04 15.0 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.2 -0.937 . . . . 0.0 109.474 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' SER . . . . . 0.402 ' O ' ' OG1' ' A' ' 142' ' ' THR . 60.3 m -74.62 -39.32 62.2 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.273 -0.892 . . . . 0.0 109.444 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 142' ' ' THR . . . . . 0.519 ' O ' ' CG ' ' A' ' 143' ' ' HIS . 90.0 m -165.58 -77.62 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.287 -0.883 . . . . 0.0 109.449 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 143' ' ' HIS . . . . . 0.519 ' CG ' ' O ' ' A' ' 142' ' ' THR . 43.6 m80 -158.22 149.98 21.52 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.242 -0.911 . . . . 0.0 109.472 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 50.8 m -71.14 79.19 0.69 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.25 -0.906 . . . . 0.0 109.492 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -67.53 82.26 0.17 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.259 -0.9 . . . . 0.0 109.479 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' GLN . . . . . 0.457 ' C ' ' H ' ' A' ' 148' ' ' VAL . 49.4 tt0 -168.44 -65.44 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.19 -0.943 . . . . 0.0 109.439 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 147' ' ' PHE . . . . . 0.519 ' CD2' ' O ' ' A' ' 147' ' ' PHE . 80.9 t80 -72.49 14.0 0.29 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.294 -0.879 . . . . 0.0 109.364 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 148' ' ' VAL . . . . . 0.457 ' H ' ' C ' ' A' ' 146' ' ' GLN . 44.0 t -148.07 -75.97 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.219 -0.925 . . . . 0.0 109.363 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 47.5 t -76.79 -178.94 5.1 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.269 -0.894 . . . . 0.0 109.509 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 13.3 t 51.86 17.19 0.6 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.269 -0.894 . . . . 0.0 109.477 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 151' ' ' SER . . . . . 0.418 ' OG ' ' N ' ' A' ' 152' ' ' THR . 78.6 p -71.35 -100.93 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.24 -0.913 . . . . 0.0 109.542 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 152' ' ' THR . . . . . 0.418 ' N ' ' OG ' ' A' ' 151' ' ' SER . 47.5 m -78.5 105.97 10.13 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.246 -0.909 . . . . 0.0 109.566 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 70.6 p -144.55 -12.6 0.59 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.311 -0.868 . . . . 0.0 109.39 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 21.7 t 51.08 80.68 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.182 -0.949 . . . . 0.0 109.47 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 44.2 m-20 50.87 -146.48 0.44 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.221 -0.925 . . . . 0.0 109.452 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 69.6 ttt180 -166.05 149.61 7.64 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.248 -0.907 . . . . 0.0 109.454 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 73.49 176.79 33.31 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -69.25 -106.43 0.03 OUTLIER Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 73.2 p -169.01 0.56 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.265 -1.138 . . . . 0.0 109.452 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -159.69 78.71 0.7 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.296 -0.878 . . . . 0.0 109.461 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 161' ' ' ILE . . . . . 0.474 ' O ' ' N ' ' A' ' 163' ' ' SER . 75.8 mt -72.97 -40.57 59.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.259 -0.901 . . . . 0.0 109.461 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -68.9 44.39 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.163 -0.961 . . . . 0.0 109.494 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 163' ' ' SER . . . . . 0.474 ' N ' ' O ' ' A' ' 161' ' ' ILE . 54.2 m -72.12 65.23 0.57 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.225 -0.922 . . . . 0.0 109.368 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.407 ' O ' ' O ' ' A' ' 163' ' ' SER . 62.5 mmtt 53.24 176.6 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.256 -0.903 . . . . 0.0 109.448 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 2.6 m80 -64.87 -58.64 5.64 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.261 -0.899 . . . . 0.0 109.548 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 117.901 -1.047 . . . . 0.0 109.419 -179.985 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.4 ptt? . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 178.1 16.24 0.03 OUTLIER Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 25.7 m -165.37 98.39 0.71 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.321 -1.105 . . . . 0.0 109.453 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.513 ' CD2' ' O ' ' A' ' 4' ' ' PHE . 12.2 p90 -70.18 102.92 2.2 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.309 -0.87 . . . . 0.0 109.525 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 69.5 mtm180 -83.68 7.15 18.45 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.244 -0.91 . . . . 0.0 109.522 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -60.64 143.0 55.0 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.209 -0.932 . . . . 0.0 109.44 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.438 ' CD ' ' N ' ' A' ' 7' ' ' GLU . 21.0 mp0 -72.82 141.73 48.01 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.217 -0.927 . . . . 0.0 109.489 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -66.1 142.4 43.02 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.8 m 50.57 81.71 0.06 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.296 -1.12 . . . . 0.0 109.388 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 10' ' ' VAL . 35.3 m -71.68 121.88 22.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.27 -0.894 . . . . 0.0 109.639 -179.851 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.7 m -161.08 126.86 3.8 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.177 -0.952 . . . . 0.0 109.45 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.1 t 54.17 -168.66 0.07 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.315 -0.866 . . . . 0.0 109.443 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 176.42 -67.61 0.09 OUTLIER Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.6 t -170.04 37.97 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.224 -1.162 . . . . 0.0 109.527 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.46 ' C ' ' H ' ' A' ' 17' ' ' GLU . 19.8 tptp -83.79 -24.07 31.2 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.282 -0.886 . . . . 0.0 109.441 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -66.95 5.96 0.58 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.235 -0.916 . . . . 0.0 109.488 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.46 ' H ' ' C ' ' A' ' 15' ' ' LYS . 58.1 mm-40 -62.89 -42.51 99.8 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.269 -0.895 . . . . 0.0 109.392 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -67.58 81.06 0.17 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.208 -0.932 . . . . 0.0 109.372 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.541 ' N ' ' ND1' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -76.74 -168.33 1.01 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.226 -0.921 . . . . 0.0 109.42 -179.923 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 85.4 m -71.36 105.28 3.46 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.205 -0.935 . . . . 0.0 109.494 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -82.91 -15.34 72.98 Favored Glycine 0 N--CA 1.492 2.382 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -45.86 142.1 2.73 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.277 -1.131 . . . . 0.0 109.724 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.581 ' N ' HD12 ' A' ' 23' ' ' LEU . 8.8 mp -80.98 72.95 8.03 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.315 -0.866 . . . . 0.0 109.15 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 29.7 m -74.04 141.32 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.262 -0.899 . . . . 0.0 109.465 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 70.4 p -149.98 89.34 1.59 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.235 -0.916 . . . . 0.0 109.289 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 47.0 m -78.46 149.21 33.27 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.283 -0.885 . . . . 0.0 109.47 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.419 ' CB ' ' NZ ' ' A' ' 27' ' ' LYS . 7.0 ttpm? -149.84 165.27 33.02 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.265 -0.897 . . . . 0.0 109.316 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 167.3 107.4 0.2 Allowed Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -79.31 124.17 28.15 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.168 -1.195 . . . . 0.0 109.301 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -90.73 148.86 22.3 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.241 -0.912 . . . . 0.0 109.652 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 53.05 86.34 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.375 -0.828 . . . . 0.0 109.807 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.588 ' N ' HD12 ' A' ' 32' ' ' LEU . 9.7 mp -84.18 -17.78 38.83 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.244 -0.91 . . . . 0.0 109.158 179.666 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 14.3 mt 50.3 11.07 0.06 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.31 -0.869 . . . . 0.0 109.548 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.475 ' H ' ' C ' ' A' ' 32' ' ' LEU . 96.5 mt -135.35 116.64 19.82 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.013 0 O-C-N 121.441 -0.787 . . . . 0.0 109.073 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -74.26 74.87 1.83 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.233 -0.917 . . . . 0.0 109.619 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.517 ' O ' ' N ' ' A' ' 38' ' ' LYS . 27.6 m120 -71.84 -179.55 2.73 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.279 -0.888 . . . . 0.0 109.39 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 80.3 mt-10 -62.69 75.78 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.262 -0.899 . . . . 0.0 109.43 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.517 ' N ' ' O ' ' A' ' 36' ' ' ASN . 7.3 tppt? -69.91 -28.95 66.03 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.315 -0.865 . . . . 0.0 109.472 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.435 ' O ' HG13 ' A' ' 39' ' ' VAL . 7.2 p -60.48 128.18 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 121.183 -0.948 . . . . 0.0 109.407 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 42.0 m -166.74 117.29 0.92 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.259 -0.901 . . . . 0.0 109.4 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 69.0 m -166.06 -12.38 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.292 -0.88 . . . . 0.0 109.431 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 62.08 -134.42 46.03 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -171.33 -35.47 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.257 -1.143 . . . . 0.0 109.263 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.433 ' O ' ' O ' ' A' ' 45' ' ' THR . 20.0 p 50.79 -143.12 0.64 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.405 -0.809 . . . . 0.0 109.341 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.513 ' O ' ' N ' ' A' ' 47' ' ' THR . 30.9 p 49.3 95.62 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.22 -0.925 . . . . 0.0 109.486 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.428 HG22 ' H ' ' A' ' 46' ' ' THR . 0.7 OUTLIER -65.06 68.47 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.222 -0.924 . . . . 0.0 109.565 -179.955 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.513 ' N ' ' O ' ' A' ' 45' ' ' THR . 65.8 p -68.16 -58.25 4.76 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.251 -0.906 . . . . 0.0 109.276 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 15.9 ptm180 -145.72 141.86 28.43 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.277 -0.89 . . . . 0.0 109.194 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.427 ' O ' ' O ' ' A' ' 50' ' ' SER . 32.9 ttp180 -95.83 140.87 29.99 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.165 -0.959 . . . . 0.0 110.286 -179.614 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.427 ' O ' ' O ' ' A' ' 49' ' ' ARG . 11.9 m 53.45 171.36 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.338 -0.851 . . . . 0.0 110.206 179.358 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.448 ' SG ' ' N ' ' A' ' 52' ' ' SER . 6.2 p -58.88 -62.05 2.17 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.387 -0.821 . . . . 0.0 109.165 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.448 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 9.0 t -49.27 146.05 4.02 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.077 -1.015 . . . . 0.0 108.764 179.507 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -84.1 102.02 12.24 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 120.999 -1.063 . . . . 0.0 109.689 -179.47 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.603 HG13 ' O ' ' A' ' 54' ' ' VAL . 13.6 p -125.82 117.12 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 CA-C-O 121.576 0.703 . . . . 0.0 109.107 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 7.3 tp -128.36 138.4 54.75 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 49.0 m -128.07 113.31 15.62 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.35 -0.844 . . . . 0.0 109.518 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.54 ' H ' ' HB ' ' A' ' 69' ' ' THR . 5.5 mtmm -125.14 116.26 21.76 Favored 'General case' 0 N--CA 1.511 2.61 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 178.582 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.4 t -116.81 141.29 48.4 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.395 -0.816 . . . . 0.0 109.92 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 59' ' ' VAL . 2.8 m -132.31 120.8 44.29 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.16 0 O-C-N 121.554 -0.716 . . . . 0.0 109.311 179.067 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 32.0 p -110.16 133.36 53.3 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.836 -0.54 . . . . 0.0 109.841 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.429 ' OD1' ' N ' ' A' ' 62' ' ' ALA . 16.2 t-20 -137.55 172.18 13.36 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.367 -0.833 . . . . 0.0 109.734 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.429 ' N ' ' OD1' ' A' ' 61' ' ' ASN . . . -63.32 -39.96 96.0 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.85 -1.156 . . . . 0.0 112.621 -177.357 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 35.9 m-20 -68.8 6.04 0.97 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.445 -1.409 . . . . 0.0 109.929 -178.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.519 ' O ' ' N ' ' A' ' 66' ' ' THR . . . 89.22 8.69 68.28 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.865 -1.294 . . . . 0.0 109.865 179.286 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.418 ' O ' ' O ' ' A' ' 59' ' ' VAL . 12.8 tpt180 -64.09 79.94 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.35 0 O-C-N 120.728 -1.454 . . . . 0.0 108.139 179.306 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.519 ' N ' ' O ' ' A' ' 64' ' ' GLY . 72.9 p -112.2 72.32 0.77 Allowed 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 -179.69 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -94.79 128.33 41.43 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.341 -0.85 . . . . 0.0 109.775 -179.013 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.525 ' C ' ' H ' ' A' ' 70' ' ' LYS . 31.3 p -100.01 109.8 22.12 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.323 -0.861 . . . . 0.0 109.675 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.54 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 5.3 m -78.7 36.39 0.26 Allowed 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 178.503 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.525 ' H ' ' C ' ' A' ' 68' ' ' THR . 40.7 pttt -65.07 62.65 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 179.098 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.531 ' N ' ' O ' ' A' ' 69' ' ' THR . 45.8 mt-10 -85.36 139.91 31.19 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.097 -1.002 . . . . 0.0 110.07 -179.364 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.549 HG23 ' O ' ' A' ' 72' ' ' VAL . 16.2 m -128.41 124.14 61.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 21.6 t -126.04 117.41 48.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 CA-C-O 122.16 0.981 . . . . 0.0 109.077 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.419 ' O ' ' O ' ' A' ' 75' ' ' SER . 96.1 mttt -86.85 51.76 2.33 Favored 'General case' 0 C--N 1.29 -2.001 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.545 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.419 ' O ' ' O ' ' A' ' 74' ' ' LYS . 2.3 m 60.32 149.6 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.324 -0.86 . . . . 0.0 109.648 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -79.63 9.13 5.35 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.41 -0.806 . . . . 0.0 109.338 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -165.3 -36.07 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.21 -0.931 . . . . 0.0 109.854 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 69.56 55.81 9.4 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 42.7 t -65.65 -17.78 64.84 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.245 -1.15 . . . . 0.0 109.434 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -162.82 24.19 0.09 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.324 -0.86 . . . . 0.0 109.493 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.404 ' SG ' ' N ' ' A' ' 52' ' ' SER . 12.1 t -162.53 133.71 5.04 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.368 -0.833 . . . . 0.0 109.415 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 83.2 -24.16 5.65 Favored Glycine 0 N--CA 1.492 2.429 0 N-CA-C 109.469 -1.452 . . . . 0.0 109.469 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 29.3 t70 51.35 21.29 1.13 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.196 -1.179 . . . . 0.0 109.432 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -71.57 55.16 0.24 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.264 -0.898 . . . . 0.0 109.447 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -61.03 137.91 58.21 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.274 -0.891 . . . . 0.0 109.537 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -69.16 161.14 29.76 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.195 -0.94 . . . . 0.0 109.447 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.436 ' O ' ' O ' ' A' ' 88' ' ' TRP . 6.9 p-10 -169.9 91.99 0.21 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.228 -0.92 . . . . 0.0 109.406 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' TRP . . . . . 0.436 ' O ' ' O ' ' A' ' 87' ' ' ASP . 1.7 m0 61.26 137.48 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.431 -0.793 . . . . 0.0 109.7 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -168.28 -70.83 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.215 -0.928 . . . . 0.0 109.376 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -66.78 -95.74 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.279 -0.888 . . . . 0.0 109.424 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.1 m -159.03 51.65 0.38 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.181 -0.95 . . . . 0.0 109.305 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.568 ' N ' ' CD ' ' A' ' 93' ' ' PRO . 0.2 OUTLIER -79.26 -44.77 1.69 Allowed Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.291 -0.88 . . . . 0.0 110.658 -179.932 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.568 ' CD ' ' N ' ' A' ' 92' ' ' PHE . 6.3 Cg_exo -64.54 130.17 25.82 Favored 'Trans proline' 0 C--N 1.32 -0.954 0 C-N-CA 121.075 1.183 . . . . 0.0 110.164 -178.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 79.4 p -167.38 130.5 1.73 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.409 -0.807 . . . . 0.0 109.295 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.43 ' O ' ' O ' ' A' ' 96' ' ' GLY . 38.3 ttm180 -58.18 -91.84 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.24 -0.912 . . . . 0.0 109.537 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.43 ' O ' ' O ' ' A' ' 95' ' ' ARG . . . 51.45 97.71 0.01 OUTLIER Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.616 -1.394 . . . . 0.0 109.616 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 31.6 p-10 -170.84 121.22 0.56 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.217 -1.167 . . . . 0.0 109.605 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.59 ' N ' HD12 ' A' ' 98' ' ' LEU . 8.7 mp 50.07 70.38 0.51 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.178 -0.951 . . . . 0.0 109.353 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -158.5 121.28 3.74 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.233 -0.917 . . . . 0.0 109.466 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 -57.77 128.82 39.01 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.246 -0.909 . . . . 0.0 109.428 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -61.92 -17.26 56.16 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.181 -0.95 . . . . 0.0 109.494 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -70.32 143.97 51.85 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.17 -0.956 . . . . 0.0 108.915 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -60.72 -48.78 80.24 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.162 -0.961 . . . . 0.0 109.782 -179.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -168.54 110.15 0.54 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.221 -0.924 . . . . 0.0 109.425 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -169.34 71.3 0.07 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.262 -0.899 . . . . 0.0 109.312 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -68.04 -89.2 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.208 -0.933 . . . . 0.0 109.414 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -168.7 -140.7 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.245 -0.91 . . . . 0.0 109.413 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 22.4 p30 -171.71 63.91 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.119 -0.988 . . . . 0.0 109.5 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -66.43 -50.58 62.93 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.256 -0.902 . . . . 0.0 109.429 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -82.48 105.02 13.19 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.215 -0.928 . . . . 0.0 109.481 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 40.8 m -77.36 109.46 11.29 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.198 -0.939 . . . . 0.0 109.469 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.589 ' CG ' HH11 ' A' ' 112' ' ' ARG . 4.0 mtt-85 -72.92 111.57 8.16 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.233 -0.917 . . . . 0.0 109.492 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 95.2 p -67.46 102.16 1.09 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.264 -0.897 . . . . 0.0 109.486 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.525 ' O ' ' CG ' ' A' ' 115' ' ' HIS . 29.6 t -171.76 124.64 0.56 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.269 -0.894 . . . . 0.0 109.45 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' HIS . . . . . 0.525 ' CG ' ' O ' ' A' ' 114' ' ' SER . 88.8 m-70 -158.2 161.7 37.84 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.224 -0.923 . . . . 0.0 109.445 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -63.42 124.19 20.67 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.277 -0.89 . . . . 0.0 109.411 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -67.38 -28.42 67.92 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.219 -0.925 . . . . 0.0 109.539 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -62.19 -175.83 0.08 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.273 -0.892 . . . . 0.0 109.433 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.423 ' O ' ' N ' ' A' ' 121' ' ' THR . . . 71.7 3.07 53.67 Favored Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 50.35 -96.66 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.289 -1.124 . . . . 0.0 109.401 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.423 ' N ' ' O ' ' A' ' 119' ' ' GLY . 5.4 m 58.39 162.4 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.318 -0.864 . . . . 0.0 109.644 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 64.93 112.11 0.01 OUTLIER Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.678 -1.369 . . . . 0.0 109.678 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 14.8 mt -70.35 135.65 49.01 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.298 -1.119 . . . . 0.0 109.18 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -77.0 151.73 82.05 Favored Pre-proline 0 N--CA 1.49 1.534 0 O-C-N 121.109 -0.994 . . . . 0.0 108.985 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -59.85 -9.29 9.32 Favored 'Trans proline' 0 C--N 1.323 -0.798 0 C-N-CA 121.012 1.142 . . . . 0.0 109.675 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -49.17 165.01 0.06 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.238 -0.914 . . . . 0.0 109.841 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 36.8 p90 -171.93 165.29 6.38 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.496 -0.753 . . . . 0.0 109.511 179.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.37 100.21 1.32 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.261 -0.899 . . . . 0.0 109.438 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -77.82 147.91 34.99 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.294 -0.879 . . . . 0.0 109.396 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.586 ' N ' HD12 ' A' ' 130' ' ' LEU . 8.4 mp -64.81 -5.43 5.92 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.298 -0.876 . . . . 0.0 109.266 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -173.22 130.71 1.93 Allowed Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.611 -1.395 . . . . 0.0 109.611 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -63.13 162.39 11.8 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.295 -1.121 . . . . 0.0 109.419 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' SER . . . . . 0.42 ' C ' ' H ' ' A' ' 135' ' ' SER . 31.4 t -170.63 153.01 3.99 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.168 -0.957 . . . . 0.0 109.473 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 67.1 -3.41 4.19 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' SER . . . . . 0.42 ' H ' ' C ' ' A' ' 133' ' ' SER . 48.9 m -67.11 147.16 53.48 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.198 -1.178 . . . . 0.0 109.371 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 50.9 m -65.46 118.79 9.93 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.128 -0.982 . . . . 0.0 109.45 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 69.0 m -166.05 73.36 0.17 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.321 -0.862 . . . . 0.0 109.432 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 87.4 p -70.62 69.61 0.43 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.313 -0.867 . . . . 0.0 109.494 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 67.7 mmtt -68.66 99.23 0.97 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.223 -0.923 . . . . 0.0 109.318 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 74.6 p -68.31 -177.51 0.91 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.261 -0.9 . . . . 0.0 109.402 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 74.9 m -166.32 49.87 0.08 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.245 -0.909 . . . . 0.0 109.446 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 2.3 t -60.04 163.4 4.79 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.25 -0.906 . . . . 0.0 109.443 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 56.5 t-80 -66.49 99.24 0.55 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.221 -0.924 . . . . 0.0 109.465 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 43.5 t -65.48 114.43 4.86 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.291 -0.881 . . . . 0.0 109.492 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -65.79 137.8 57.49 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.214 -0.929 . . . . 0.0 109.455 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 53.18 86.5 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.258 -0.901 . . . . 0.0 109.452 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 44.3 p90 -61.12 164.64 4.97 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.137 -0.977 . . . . 0.0 109.473 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 43.1 t -148.2 116.36 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.289 -0.882 . . . . 0.0 109.284 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' SER . . . . . 0.449 ' O ' ' N ' ' A' ' 151' ' ' SER . 30.3 t -170.04 150.66 3.82 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.256 -0.902 . . . . 0.0 109.44 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 48.2 t -66.05 74.0 0.08 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.268 -0.895 . . . . 0.0 109.498 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 151' ' ' SER . . . . . 0.449 ' N ' ' O ' ' A' ' 149' ' ' SER . 67.4 m -165.95 64.16 0.11 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.269 -0.894 . . . . 0.0 109.514 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 62.5 p -75.26 -13.99 60.48 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.18 -0.95 . . . . 0.0 109.414 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 30.5 p 49.22 85.47 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.156 -0.965 . . . . 0.0 109.52 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 30.4 t -66.01 -12.27 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.281 -0.887 . . . . 0.0 109.425 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -157.44 127.0 6.04 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.284 -0.885 . . . . 0.0 109.329 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -65.05 -75.29 0.09 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.166 -0.959 . . . . 0.0 109.371 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 172.26 16.68 0.02 OUTLIER Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -171.71 -83.78 0.06 OUTLIER Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.606 -1.397 . . . . 0.0 109.606 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 159' ' ' SER . . . . . 0.532 ' O ' ' N ' ' A' ' 161' ' ' ILE . 9.4 m 52.84 53.16 12.56 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.303 -1.116 . . . . 0.0 109.407 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.447 ' O ' ' O ' ' A' ' 161' ' ' ILE . . . -57.29 82.08 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.394 -0.816 . . . . 0.0 109.881 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 161' ' ' ILE . . . . . 0.601 HG22 ' N ' ' A' ' 162' ' ' GLU . 77.9 mt -42.66 167.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.58 -0.7 . . . . 0.0 110.251 -179.581 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.601 ' N ' HG22 ' A' ' 161' ' ' ILE . 66.0 mt-10 -149.81 126.56 11.04 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.229 -0.919 . . . . 0.0 109.435 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 94.2 p -69.97 142.73 52.81 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.268 -0.895 . . . . 0.0 109.456 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 17.2 ttmm -68.56 -38.46 80.77 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.28 -0.887 . . . . 0.0 109.403 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 165' ' ' HIS . . . . . 0.601 ' ND1' ' N ' ' A' ' 166' ' ' PHE . 50.1 t-80 51.37 -102.59 0.12 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.242 -0.911 . . . . 0.0 109.399 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 166' ' ' PHE . . . . . 0.601 ' N ' ' ND1' ' A' ' 165' ' ' HIS . 51.7 p90 . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 118.003 -0.999 . . . . 0.0 109.409 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.5 mtp . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.452 ' C ' ' H ' ' A' ' 4' ' ' PHE . . . -179.44 161.65 27.83 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 72.0 p -76.04 27.38 0.12 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.232 -1.158 . . . . 0.0 109.41 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.452 ' H ' ' C ' ' A' ' 2' ' ' GLY . 62.2 t80 -75.45 104.17 5.9 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.228 -0.92 . . . . 0.0 109.46 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -167.87 152.31 6.52 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.209 -0.932 . . . . 0.0 109.488 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -90.79 84.5 5.84 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.322 -0.861 . . . . 0.0 109.342 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -67.32 -76.45 0.08 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.18 -0.95 . . . . 0.0 109.457 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 159.62 167.01 19.66 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.44 ' O ' ' N ' ' A' ' 11' ' ' SER . 78.0 p -171.71 -6.95 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.257 -1.143 . . . . 0.0 109.492 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.43 ' H ' HG22 ' A' ' 10' ' ' VAL . 15.6 m -69.8 51.98 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.236 -0.915 . . . . 0.0 109.419 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.44 ' N ' ' O ' ' A' ' 9' ' ' SER . 92.1 p -166.04 -157.5 0.3 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.193 -0.942 . . . . 0.0 109.47 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.2 t -168.32 -63.64 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.224 -0.922 . . . . 0.0 109.469 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -171.92 151.41 14.89 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 49.4 m -57.33 -18.99 19.7 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.274 -1.133 . . . . 0.0 109.514 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 20.9 pttp -55.55 147.7 17.37 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.308 -0.87 . . . . 0.0 109.485 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 27.1 mm100 -63.32 152.49 37.74 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.271 -0.893 . . . . 0.0 109.469 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -72.53 -32.29 65.99 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.227 -0.921 . . . . 0.0 109.472 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.452 ' CD2' ' O ' ' A' ' 19' ' ' HIS . 81.0 t80 -169.35 137.04 1.82 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.3 -0.875 . . . . 0.0 109.435 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.452 ' O ' ' CD2' ' A' ' 18' ' ' PHE . 55.8 m80 -59.95 146.56 41.99 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.311 -0.868 . . . . 0.0 109.405 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.9 m 53.08 92.94 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.237 -0.914 . . . . 0.0 109.453 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 175.51 124.88 0.83 Allowed Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -152.26 147.07 25.93 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.197 -1.178 . . . . 0.0 109.528 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.439 HD23 ' C ' ' A' ' 23' ' ' LEU . 1.9 tt 57.47 83.83 0.1 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.33 -0.856 . . . . 0.0 109.149 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.4 t -149.85 90.94 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.144 -0.972 . . . . 0.0 109.271 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.8 t -56.9 159.84 3.86 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.29 -0.881 . . . . 0.0 109.434 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 50.8 m -163.5 -12.53 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.204 -0.935 . . . . 0.0 109.481 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.419 ' O ' ' N ' ' A' ' 29' ' ' ASP . 24.6 mtpp -51.21 123.12 8.83 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.215 -0.928 . . . . 0.0 109.545 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -68.71 68.77 0.42 Allowed Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 27' ' ' LYS . 2.0 p30 -79.85 -163.95 0.6 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.308 -1.113 . . . . 0.0 109.45 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.423 ' O ' ' OE2' ' A' ' 31' ' ' GLU . 60.5 tttp -170.46 76.87 0.08 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.31 -0.869 . . . . 0.0 109.439 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.423 ' OE2' ' O ' ' A' ' 30' ' ' LYS . 57.8 mm-40 -137.93 -41.65 0.53 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.409 -0.807 . . . . 0.0 109.206 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.582 ' N ' HD12 ' A' ' 32' ' ' LEU . 8.4 mp -75.79 -24.41 55.96 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.277 -0.89 . . . . 0.0 109.346 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.574 ' N ' HD12 ' A' ' 33' ' ' LEU . 8.4 mp -84.93 85.39 7.48 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.209 -0.932 . . . . 0.0 109.115 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 19.8 pt -75.2 155.66 6.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.241 -0.912 . . . . 0.0 109.524 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.462 ' OD1' ' N ' ' A' ' 35' ' ' ASP . 17.1 p-10 -159.7 65.35 0.37 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.228 -0.92 . . . . 0.0 109.485 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -157.95 -83.79 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.275 -0.89 . . . . 0.0 109.42 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.434 ' O ' ' O ' ' A' ' 38' ' ' LYS . 24.5 tt0 59.92 19.56 8.57 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.343 -0.848 . . . . 0.0 109.36 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.434 ' O ' ' O ' ' A' ' 37' ' ' GLU . 69.6 mttt 58.38 113.7 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.288 -0.882 . . . . 0.0 109.742 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 26.8 m -53.51 176.43 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.238 -0.914 . . . . 0.0 109.446 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.535 HG22 ' N ' ' A' ' 41' ' ' SER . 53.8 m -69.4 165.42 20.84 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.26 -0.9 . . . . 0.0 109.42 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.535 ' N ' HG22 ' A' ' 40' ' ' THR . 51.6 m -157.33 -51.9 0.07 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.213 -0.93 . . . . 0.0 109.382 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 179.17 68.08 0.07 OUTLIER Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 59.3 t-80 -74.66 81.53 2.04 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.252 -1.146 . . . . 0.0 109.508 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 14.6 p 51.37 -167.93 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.18 -0.95 . . . . 0.0 109.488 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 77.4 p -68.93 99.64 1.09 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.259 -0.9 . . . . 0.0 109.428 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 57.4 p -65.98 -124.58 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.148 -0.97 . . . . 0.0 109.505 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 67.3 p -101.27 57.52 0.86 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.372 -0.83 . . . . 0.0 109.447 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -146.07 142.79 28.9 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.181 -0.949 . . . . 0.0 109.495 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -94.87 144.42 25.67 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.235 -0.916 . . . . 0.0 109.654 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.2 m 67.86 169.78 0.27 Allowed 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.472 -0.767 . . . . 0.0 110.194 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.444 ' O ' ' O ' ' A' ' 52' ' ' SER . 1.6 m -56.91 -65.15 0.66 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.267 -0.895 . . . . 0.0 109.431 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.553 ' OG ' ' N ' ' A' ' 53' ' ' LYS . 12.7 t -58.64 -157.37 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.553 ' N ' ' OG ' ' A' ' 52' ' ' SER . 89.2 tttt -122.42 100.47 6.96 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.145 -0.972 . . . . 0.0 108.612 179.02 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.588 HG13 ' O ' ' A' ' 54' ' ' VAL . 11.3 p -126.65 120.37 55.92 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.709 -0.619 . . . . 0.0 109.58 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 2.3 pt -126.4 134.15 67.06 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.53 -0.731 . . . . 0.0 109.037 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 46.8 p -132.42 114.51 14.43 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.404 -0.81 . . . . 0.0 109.384 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.569 ' H ' ' HB ' ' A' ' 69' ' ' THR . 22.1 mttt -121.47 113.06 19.3 Favored 'General case' 0 N--CA 1.513 2.686 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.664 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 29.7 p -119.76 138.29 53.42 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.638 -0.664 . . . . 0.0 109.934 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.403 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.9 m -131.47 125.69 56.93 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.135 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.849 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 48.7 p -107.77 110.39 22.19 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.7 -0.625 . . . . 0.0 110.373 -179.027 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.44 ' N ' ' ND2' ' A' ' 61' ' ' ASN . 1.0 OUTLIER -100.24 144.08 29.68 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.354 -0.841 . . . . 0.0 108.769 179.395 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.445 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -67.03 -32.64 73.99 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 120.047 -1.658 . . . . 0.0 112.908 -177.425 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -65.74 4.28 0.63 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.291 -1.505 . . . . 0.0 110.006 -178.21 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.445 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 95.64 6.47 59.56 Favored Glycine 0 N--CA 1.496 2.693 0 N-CA-C 110.778 -0.929 . . . . 0.0 110.778 178.405 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 60.1 ttt180 -92.94 112.31 24.23 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.677 -1.484 . . . . 0.0 107.794 178.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.5 p -138.73 113.89 9.44 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.227 -0.921 . . . . 0.0 109.769 -178.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -99.83 130.23 46.0 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.319 -0.863 . . . . 0.0 109.993 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -107.07 108.93 20.66 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.586 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.569 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 4.5 m -96.31 28.7 3.14 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 107.531 -1.285 . . . . 0.0 107.531 179.087 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.1 pttp -64.81 67.74 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.515 ' N ' ' O ' ' A' ' 69' ' ' THR . 50.8 mt-10 -104.26 157.09 17.37 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.312 -0.868 . . . . 0.0 110.046 -179.239 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.468 ' O ' HG13 ' A' ' 72' ' ' VAL . 7.4 p -128.16 125.42 64.34 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.437 ' O ' ' O ' ' A' ' 53' ' ' LYS . 79.0 t -107.19 135.44 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 CA-C-O 121.922 0.868 . . . . 0.0 109.434 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 65.1 tttt 69.9 -137.27 0.06 Allowed 'General case' 0 N--CA 1.505 2.301 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.399 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 2.7 t 52.28 71.36 0.47 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.284 -0.885 . . . . 0.0 109.28 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 62.5 mm-40 -121.06 18.02 11.65 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.58 -0.7 . . . . 0.0 109.201 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -171.22 29.04 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.257 -0.902 . . . . 0.0 109.437 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.549 ' O ' ' N ' ' A' ' 80' ' ' ASP . . . -150.47 -42.25 0.03 OUTLIER Glycine 0 N--CA 1.492 2.43 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 70.8 m 51.67 -89.48 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.38 -1.071 . . . . 0.0 108.899 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.549 ' N ' ' O ' ' A' ' 78' ' ' GLY . 59.6 t0 -83.68 42.73 0.86 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.294 -0.879 . . . . 0.0 109.085 179.315 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.512 ' O ' ' N ' ' A' ' 83' ' ' ASP . 6.8 m 50.1 60.89 3.5 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.138 -0.976 . . . . 0.0 108.845 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 49.8 8.06 0.12 Allowed Glycine 0 N--CA 1.49 2.291 0 N-CA-C 110.131 -1.188 . . . . 0.0 110.131 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.512 ' N ' ' O ' ' A' ' 81' ' ' CYS . 8.3 m-20 -105.97 -156.92 0.59 Allowed 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.213 -1.169 . . . . 0.0 109.435 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -171.13 -156.39 0.12 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.371 -0.83 . . . . 0.0 109.31 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -169.43 126.55 0.92 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.306 -0.871 . . . . 0.0 109.455 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 66.9 t80 52.28 92.72 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.27 -0.894 . . . . 0.0 109.399 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -51.34 143.42 11.52 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.248 -0.908 . . . . 0.0 109.513 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 6.2 m-90 -58.9 -56.41 22.64 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.196 -0.94 . . . . 0.0 109.467 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.563 ' CG ' ' H ' ' A' ' 90' ' ' HIS . 54.9 t-80 -58.54 179.12 0.09 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.297 -0.877 . . . . 0.0 109.345 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.563 ' H ' ' CG ' ' A' ' 89' ' ' HIS . 2.1 p80 -166.64 143.93 4.97 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.205 -0.934 . . . . 0.0 109.636 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.445 ' OG1' ' N ' ' A' ' 92' ' ' PHE . 82.7 p -48.59 -84.23 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.251 -0.906 . . . . 0.0 109.505 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.445 ' N ' ' OG1' ' A' ' 91' ' ' THR . 84.6 t80 51.43 68.12 3.58 Favored Pre-proline 0 N--CA 1.491 1.594 0 O-C-N 121.239 -0.913 . . . . 0.0 109.607 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -62.14 146.18 96.14 Favored 'Trans proline' 0 C--N 1.317 -1.121 0 C-N-CA 121.429 1.42 . . . . 0.0 109.805 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 31.0 t -172.26 67.96 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.267 -0.896 . . . . 0.0 109.409 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 20.9 tpt180 -61.18 -19.79 61.99 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.338 -0.851 . . . . 0.0 109.289 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.464 ' O ' ' N ' ' A' ' 98' ' ' LEU . . . -165.05 -59.29 0.02 OUTLIER Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.584 -1.407 . . . . 0.0 109.584 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.469 ' O ' ' N ' ' A' ' 99' ' ' ASP . 13.8 m-20 51.01 -93.91 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.267 -1.137 . . . . 0.0 109.509 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.464 ' N ' ' O ' ' A' ' 96' ' ' GLY . 55.5 tp -63.82 78.69 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.256 -0.903 . . . . 0.0 109.286 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.469 ' N ' ' O ' ' A' ' 97' ' ' ASN . 22.5 m-20 -74.85 53.72 0.6 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.301 -0.874 . . . . 0.0 109.45 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -78.74 -3.67 45.46 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.301 -0.874 . . . . 0.0 109.352 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.419 ' O ' ' N ' ' A' ' 103' ' ' HIS . 57.0 t80 -66.36 -55.72 14.55 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.279 -0.888 . . . . 0.0 109.525 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -59.03 88.91 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.174 -0.954 . . . . 0.0 109.432 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.465 ' O ' ' ND1' ' A' ' 103' ' ' HIS . 0.8 OUTLIER -71.22 -26.09 62.78 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.162 -0.961 . . . . 0.0 109.284 179.981 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.416 ' O ' ' O ' ' A' ' 103' ' ' HIS . 44.3 mtp180 50.99 -178.96 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.304 -0.872 . . . . 0.0 109.495 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -157.98 4.63 0.12 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.289 -0.882 . . . . 0.0 109.384 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.429 ' C ' ' H ' ' A' ' 108' ' ' ASP . 58.8 mttp -59.53 -21.43 60.21 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.26 -0.9 . . . . 0.0 109.472 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -66.65 3.17 1.07 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.234 -0.916 . . . . 0.0 109.438 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.429 ' H ' ' C ' ' A' ' 106' ' ' LYS . 15.2 t70 -64.32 125.87 25.97 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.168 -0.957 . . . . 0.0 109.491 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -74.28 0.71 13.4 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.26 -0.9 . . . . 0.0 109.496 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 75.6 t80 51.57 91.57 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.235 -0.915 . . . . 0.0 109.431 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 67.1 p -72.84 165.56 24.66 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.216 -0.928 . . . . 0.0 109.502 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.585 ' CG ' HH11 ' A' ' 112' ' ' ARG . 0.0 OUTLIER -169.38 138.77 2.04 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.274 -0.891 . . . . 0.0 109.506 -179.995 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 61.2 p -168.69 81.22 0.15 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.296 -0.877 . . . . 0.0 109.505 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 50.7 m -62.09 162.28 9.67 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.242 -0.911 . . . . 0.0 109.384 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 25.1 m-70 -60.19 108.87 0.85 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.253 -0.904 . . . . 0.0 109.434 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -56.36 -58.74 6.73 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.319 -0.863 . . . . 0.0 109.43 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -61.15 -74.22 0.08 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.232 -0.918 . . . . 0.0 109.521 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.455 ' N ' ' OD1' ' A' ' 118' ' ' ASP . 1.5 m-20 -72.52 -137.51 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.182 -0.949 . . . . 0.0 109.485 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 69.49 138.9 0.11 Allowed Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -71.53 -179.51 2.57 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.237 -1.155 . . . . 0.0 109.461 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.424 ' O ' ' N ' ' A' ' 123' ' ' LEU . 71.4 p -73.98 2.48 8.6 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.279 -0.888 . . . . 0.0 109.571 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 61.49 -85.57 0.03 OUTLIER Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.384 -1.486 . . . . 0.0 109.384 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.424 ' N ' ' O ' ' A' ' 121' ' ' THR . 24.7 mt -64.03 143.09 58.13 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.187 -1.184 . . . . 0.0 109.076 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.533 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -81.14 163.0 57.29 Favored Pre-proline 0 N--CA 1.492 1.626 0 O-C-N 121.17 -0.956 . . . . 0.0 108.87 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.533 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 1.1 Cg_endo -58.28 1.67 0.24 Allowed 'Trans proline' 0 C--N 1.319 -0.986 0 C-N-CA 121.414 1.409 . . . . 0.0 110.203 179.523 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.532 ' O ' ' CG ' ' A' ' 127' ' ' PHE . 74.4 mt-10 52.4 -100.56 0.1 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.183 -0.948 . . . . 0.0 109.489 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' PHE . . . . . 0.532 ' CG ' ' O ' ' A' ' 126' ' ' GLU . 97.4 m-85 -157.9 75.47 0.76 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.199 -0.938 . . . . 0.0 109.347 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -168.67 -156.99 0.18 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.241 -0.912 . . . . 0.0 109.511 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -167.96 -11.89 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.298 -0.876 . . . . 0.0 109.399 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 10.8 tp 53.41 95.48 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.187 -0.945 . . . . 0.0 109.381 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -177.11 -45.53 0.06 OUTLIER Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 53.92 67.76 0.96 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.228 -1.16 . . . . 0.0 109.453 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 40.0 t -70.81 166.17 21.59 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.2 -0.937 . . . . 0.0 109.538 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 64.14 89.08 0.04 OUTLIER Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.566 -1.413 . . . . 0.0 109.566 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' SER . . . . . 0.412 ' OG ' ' N ' ' A' ' 136' ' ' SER . 41.2 t -68.16 -149.89 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.302 -1.116 . . . . 0.0 109.444 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.427 ' O ' ' N ' ' A' ' 138' ' ' SER . 87.7 p -169.66 -28.82 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.236 -0.915 . . . . 0.0 109.508 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 51.8 m -68.71 68.76 0.15 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.263 -0.898 . . . . 0.0 109.476 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.427 ' N ' ' O ' ' A' ' 136' ' ' SER . 72.9 m -166.47 -99.54 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.299 -0.876 . . . . 0.0 109.477 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -170.35 142.77 2.22 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.266 -0.896 . . . . 0.0 109.496 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 13.4 m -165.35 63.13 0.12 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.205 -0.934 . . . . 0.0 109.401 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 48.2 t -76.55 -28.22 56.2 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.237 -0.914 . . . . 0.0 109.536 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 1.4 t -170.12 158.41 6.93 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.242 -0.911 . . . . 0.0 109.376 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 75.8 m80 -65.92 -33.03 74.89 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.287 -0.883 . . . . 0.0 109.482 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 45.0 t -62.06 146.28 50.77 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.203 -0.935 . . . . 0.0 109.468 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -170.38 -13.39 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.257 -0.902 . . . . 0.0 109.418 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -67.95 78.78 0.22 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.254 -0.904 . . . . 0.0 109.431 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' PHE . . . . . 0.476 ' CD1' ' O ' ' A' ' 147' ' ' PHE . 40.6 p90 -73.32 134.37 44.13 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.328 -0.858 . . . . 0.0 109.427 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 33.2 t -76.17 138.99 19.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.256 -0.903 . . . . 0.0 109.494 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 26.1 t -172.4 22.59 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.263 -0.898 . . . . 0.0 109.413 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 49.9 m -71.18 -58.78 3.22 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.307 -0.87 . . . . 0.0 109.465 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 48.3 t -64.12 134.92 55.81 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.216 -0.927 . . . . 0.0 109.501 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 47.1 p -69.67 -145.54 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.181 -0.95 . . . . 0.0 109.488 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 61.3 p -98.74 -141.68 0.31 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.293 -0.879 . . . . 0.0 109.15 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 23.0 t -65.91 -63.39 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.25 -0.907 . . . . 0.0 109.261 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 2.0 m120 56.2 -114.36 0.84 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.423 -0.798 . . . . 0.0 109.462 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -74.91 -103.35 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.13 -0.981 . . . . 0.0 109.446 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -172.01 -93.59 0.09 OUTLIER Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -169.82 85.52 0.09 OUTLIER Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 44.9 t 50.88 -104.22 0.16 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.321 -1.105 . . . . 0.0 109.498 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . 53.29 53.14 12.25 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.283 -0.886 . . . . 0.0 109.426 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 161' ' ' ILE . . . . . 0.4 HG23 ' N ' ' A' ' 162' ' ' GLU . 6.8 tp -72.12 -35.32 52.92 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.268 -0.895 . . . . 0.0 109.248 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.4 ' N ' HG23 ' A' ' 161' ' ' ILE . 65.1 mm-40 51.7 76.58 0.17 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.285 -0.884 . . . . 0.0 109.447 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 52.0 m -165.69 113.1 0.94 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.26 -0.9 . . . . 0.0 109.397 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 15.3 tptp -69.1 -46.38 67.85 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.218 -0.926 . . . . 0.0 109.388 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 165' ' ' HIS . . . . . 0.524 ' O ' ' CG ' ' A' ' 166' ' ' PHE . 3.5 m-70 -62.7 -80.0 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.247 -0.908 . . . . 0.0 109.509 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 166' ' ' PHE . . . . . 0.524 ' CG ' ' O ' ' A' ' 165' ' ' HIS . 97.8 m-85 . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 118.034 -0.984 . . . . 0.0 109.397 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.7 mtt . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.424 ' O ' ' O ' ' A' ' 3' ' ' THR . . . 178.42 -135.71 2.73 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.424 ' O ' ' O ' ' A' ' 2' ' ' GLY . 11.9 m 55.29 103.47 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.249 -1.148 . . . . 0.0 109.53 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -158.33 -4.74 0.08 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.278 -0.889 . . . . 0.0 109.518 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.415 ' HG3' HH11 ' A' ' 5' ' ' ARG . 27.3 ttm-85 -65.75 -19.31 65.85 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.338 -0.851 . . . . 0.0 109.415 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -74.46 79.34 1.92 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.313 -0.867 . . . . 0.0 109.372 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -59.92 -38.62 82.85 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.258 -0.901 . . . . 0.0 109.462 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 64.69 53.49 34.52 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.6 t -171.28 146.4 2.33 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.258 -1.142 . . . . 0.0 109.474 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.8 p -168.62 136.49 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.301 -0.875 . . . . 0.0 109.48 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 43.6 t -77.54 133.15 38.58 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.197 -0.939 . . . . 0.0 109.473 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.3 t -71.64 -8.02 51.45 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.24 -0.912 . . . . 0.0 109.46 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 69.08 17.84 72.28 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.445 -1.462 . . . . 0.0 109.445 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.9 t -66.42 -177.13 0.51 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.244 -1.151 . . . . 0.0 109.406 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 77.5 tttt 56.37 -124.38 1.89 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.192 -0.943 . . . . 0.0 109.262 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 51.4 52.6 14.43 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.086 -1.009 . . . . 0.0 109.436 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.427 ' O ' ' O ' ' A' ' 18' ' ' PHE . 72.2 mm-40 -72.06 -27.77 62.9 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.283 -0.885 . . . . 0.0 109.565 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.427 ' O ' ' O ' ' A' ' 17' ' ' GLU . 40.8 t80 59.33 150.01 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.556 -0.715 . . . . 0.0 109.739 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 51.8 m80 -78.83 163.92 24.92 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.275 -0.89 . . . . 0.0 109.51 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 6.3 t -73.32 -11.12 60.38 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.225 -0.922 . . . . 0.0 109.427 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -170.15 173.89 44.2 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -70.91 153.6 42.55 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.231 -1.158 . . . . 0.0 109.46 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 18.0 mt -140.35 -172.25 3.39 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.391 -0.818 . . . . 0.0 109.156 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 34.6 t -64.19 101.94 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.269 -0.894 . . . . 0.0 109.481 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 37.8 m -165.33 111.02 0.91 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.253 -0.904 . . . . 0.0 109.52 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.434 ' C ' ' H ' ' A' ' 28' ' ' GLY . 76.9 p -81.11 116.54 21.08 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.27 -0.894 . . . . 0.0 109.389 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -75.43 36.6 0.13 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.333 -0.854 . . . . 0.0 109.636 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.459 ' C ' ' H ' ' A' ' 30' ' ' LYS . . . 76.89 150.92 3.85 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.537 -1.425 . . . . 0.0 109.537 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.27 28.35 0.12 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.177 -1.19 . . . . 0.0 109.457 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.459 ' H ' ' C ' ' A' ' 28' ' ' GLY . 96.1 mttt -62.26 127.22 30.34 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.287 -0.883 . . . . 0.0 109.403 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -167.59 -153.16 0.13 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.195 -0.941 . . . . 0.0 109.095 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.508 ' N ' HD12 ' A' ' 32' ' ' LEU . 11.0 mp -86.21 8.67 20.22 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.093 -1.004 . . . . 0.0 109.168 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.571 ' N ' HD12 ' A' ' 33' ' ' LEU . 8.8 mp 52.07 99.86 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.269 -0.894 . . . . 0.0 109.376 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.426 ' O ' ' O ' ' A' ' 33' ' ' LEU . 20.3 pt -51.8 -178.46 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.193 -0.942 . . . . 0.0 109.424 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -157.33 -9.92 0.09 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.253 -0.904 . . . . 0.0 109.47 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.46 HD21 ' HE2' ' A' ' 38' ' ' LYS . 21.3 p30 -58.29 -18.82 29.68 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.218 -0.926 . . . . 0.0 109.426 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 18.2 tp10 49.01 65.13 1.46 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.302 -0.874 . . . . 0.0 109.603 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.46 ' HE2' HD21 ' A' ' 36' ' ' ASN . 59.9 mttm -75.0 162.43 28.58 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.227 -0.921 . . . . 0.0 109.453 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 30.2 m -58.94 139.17 19.03 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.154 -0.966 . . . . 0.0 109.505 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 4.6 m -69.46 -126.58 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.222 -0.924 . . . . 0.0 109.284 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 42.3 t -62.18 173.0 1.24 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.124 -0.985 . . . . 0.0 109.397 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -179.83 -17.14 0.03 OUTLIER Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.447 ' O ' ' CG ' ' A' ' 43' ' ' HIS . 26.6 p-80 -171.08 102.59 0.21 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.235 -1.156 . . . . 0.0 109.509 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 58.5 m -154.79 129.66 9.4 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.289 -0.882 . . . . 0.0 109.388 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 26.6 m 52.5 87.72 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.206 -0.934 . . . . 0.0 109.401 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 82.1 p -149.54 72.69 1.15 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.271 -0.893 . . . . 0.0 109.336 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 50.5 p -81.78 110.83 17.46 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.232 -0.917 . . . . 0.0 109.358 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 79.2 mtt180 -142.67 142.53 32.06 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.31 -0.869 . . . . 0.0 109.345 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -89.69 138.69 31.26 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.338 -0.851 . . . . 0.0 109.831 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.3 m 57.97 174.22 0.06 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.364 -0.835 . . . . 0.0 109.969 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 39.1 t -59.53 -75.4 0.06 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.347 -0.845 . . . . 0.0 109.511 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 3.0 t -47.17 141.12 4.66 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.204 -0.935 . . . . 0.0 109.191 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -73.92 103.51 4.46 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 120.998 -1.064 . . . . 0.0 109.599 -179.006 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.596 HG13 ' O ' ' A' ' 54' ' ' VAL . 10.7 p -126.57 118.08 49.99 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.776 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.545 HG23 ' O ' ' A' ' 55' ' ' ILE . 6.6 tt -126.99 122.45 60.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.531 -0.731 . . . . 0.0 109.125 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 17.9 m -129.21 111.86 13.33 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.437 -0.789 . . . . 0.0 109.671 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.526 ' H ' ' HB ' ' A' ' 69' ' ' THR . 31.1 mmtt -126.03 113.35 17.0 Favored 'General case' 0 N--CA 1.515 2.775 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 178.065 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 96.6 m -110.3 125.03 52.72 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.533 -0.729 . . . . 0.0 109.489 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.4 m -132.49 119.98 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.3 m -109.52 133.68 52.8 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.713 -0.617 . . . . 0.0 109.842 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -125.24 159.01 32.65 Favored 'General case' 0 N--CA 1.516 2.861 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.88 -33.96 68.78 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 120.538 -1.351 . . . . 0.0 112.477 -177.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.508 ' OD2' ' NH2' ' A' ' 65' ' ' ARG . 11.6 p30 -70.69 2.34 4.25 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.445 -1.409 . . . . 0.0 110.411 -178.417 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 98.32 1.07 58.09 Favored Glycine 0 N--CA 1.494 2.525 0 N-CA-C 109.629 -1.388 . . . . 0.0 109.629 179.592 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.508 ' NH2' ' OD2' ' A' ' 63' ' ' ASP . 1.3 mpp_? -76.8 85.55 3.4 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 178.543 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 93.4 m -122.18 93.35 3.96 Favored 'General case' 0 N--CA 1.492 1.665 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 -178.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -100.0 129.78 46.1 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.427 -0.796 . . . . 0.0 109.909 -179.153 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 40.1 p -106.04 109.76 21.81 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.413 -0.804 . . . . 0.0 109.609 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.526 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 3.5 m -88.95 30.5 0.93 Allowed 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 178.706 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.404 ' CB ' ' NZ ' ' A' ' 70' ' ' LYS . 0.3 OUTLIER -66.75 58.12 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 109.02 -0.734 . . . . 0.0 109.02 179.623 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.501 ' N ' ' O ' ' A' ' 69' ' ' THR . 79.8 mt-10 -101.07 141.45 33.94 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.221 -0.925 . . . . 0.0 109.833 -179.585 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.404 HG13 ' O ' ' A' ' 72' ' ' VAL . 7.7 p -128.17 131.53 69.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 15.7 t -129.87 116.05 36.13 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.942 0 CA-C-O 122.146 0.974 . . . . 0.0 109.418 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.39 174.72 2.55 Favored 'General case' 0 C--N 1.288 -2.067 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.42 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 75.8 m -64.91 -174.67 0.15 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.306 -0.871 . . . . 0.0 109.421 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -61.81 -62.98 1.42 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.275 -0.891 . . . . 0.0 109.306 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 18.3 p-10 -159.1 22.96 0.2 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.273 -0.892 . . . . 0.0 109.511 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 83.07 29.91 32.82 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.308 -1.517 . . . . 0.0 109.308 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 39.2 t -77.24 -25.0 51.12 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.317 -1.108 . . . . 0.0 109.388 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 44.5 m-20 -157.51 60.94 0.49 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.354 -0.841 . . . . 0.0 109.398 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 39.1 t -170.93 66.82 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.18 -0.95 . . . . 0.0 109.08 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 83.21 43.67 7.39 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.319 -1.513 . . . . 0.0 109.319 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.417 ' O ' ' OD1' ' A' ' 83' ' ' ASP . 19.6 p30 -66.3 81.34 0.09 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.281 -1.129 . . . . 0.0 109.535 -179.825 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -172.46 -174.04 1.13 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.295 -0.878 . . . . 0.0 109.435 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -59.47 141.07 55.57 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.312 -0.867 . . . . 0.0 109.34 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -168.83 -49.54 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.233 -0.917 . . . . 0.0 109.422 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 42.7 t0 52.49 -120.17 1.63 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.222 -0.924 . . . . 0.0 109.361 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 64.1 t-105 53.71 55.25 8.74 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.175 -0.953 . . . . 0.0 109.453 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.502 ' C ' ' H ' ' A' ' 91' ' ' THR . 0.7 OUTLIER -72.92 46.39 0.16 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.22 -0.925 . . . . 0.0 109.44 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.448 ' O ' ' ND1' ' A' ' 90' ' ' HIS . 0.8 OUTLIER 56.7 2.32 0.1 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.372 -0.83 . . . . 0.0 109.741 -179.875 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.502 ' H ' ' C ' ' A' ' 89' ' ' HIS . 2.6 m -52.61 164.37 0.35 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.228 -0.92 . . . . 0.0 109.217 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.501 ' N ' ' CD1' ' A' ' 92' ' ' PHE . 10.4 p90 -150.6 70.09 8.79 Favored Pre-proline 0 N--CA 1.494 1.756 0 O-C-N 121.206 -0.934 . . . . 0.0 109.559 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -63.97 120.56 7.96 Favored 'Trans proline' 0 C--N 1.316 -1.132 0 C-N-CA 121.519 1.479 . . . . 0.0 109.85 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 30.9 t -171.86 18.59 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.209 -0.932 . . . . 0.0 109.599 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 31.8 ptt180 -72.02 136.92 46.86 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.168 -0.958 . . . . 0.0 109.406 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.456 ' C ' ' H ' ' A' ' 98' ' ' LEU . . . 162.46 34.04 0.02 OUTLIER Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.381 -1.488 . . . . 0.0 109.381 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 12.1 p-10 -69.58 8.49 0.64 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.36 -1.082 . . . . 0.0 109.314 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.488 HD13 ' N ' ' A' ' 99' ' ' ASP . 0.3 OUTLIER -68.13 114.22 6.45 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.389 -0.819 . . . . 0.0 109.177 -179.964 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.488 ' N ' HD13 ' A' ' 98' ' ' LEU . 0.8 OUTLIER -49.1 -68.27 0.19 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.238 -0.914 . . . . 0.0 109.489 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.425 ' N ' ' OD1' ' A' ' 100' ' ' ASP . 26.1 p-10 -165.11 126.82 2.08 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.242 -0.911 . . . . 0.0 109.485 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.548 ' CD2' ' N ' ' A' ' 102' ' ' PHE . 24.3 p90 -77.35 -47.53 19.67 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.284 -0.885 . . . . 0.0 109.505 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.548 ' N ' ' CD2' ' A' ' 101' ' ' PHE . 65.0 t80 48.76 73.7 0.21 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.253 -0.905 . . . . 0.0 109.569 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 37.4 m80 -74.26 -23.23 59.1 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.165 -0.959 . . . . 0.0 109.361 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.422 ' O ' ' CE2' ' A' ' 102' ' ' PHE . 67.6 ttt180 -61.04 155.2 20.8 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.289 -0.882 . . . . 0.0 109.49 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -166.56 79.24 0.23 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.288 -0.882 . . . . 0.0 109.392 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -72.4 98.31 2.22 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.285 -0.884 . . . . 0.0 109.453 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.469 ' OD1' ' N ' ' A' ' 107' ' ' ASP . 1.4 m-20 51.68 -128.31 2.37 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.242 -0.911 . . . . 0.0 109.462 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -157.18 138.55 13.8 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.255 -0.903 . . . . 0.0 109.36 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -73.47 -29.9 62.82 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.317 -0.864 . . . . 0.0 109.532 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -56.13 108.62 0.48 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.287 -0.883 . . . . 0.0 109.51 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 76.6 p -69.5 -10.27 57.38 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.252 -0.905 . . . . 0.0 109.425 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.583 ' CG ' HH11 ' A' ' 112' ' ' ARG . 0.3 OUTLIER -56.85 -37.47 71.31 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.205 -0.934 . . . . 0.0 109.458 179.984 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.408 ' O ' ' OG ' ' A' ' 114' ' ' SER . 65.2 m -71.79 164.01 26.77 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.284 -0.885 . . . . 0.0 109.455 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.408 ' OG ' ' O ' ' A' ' 113' ' ' SER . 26.1 p 52.32 61.87 2.98 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.216 -0.928 . . . . 0.0 109.497 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' HIS . . . . . 0.461 ' C ' ' H ' ' A' ' 117' ' ' PHE . 2.3 t60 -168.49 -38.4 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.275 -0.89 . . . . 0.0 109.459 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.519 ' O ' ' CG ' ' A' ' 117' ' ' PHE . 19.7 mm-40 -75.77 28.16 0.11 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.323 -0.861 . . . . 0.0 109.467 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.519 ' CG ' ' O ' ' A' ' 116' ' ' GLU . 97.2 m-85 -158.19 114.2 2.75 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.192 -0.943 . . . . 0.0 109.462 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -68.51 62.63 0.1 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.243 -0.911 . . . . 0.0 109.365 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.448 ' N ' ' O ' ' A' ' 117' ' ' PHE . . . -70.78 -160.35 3.44 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.449 -1.46 . . . . 0.0 109.449 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 37.8 ttp180 52.43 85.92 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.274 -1.133 . . . . 0.0 109.416 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 82.6 p -68.75 86.12 0.32 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.219 -0.926 . . . . 0.0 109.557 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -63.82 -112.42 0.01 OUTLIER Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.588 ' N ' HD12 ' A' ' 123' ' ' LEU . 8.1 mp -67.02 127.46 32.65 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.249 -1.148 . . . . 0.0 109.265 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.543 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -73.69 162.49 73.94 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.208 -0.933 . . . . 0.0 108.764 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.543 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 2.5 Cg_endo -55.88 148.64 55.67 Favored 'Trans proline' 0 C--N 1.319 -0.989 0 C-N-CA 121.287 1.325 . . . . 0.0 109.707 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -139.9 110.22 6.6 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.303 -0.873 . . . . 0.0 109.421 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -135.92 110.77 8.75 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.42 -0.8 . . . . 0.0 109.389 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -71.28 95.41 1.3 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.268 -0.895 . . . . 0.0 109.367 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -68.02 117.68 10.2 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.228 -0.92 . . . . 0.0 109.534 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 13.5 mt 53.12 -160.37 0.12 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.314 -0.867 . . . . 0.0 109.587 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -176.09 164.48 34.49 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.589 -1.405 . . . . 0.0 109.589 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.413 ' O ' ' OG ' ' A' ' 133' ' ' SER . 64.3 mm-40 -62.91 -55.46 25.79 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.216 -1.167 . . . . 0.0 109.492 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' SER . . . . . 0.413 ' OG ' ' O ' ' A' ' 132' ' ' GLU . 27.6 p 52.13 62.8 2.51 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.227 -0.92 . . . . 0.0 109.488 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -175.53 67.34 0.09 OUTLIER Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 41.6 t -65.86 104.9 1.17 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.279 -1.13 . . . . 0.0 109.437 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.451 ' C ' ' H ' ' A' ' 138' ' ' SER . 41.7 t -65.11 -30.11 71.03 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.267 -0.895 . . . . 0.0 109.413 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 94.0 p -75.66 22.15 0.14 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.229 -0.919 . . . . 0.0 109.433 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.451 ' H ' ' C ' ' A' ' 136' ' ' SER . 69.2 m -165.57 82.85 0.33 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.243 -0.911 . . . . 0.0 109.469 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -170.46 76.88 0.08 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.269 -0.894 . . . . 0.0 109.455 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 73.3 p -67.89 85.86 0.23 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.259 -0.901 . . . . 0.0 109.479 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' SER . . . . . 0.423 ' O ' ' O ' ' A' ' 142' ' ' THR . 41.1 t -68.29 -70.85 0.24 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.295 -0.878 . . . . 0.0 109.476 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 142' ' ' THR . . . . . 0.423 ' O ' ' O ' ' A' ' 141' ' ' SER . 6.0 m 57.5 162.0 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.339 -0.85 . . . . 0.0 109.513 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 25.2 p80 -170.23 21.12 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.279 -0.888 . . . . 0.0 109.464 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 49.2 m -72.53 -0.35 12.51 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.298 -0.876 . . . . 0.0 109.418 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 91.3 mttt 52.49 55.47 9.05 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.265 -0.897 . . . . 0.0 109.418 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -65.08 -31.27 72.39 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.276 -0.89 . . . . 0.0 109.434 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -65.47 133.79 52.03 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.322 -0.861 . . . . 0.0 109.505 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 8.6 p -170.03 150.34 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.299 -0.876 . . . . 0.0 109.414 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 31.4 t -171.43 -106.87 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.23 -0.919 . . . . 0.0 109.391 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 26.8 p 50.6 34.87 10.36 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.224 -0.922 . . . . 0.0 109.533 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 30.6 t -169.23 86.24 0.15 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.314 -0.866 . . . . 0.0 109.289 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 26.9 m -62.0 -54.71 37.73 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.294 -0.879 . . . . 0.0 109.458 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' THR . . . . . 0.516 ' OG1' ' N ' ' A' ' 154' ' ' VAL . 4.3 t -172.98 -140.34 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.272 -0.892 . . . . 0.0 109.512 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.571 ' O ' ' ND2' ' A' ' 155' ' ' ASN . 11.5 m -145.53 161.01 12.44 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 O-C-N 121.303 -0.873 . . . . 0.0 109.035 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 155' ' ' ASN . . . . . 0.571 ' ND2' ' O ' ' A' ' 154' ' ' VAL . 0.7 OUTLIER 40.28 63.15 1.15 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.719 -0.613 . . . . 0.0 110.09 -179.817 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 94.0 mtt180 42.55 -125.64 0.71 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.554 -0.716 . . . . 0.0 110.044 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -148.5 -137.15 2.81 Favored Glycine 0 N--CA 1.494 2.533 0 N-CA-C 109.414 -1.475 . . . . 0.0 109.414 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 76.9 -133.51 13.59 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 33.8 t -165.45 -29.62 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.271 -1.135 . . . . 0.0 109.469 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -151.87 -19.91 0.19 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.284 -0.885 . . . . 0.0 109.37 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 18.8 tt -60.11 -8.08 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.222 -0.924 . . . . 0.0 109.373 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 55.4 tt0 -47.71 -70.75 0.08 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.29 -0.881 . . . . 0.0 109.679 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 87.8 p -168.49 -40.49 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.291 -0.88 . . . . 0.0 109.483 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -53.08 107.77 0.26 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.202 -0.936 . . . . 0.0 109.522 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 47.0 m80 -67.04 -48.28 68.82 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.205 -0.934 . . . . 0.0 109.491 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 52.1 t80 . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 118.041 -0.981 . . . . 0.0 109.492 -179.977 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.3 mtt . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 121.28 0.562 . . . . 0.0 109.525 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -67.0 143.19 42.9 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 61.6 p -67.59 -161.78 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.225 -1.162 . . . . 0.0 109.437 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -69.71 -109.64 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.227 -0.92 . . . . 0.0 109.483 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -170.99 -53.15 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.269 -0.895 . . . . 0.0 109.476 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.553 ' H ' ' CD ' ' A' ' 6' ' ' GLU . 13.5 mp0 -58.68 -41.79 87.02 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.242 -0.911 . . . . 0.0 109.514 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 57.4 mt-10 -66.13 158.91 27.39 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.286 -0.884 . . . . 0.0 109.412 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 70.89 121.83 0.05 OUTLIER Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.5 m 52.85 80.57 0.1 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.141 -1.211 . . . . 0.0 109.52 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.7 p -71.49 149.3 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.31 -0.869 . . . . 0.0 109.503 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 29.4 t -169.46 49.73 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.181 -0.95 . . . . 0.0 109.39 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 21.8 m -65.99 -144.64 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.221 -0.924 . . . . 0.0 109.317 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -169.09 -121.26 0.57 Allowed Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.8 t -60.88 142.65 56.08 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.266 -1.138 . . . . 0.0 109.46 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.429 ' O ' ' O ' ' A' ' 16' ' ' GLN . 92.6 mttt -75.19 -142.36 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.23 -0.919 . . . . 0.0 109.452 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.429 ' O ' ' O ' ' A' ' 15' ' ' LYS . 4.1 pt20 -60.85 -151.29 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.362 -0.836 . . . . 0.0 109.289 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -59.16 -38.74 80.47 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.023 -1.048 . . . . 0.0 109.646 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.405 ' CE2' ' CE1' ' A' ' 19' ' ' HIS . 9.9 t80 62.18 -146.3 0.39 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.341 -0.849 . . . . 0.0 109.275 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.435 ' N ' ' ND1' ' A' ' 19' ' ' HIS . 0.4 OUTLIER -63.8 -45.36 90.02 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.213 -0.93 . . . . 0.0 109.45 -179.879 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.422 ' O ' ' O ' ' A' ' 21' ' ' GLY . 37.1 m -165.29 -23.89 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.257 -0.902 . . . . 0.0 109.541 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.422 ' O ' ' O ' ' A' ' 20' ' ' THR . . . 62.3 132.02 0.01 OUTLIER Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.5 ttmt -166.86 -32.7 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.249 -1.148 . . . . 0.0 109.528 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 16.8 mt -85.09 111.65 19.95 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.263 -0.898 . . . . 0.0 109.225 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 30.1 m -75.9 -176.84 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.251 -0.906 . . . . 0.0 109.824 -179.627 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 60.1 p -44.33 106.42 0.07 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.524 -0.735 . . . . 0.0 109.906 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 47.5 m -78.42 104.07 8.77 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.322 -0.861 . . . . 0.0 109.502 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.5 mmtm -76.75 -177.75 4.46 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.243 -0.911 . . . . 0.0 109.44 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 175.91 49.22 0.06 OUTLIER Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.329 -1.508 . . . . 0.0 109.329 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -79.14 122.6 26.46 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.32 -1.106 . . . . 0.0 109.703 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 31.9 mttm -151.75 -170.89 3.78 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.38 -0.825 . . . . 0.0 108.982 179.747 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -160.2 -15.75 0.05 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.397 -0.814 . . . . 0.0 109.091 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.7 mt -57.64 -41.11 80.73 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.31 -0.869 . . . . 0.0 109.437 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 18.5 mt -69.87 -51.24 34.99 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.247 -0.908 . . . . 0.0 109.467 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.642 ' N ' HD12 ' A' ' 34' ' ' ILE . 1.5 mp -72.86 150.01 8.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.26 -0.9 . . . . 0.0 108.805 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.7 t70 53.75 90.45 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.239 -0.913 . . . . 0.0 109.455 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -70.57 -81.02 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.262 -0.899 . . . . 0.0 109.494 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 65.7 tt0 -170.19 -13.38 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.239 -0.913 . . . . 0.0 109.511 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 53.4 pttt -52.87 165.86 0.26 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.238 -0.914 . . . . 0.0 109.515 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 20.9 m -153.42 -164.99 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.253 -0.904 . . . . 0.0 109.306 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 63.5 p -65.93 -175.89 0.34 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.186 -0.946 . . . . 0.0 109.535 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.466 ' C ' ' H ' ' A' ' 43' ' ' HIS . 67.5 p -169.68 14.84 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.254 -0.904 . . . . 0.0 109.507 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -75.06 20.89 1.8 Allowed Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.466 ' H ' ' C ' ' A' ' 41' ' ' SER . 67.9 m-70 -72.83 -30.88 64.38 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.239 -1.154 . . . . 0.0 109.347 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 26.8 m -72.48 110.74 7.09 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.276 -0.89 . . . . 0.0 109.47 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.487 HG23 ' H ' ' A' ' 46' ' ' THR . 0.1 OUTLIER -68.91 -90.48 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.303 -0.873 . . . . 0.0 109.448 -179.974 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.487 ' H ' HG23 ' A' ' 45' ' ' THR . 5.3 t -77.03 150.68 35.78 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.232 -0.917 . . . . 0.0 109.375 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 67.7 p -77.56 146.63 36.16 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.172 -0.955 . . . . 0.0 109.594 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -145.8 164.85 30.59 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.254 -0.904 . . . . 0.0 109.156 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.435 ' O ' ' O ' ' A' ' 50' ' ' SER . 44.6 ttm180 -87.86 132.08 34.32 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.185 -0.947 . . . . 0.0 109.599 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.435 ' O ' ' O ' ' A' ' 49' ' ' ARG . 73.3 m -45.98 -94.48 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.337 -0.852 . . . . 0.0 109.876 -179.85 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 1.9 t -58.28 162.51 3.55 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.247 -0.908 . . . . 0.0 109.315 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.59 ' N ' ' SG ' ' A' ' 81' ' ' CYS . 4.5 p 61.82 152.4 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.25 -0.906 . . . . 0.0 109.492 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -95.71 112.33 24.07 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.323 -0.861 . . . . 0.0 109.08 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 96.6 t -126.94 116.4 44.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.489 -0.757 . . . . 0.0 109.358 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.496 ' O ' HD12 ' A' ' 55' ' ' ILE . 2.4 pp -127.81 121.64 56.98 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 67.9 p -130.74 112.61 13.23 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.355 -0.84 . . . . 0.0 109.625 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.5 ' H ' ' HB ' ' A' ' 69' ' ' THR . 0.7 OUTLIER -123.38 111.51 16.45 Favored 'General case' 0 N--CA 1.51 2.549 0 N-CA-C 108.72 -0.845 . . . . 0.0 108.72 178.791 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 70.4 p -120.63 126.13 49.49 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.604 -0.685 . . . . 0.0 109.198 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.538 HG23 ' O ' ' A' ' 59' ' ' VAL . 2.8 m -131.71 118.68 39.49 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.214 0 O-C-N 121.399 -0.813 . . . . 0.0 109.476 179.268 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 69.3 p -113.48 135.72 53.58 Favored 'General case' 0 N--CA 1.499 1.979 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.647 ' ND2' ' H ' ' A' ' 62' ' ' ALA . 4.5 t-20 -164.52 165.05 21.61 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.651 -1.281 . . . . 0.0 110.25 179.331 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.647 ' H ' ' ND2' ' A' ' 61' ' ' ASN . . . -74.81 -11.42 60.14 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 120.97 -1.081 . . . . 0.0 111.189 -179.432 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -74.71 8.95 2.05 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.122 -0.986 . . . . 0.0 109.591 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.42 10.08 84.0 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 108.9 -1.68 . . . . 0.0 108.9 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -91.7 97.2 10.87 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.059 -1.259 . . . . 0.0 108.705 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 48.4 p -129.79 66.12 1.48 Allowed 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 107.659 -1.238 . . . . 0.0 107.659 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -94.15 122.04 36.27 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.688 0.756 . . . . 0.0 111.195 -177.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.2 p -101.29 111.55 23.8 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 178.44 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.515 ' O ' ' N ' ' A' ' 71' ' ' GLU . 4.3 m -112.97 25.62 11.24 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 179.653 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 26.9 pttt -66.2 68.76 0.05 Allowed 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 179.179 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.515 ' N ' ' O ' ' A' ' 69' ' ' THR . 43.8 mm-40 -105.41 149.92 25.71 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.423 -0.798 . . . . 0.0 109.696 -179.455 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 24.1 m -127.43 142.99 42.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 16.5 t -128.62 119.84 51.07 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 CA-C-O 121.945 0.879 . . . . 0.0 109.012 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -58.46 -73.29 0.08 Allowed 'General case' 0 C--N 1.291 -1.974 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.523 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.493 ' C ' ' H ' ' A' ' 77' ' ' ASP . 79.6 p -161.47 71.56 0.38 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.259 -0.901 . . . . 0.0 109.495 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -68.28 43.41 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.225 -0.922 . . . . 0.0 109.351 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.493 ' H ' ' C ' ' A' ' 75' ' ' SER . 23.4 t0 -171.84 -37.03 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.294 -0.878 . . . . 0.0 109.174 -179.929 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.475 ' O ' ' N ' ' A' ' 80' ' ' ASP . . . 88.34 43.58 5.53 Favored Glycine 0 N--CA 1.493 2.481 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 48.7 m -68.51 50.66 0.07 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.339 -1.095 . . . . 0.0 109.297 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.514 ' N ' ' OD1' ' A' ' 80' ' ' ASP . 0.4 OUTLIER 54.84 25.87 7.14 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.343 -0.848 . . . . 0.0 109.512 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.59 ' SG ' ' N ' ' A' ' 52' ' ' SER . 12.3 t -108.0 -71.83 0.74 Allowed 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.45 -0.781 . . . . 0.0 109.275 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.504 ' O ' ' N ' ' A' ' 84' ' ' ALA . . . -72.77 -34.05 59.76 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 17.3 t70 51.07 -90.99 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.217 -1.167 . . . . 0.0 109.497 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.504 ' N ' ' O ' ' A' ' 82' ' ' GLY . . . -64.38 173.95 1.86 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.287 -0.883 . . . . 0.0 109.406 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -157.64 -110.9 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.303 -0.873 . . . . 0.0 109.368 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -70.58 113.16 7.41 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.13 -0.981 . . . . 0.0 109.577 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -64.08 -145.25 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.256 -0.902 . . . . 0.0 109.253 179.891 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' TRP . . . . . 0.444 ' O ' ' N ' ' A' ' 90' ' ' HIS . 18.5 m-90 -152.23 137.01 17.05 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.215 -0.928 . . . . 0.0 109.382 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 34.3 t60 -68.53 66.8 0.12 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.283 -0.886 . . . . 0.0 109.527 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.446 ' CG ' ' O ' ' A' ' 90' ' ' HIS . 18.9 t-80 52.81 43.88 30.95 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.281 -0.887 . . . . 0.0 109.614 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 11.5 p -142.13 119.03 11.2 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.221 -0.924 . . . . 0.0 109.297 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.534 ' N ' ' CD ' ' A' ' 93' ' ' PRO . 0.2 OUTLIER -69.19 -47.32 28.78 Favored Pre-proline 0 N--CA 1.487 1.421 0 O-C-N 121.273 -0.892 . . . . 0.0 110.385 -179.973 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.534 ' CD ' ' N ' ' A' ' 92' ' ' PHE . 5.2 Cg_exo -64.45 143.06 81.05 Favored 'Trans proline' 0 C--N 1.322 -0.851 0 C-N-CA 120.914 1.076 . . . . 0.0 109.877 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 43.7 m -60.99 -52.84 63.31 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.321 -0.862 . . . . 0.0 109.54 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 32.6 ptt180 -164.63 141.12 6.07 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.188 -0.945 . . . . 0.0 109.492 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 161.79 -170.91 37.61 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 57.7 t-20 -167.87 -78.11 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.26 -1.141 . . . . 0.0 109.588 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 55.8 mt -75.2 -92.43 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.247 -0.908 . . . . 0.0 109.526 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 49.0 35.31 6.61 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.99 -1.069 . . . . 0.0 109.551 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.473 ' CG ' ' H ' ' A' ' 101' ' ' PHE . 7.7 p-10 -67.35 -114.86 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.24 -0.912 . . . . 0.0 109.443 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.473 ' H ' ' CG ' ' A' ' 100' ' ' ASP . 64.9 t80 -66.38 -31.36 72.09 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.192 -0.943 . . . . 0.0 109.417 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -169.95 161.44 8.83 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.282 -0.886 . . . . 0.0 109.439 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.421 ' O ' ' O ' ' A' ' 104' ' ' ARG . 59.2 t-80 -63.23 -47.65 81.6 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.168 -0.958 . . . . 0.0 109.576 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.421 ' O ' ' O ' ' A' ' 103' ' ' HIS . 42.0 ttm180 51.81 98.24 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.26 -0.9 . . . . 0.0 109.56 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.405 ' O ' ' O ' ' A' ' 104' ' ' ARG . 47.3 m-20 -60.77 -154.55 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.238 -0.914 . . . . 0.0 109.496 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.467 ' CB ' ' NZ ' ' A' ' 106' ' ' LYS . 6.4 ttpm? -163.97 160.59 22.08 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.293 -0.88 . . . . 0.0 109.443 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -171.36 76.56 0.06 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.192 -0.943 . . . . 0.0 109.548 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 31.3 t70 51.29 77.44 0.13 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.238 -0.914 . . . . 0.0 109.515 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.508 ' O ' ' CD2' ' A' ' 109' ' ' PHE . 81.8 t80 -83.43 0.1 47.68 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.28 -0.887 . . . . 0.0 109.52 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -73.2 -20.83 60.79 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.222 -0.924 . . . . 0.0 109.434 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -177.32 145.23 0.44 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.268 -0.895 . . . . 0.0 109.53 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 30.1 mmt180 -76.04 -113.67 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.187 -0.946 . . . . 0.0 109.264 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.422 ' O ' ' OE2' ' A' ' 116' ' ' GLU . 46.3 t -71.16 120.51 16.84 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.232 -0.917 . . . . 0.0 109.435 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.409 ' O ' ' OE1' ' A' ' 116' ' ' GLU . 36.7 t -66.69 2.23 1.44 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.25 -0.906 . . . . 0.0 109.485 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' HIS . . . . . 0.417 ' H ' ' C ' ' A' ' 113' ' ' SER . 20.5 m170 -80.22 65.58 5.43 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.219 -0.925 . . . . 0.0 109.385 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.422 ' OE2' ' O ' ' A' ' 113' ' ' SER . 4.9 mp0 -68.42 -179.69 1.4 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.293 -0.88 . . . . 0.0 109.432 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -66.87 115.29 6.48 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.235 -0.915 . . . . 0.0 109.344 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -64.68 -38.02 89.58 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.245 -0.91 . . . . 0.0 109.412 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -178.08 139.68 4.29 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 51.3 mtp180 -63.56 166.43 6.77 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.255 -1.144 . . . . 0.0 109.388 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 7.5 t -80.99 -32.14 34.39 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.148 -0.97 . . . . 0.0 109.352 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 167.94 172.7 35.24 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.453 -1.459 . . . . 0.0 109.453 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 14.0 mt -68.31 128.45 36.62 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.232 -1.157 . . . . 0.0 109.344 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -72.25 153.74 92.24 Favored Pre-proline 0 N--CA 1.49 1.535 0 O-C-N 121.187 -0.946 . . . . 0.0 108.831 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -56.79 130.72 41.42 Favored 'Trans proline' 0 C--N 1.322 -0.829 0 C-N-CA 121.024 1.149 . . . . 0.0 109.786 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.516 ' O ' ' CG ' ' A' ' 127' ' ' PHE . 69.1 mm-40 -72.49 -49.65 31.5 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.208 -0.933 . . . . 0.0 109.359 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' PHE . . . . . 0.516 ' CG ' ' O ' ' A' ' 126' ' ' GLU . 97.9 m-85 -158.12 90.23 1.04 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.339 -0.851 . . . . 0.0 109.395 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . 54.59 -139.83 0.98 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.285 -0.885 . . . . 0.0 109.444 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -166.6 91.28 0.43 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.189 -0.944 . . . . 0.0 109.415 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.571 HD22 ' N ' ' A' ' 130' ' ' LEU . 3.5 mm? -70.78 73.45 0.57 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.176 -0.953 . . . . 0.0 109.182 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 178.26 74.86 0.06 OUTLIER Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.442 ' O ' ' N ' ' A' ' 134' ' ' GLY . 72.6 mt-10 -60.2 100.26 0.09 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.228 -1.16 . . . . 0.0 109.428 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 93.0 p -67.2 71.66 0.11 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.216 -0.928 . . . . 0.0 109.474 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' GLY . . . . . 0.459 ' O ' ' N ' ' A' ' 136' ' ' SER . . . -169.67 -55.29 0.03 OUTLIER Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 92.3 p -69.91 43.84 0.06 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.246 -1.149 . . . . 0.0 109.53 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.459 ' N ' ' O ' ' A' ' 134' ' ' GLY . 85.7 p -63.21 145.56 55.26 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.213 -0.93 . . . . 0.0 109.388 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 79.1 p -169.41 119.4 0.67 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.265 -0.897 . . . . 0.0 109.428 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 70.6 m -163.6 98.42 0.89 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.176 -0.953 . . . . 0.0 109.436 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 32.5 mtmm -62.73 -166.99 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.253 -0.904 . . . . 0.0 109.483 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 37.7 m -164.42 -46.74 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.296 -0.877 . . . . 0.0 109.408 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 14.6 t 53.14 78.99 0.13 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.21 -0.931 . . . . 0.0 109.46 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' THR . . . . . 0.41 ' OG1' ' ND1' ' A' ' 143' ' ' HIS . 78.5 p -67.11 -31.97 72.79 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.214 -0.929 . . . . 0.0 109.492 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 143' ' ' HIS . . . . . 0.507 ' N ' ' ND1' ' A' ' 143' ' ' HIS . 1.0 OUTLIER -171.77 -33.02 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.201 -0.937 . . . . 0.0 109.432 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 144' ' ' SER . . . . . 0.402 ' OG ' ' O ' ' A' ' 143' ' ' HIS . 72.6 m -167.7 104.8 0.51 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.251 -0.906 . . . . 0.0 109.43 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -61.46 -65.61 0.66 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.299 -0.876 . . . . 0.0 109.484 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 37.2 tt0 -168.34 -22.85 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.25 -0.906 . . . . 0.0 109.469 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -57.64 176.16 0.15 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.258 -0.901 . . . . 0.0 109.439 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' VAL . . . . . 0.445 ' C ' ' H ' ' A' ' 150' ' ' SER . 27.5 m -150.94 160.19 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.205 -0.935 . . . . 0.0 109.393 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 47.7 t -68.99 7.24 0.73 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.194 -0.941 . . . . 0.0 109.515 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' SER . . . . . 0.445 ' H ' ' C ' ' A' ' 148' ' ' VAL . 15.0 t 52.79 -175.16 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.27 -0.894 . . . . 0.0 109.431 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 88.3 p -170.54 70.24 0.05 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.269 -0.894 . . . . 0.0 109.483 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 1.5 t -170.22 -25.95 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.275 -0.89 . . . . 0.0 109.505 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 153' ' ' THR . . . . . 0.436 ' OG1' ' N ' ' A' ' 154' ' ' VAL . 82.8 p -69.47 -83.47 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.269 -0.894 . . . . 0.0 109.45 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.436 ' N ' ' OG1' ' A' ' 153' ' ' THR . 22.7 t 52.51 84.41 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.184 -0.948 . . . . 0.0 109.447 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 155' ' ' ASN . . . . . 0.415 ' O ' ' O ' ' A' ' 156' ' ' ARG . 7.1 m120 -64.69 -21.31 66.71 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.311 -0.868 . . . . 0.0 109.478 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 156' ' ' ARG . . . . . 0.415 ' O ' ' O ' ' A' ' 155' ' ' ASN . 62.6 mtm180 -57.6 -162.29 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.313 -0.867 . . . . 0.0 109.526 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -64.55 175.12 12.6 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -163.92 10.69 0.09 OUTLIER Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.708 -1.357 . . . . 0.0 109.708 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 12.6 m 52.08 -166.18 0.05 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.235 -1.156 . . . . 0.0 109.437 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.413 ' H ' ' H ' ' A' ' 161' ' ' ILE . . . -171.25 -1.66 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.184 -0.948 . . . . 0.0 109.52 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 161' ' ' ILE . . . . . 0.413 ' H ' ' H ' ' A' ' 160' ' ' ALA . 78.4 mt -79.32 89.17 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.235 -0.915 . . . . 0.0 109.468 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 74.2 mt-10 -63.73 -102.3 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.27 -0.893 . . . . 0.0 109.488 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 29.0 t -171.99 0.64 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.224 -0.922 . . . . 0.0 109.435 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 53.3 pttt -168.76 144.06 3.37 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.212 -0.93 . . . . 0.0 109.452 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 5.0 m-70 -69.05 -78.78 0.06 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.302 -0.874 . . . . 0.0 109.412 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 . . . . . 0 N--CA 1.489 1.519 0 CA-C-O 118.038 -0.982 . . . . 0.0 109.485 179.969 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.5 ttt . . . . . 0 N--CA 1.491 1.595 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 171.24 78.62 0.05 OUTLIER Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 70.8 p -65.36 94.82 0.18 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.187 -1.184 . . . . 0.0 109.506 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.541 ' CD2' ' N ' ' A' ' 5' ' ' ARG . 72.1 t80 -69.52 175.9 3.81 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.27 -0.894 . . . . 0.0 109.406 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.587 ' CG ' HH11 ' A' ' 5' ' ' ARG . 3.5 mtt-85 -63.12 -64.59 0.87 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.281 -0.887 . . . . 0.0 109.493 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 48.6 tt0 53.41 90.64 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.198 -0.939 . . . . 0.0 109.502 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -65.61 -125.96 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.241 -0.912 . . . . 0.0 109.375 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -178.38 36.24 0.08 OUTLIER Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.576 -1.409 . . . . 0.0 109.576 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.457 ' C ' ' H ' ' A' ' 11' ' ' SER . 69.2 m -166.04 93.37 0.53 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.262 -1.14 . . . . 0.0 109.551 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.4 m -74.7 18.9 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.224 -0.922 . . . . 0.0 109.434 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.457 ' H ' ' C ' ' A' ' 9' ' ' SER . 12.4 m 52.66 39.25 28.04 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.335 -0.853 . . . . 0.0 109.438 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.7 t 48.2 -140.6 0.62 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.298 -0.876 . . . . 0.0 109.529 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -168.04 69.0 0.17 Allowed Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 59.9 p -63.15 -46.9 85.02 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.339 -1.095 . . . . 0.0 109.552 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.457 ' C ' ' H ' ' A' ' 17' ' ' GLU . 91.8 mttt 52.5 64.86 1.69 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.156 -0.965 . . . . 0.0 109.374 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -70.97 10.17 0.58 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.249 -0.907 . . . . 0.0 109.42 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.457 ' H ' ' C ' ' A' ' 15' ' ' LYS . 48.7 mt-10 -80.19 -41.49 25.14 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.306 -0.871 . . . . 0.0 109.604 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 50.91 13.88 0.16 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.193 -0.942 . . . . 0.0 109.275 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.436 ' N ' ' C ' ' A' ' 17' ' ' GLU . 6.4 m-70 -75.42 -24.38 57.09 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.278 -0.889 . . . . 0.0 109.484 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 71.5 p -69.01 92.97 0.54 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.213 -0.929 . . . . 0.0 109.485 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -70.35 -149.14 0.47 Allowed Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -90.75 128.2 36.6 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.289 -1.124 . . . . 0.0 109.244 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.583 ' N ' HD12 ' A' ' 23' ' ' LEU . 8.6 mp 51.01 87.24 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.134 -0.979 . . . . 0.0 109.199 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 25.5 t -60.35 -40.98 85.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.28 -0.888 . . . . 0.0 109.48 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.443 ' H ' HG22 ' A' ' 25' ' ' THR . 0.0 OUTLIER -64.97 128.63 36.55 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.279 -0.888 . . . . 0.0 109.487 -179.953 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 49.3 m -156.81 -12.96 0.09 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.299 -0.875 . . . . 0.0 109.479 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 58.7 mttp -55.23 112.58 1.12 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.195 -0.941 . . . . 0.0 109.472 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 179.71 -155.13 14.87 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.421 ' O ' ' O ' ' A' ' 30' ' ' LYS . 1.2 m-20 -72.28 3.94 4.17 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.281 -1.129 . . . . 0.0 109.384 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.421 ' O ' ' O ' ' A' ' 29' ' ' ASP . 49.9 mtpt 52.56 175.66 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.403 -0.81 . . . . 0.0 109.568 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.46 ' N ' ' CD ' ' A' ' 31' ' ' GLU . 17.8 mp0 -84.43 114.39 21.87 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.247 -0.908 . . . . 0.0 109.526 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 15.8 mt -72.44 -6.84 46.42 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.207 -0.933 . . . . 0.0 109.361 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 11.0 tp -168.47 139.41 2.61 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.277 -0.889 . . . . 0.0 109.281 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 21.1 pt -67.94 164.79 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.215 -0.928 . . . . 0.0 109.522 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 35.3 t0 53.03 178.33 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.291 -0.88 . . . . 0.0 109.557 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 16.2 m-20 -55.96 156.68 5.07 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.256 -0.902 . . . . 0.0 109.498 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -73.89 -67.72 0.58 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.22 -0.925 . . . . 0.0 109.24 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -72.56 93.8 1.63 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.248 -0.908 . . . . 0.0 109.447 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.5 m -75.42 -158.93 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.244 -0.91 . . . . 0.0 109.427 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 79.6 p -59.24 132.02 52.75 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.236 -0.915 . . . . 0.0 109.433 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 50.9 m -69.72 87.87 0.52 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.326 -0.858 . . . . 0.0 109.441 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 168.36 40.47 0.03 OUTLIER Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.469 ' C ' ' H ' ' A' ' 45' ' ' THR . 57.3 t-80 -73.92 11.02 0.96 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.242 -1.152 . . . . 0.0 109.384 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.7 m -75.8 25.36 0.12 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.231 -0.918 . . . . 0.0 109.224 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.469 ' H ' ' C ' ' A' ' 43' ' ' HIS . 70.0 p -75.34 109.55 8.95 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.172 -0.955 . . . . 0.0 109.295 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 56.9 p -151.78 123.13 7.77 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.247 -0.908 . . . . 0.0 109.359 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 61.2 p -71.42 103.72 3.0 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.247 -0.908 . . . . 0.0 109.428 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 55.6 mtp180 -145.75 143.97 30.05 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.343 -0.848 . . . . 0.0 109.174 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.1 mmm180 -88.05 122.26 31.43 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.191 -0.943 . . . . 0.0 109.709 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.445 ' O ' ' O ' ' A' ' 51' ' ' CYS . 41.7 t -67.02 -67.82 0.42 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.222 -0.924 . . . . 0.0 109.668 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.445 ' O ' ' O ' ' A' ' 50' ' ' SER . 41.7 t -47.73 -93.39 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.157 -0.964 . . . . 0.0 109.235 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 48.7 m -55.47 149.79 12.9 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 22.9 tptp -95.56 100.4 12.14 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 120.959 -1.088 . . . . 0.0 108.438 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 41.2 t -128.45 116.2 40.83 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.647 -0.658 . . . . 0.0 109.562 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.519 HG23 ' O ' ' A' ' 55' ' ' ILE . 17.0 tt -127.89 124.92 63.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 179.545 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.6 m -128.19 111.65 13.67 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.365 -0.835 . . . . 0.0 109.488 -179.338 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.525 ' H ' ' HB ' ' A' ' 69' ' ' THR . 10.0 mtmt -124.3 114.42 19.54 Favored 'General case' 0 N--CA 1.512 2.652 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 178.203 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.9 p -118.96 126.63 52.2 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.433 -0.792 . . . . 0.0 109.752 -179.506 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.6 m -132.35 122.93 49.12 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.13 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 178.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' THR . . . . . 0.539 HG23 ' O ' ' A' ' 60' ' ' THR . 7.9 t -107.57 120.17 41.46 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.561 -0.712 . . . . 0.0 109.98 -179.43 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.462 ' ND2' ' O ' ' A' ' 65' ' ' ARG . 2.5 m-20 -111.82 145.45 39.41 Favored 'General case' 0 N--CA 1.51 2.553 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.418 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -69.96 -30.26 67.58 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 120.07 -1.644 . . . . 0.0 112.737 -177.554 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 11.5 p30 -67.07 3.99 1.0 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.249 -1.532 . . . . 0.0 109.863 -178.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.418 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 96.83 5.6 58.51 Favored Glycine 0 N--CA 1.496 2.654 0 N-CA-C 110.664 -0.974 . . . . 0.0 110.664 178.6 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.462 ' O ' ' ND2' ' A' ' 61' ' ' ASN . 11.7 mpt_? -91.68 104.82 17.24 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.568 -1.548 . . . . 0.0 108.043 178.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 28.7 p -130.1 104.53 7.38 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.536 -0.728 . . . . 0.0 109.128 -179.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -94.58 127.61 40.63 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.154 -0.966 . . . . 0.0 109.979 -179.18 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.409 HG22 ' H ' ' A' ' 70' ' ' LYS . 73.3 m -108.68 108.37 19.2 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.546 -0.721 . . . . 0.0 109.286 179.571 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.525 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 5.8 m -102.08 27.14 6.86 Favored 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 178.776 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.409 ' H ' HG22 ' A' ' 68' ' ' THR . 86.7 tttt -70.09 69.04 0.33 Allowed 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -106.26 143.98 33.61 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.552 -0.718 . . . . 0.0 109.275 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 43.1 t -128.11 129.19 69.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 179.496 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 17.2 t -130.12 116.93 38.76 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 CA-C-O 122.072 0.939 . . . . 0.0 108.95 179.224 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 58.1 mttp -78.77 -164.56 0.6 Allowed 'General case' 0 C--N 1.287 -2.109 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.614 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.519 ' O ' ' N ' ' A' ' 77' ' ' ASP . 86.1 p -77.6 90.34 3.94 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.192 -0.943 . . . . 0.0 109.643 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -46.15 -14.93 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.36 -0.837 . . . . 0.0 109.839 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.519 ' N ' ' O ' ' A' ' 75' ' ' SER . 44.0 m-20 -158.12 -38.79 0.07 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.203 -0.936 . . . . 0.0 109.316 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.411 ' O ' ' OG ' ' A' ' 79' ' ' SER . . . 177.51 -5.5 0.03 OUTLIER Glycine 0 N--CA 1.488 2.162 0 N-CA-C 109.24 -1.544 . . . . 0.0 109.24 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' SER . . . . . 0.45 ' OG ' ' SG ' ' A' ' 81' ' ' CYS . 96.9 p 47.16 27.09 0.75 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.277 -1.131 . . . . 0.0 109.242 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 54.12 24.35 4.77 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.417 -0.802 . . . . 0.0 109.233 -179.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.45 ' SG ' ' OG ' ' A' ' 79' ' ' SER . 99.3 m -95.7 18.82 12.22 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.185 -0.947 . . . . 0.0 109.49 -179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -158.8 -8.07 0.05 OUTLIER Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.452 ' C ' ' H ' ' A' ' 85' ' ' ASP . 9.0 p-10 -161.77 95.46 0.99 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.397 -1.061 . . . . 0.0 109.502 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -67.12 4.64 0.86 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.241 -0.912 . . . . 0.0 109.364 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.452 ' H ' ' C ' ' A' ' 83' ' ' ASP . 27.0 t70 -168.42 141.43 3.02 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.298 -0.876 . . . . 0.0 109.474 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -58.6 123.5 16.49 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.269 -0.894 . . . . 0.0 109.456 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -60.67 -48.14 83.11 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.215 -0.928 . . . . 0.0 109.467 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' TRP . . . . . 0.426 ' O ' ' O ' ' A' ' 89' ' ' HIS . 35.6 m95 -65.3 -37.51 87.36 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.194 -0.941 . . . . 0.0 109.491 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.426 ' O ' ' O ' ' A' ' 88' ' ' TRP . 49.9 t-80 54.89 169.8 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.389 -0.82 . . . . 0.0 109.516 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.416 ' ND1' ' N ' ' A' ' 90' ' ' HIS . 8.3 m80 -82.2 53.68 2.33 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.282 -0.886 . . . . 0.0 109.449 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.434 HG22 ' CD2' ' A' ' 92' ' ' PHE . 7.1 m -60.27 136.83 58.15 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.176 -0.952 . . . . 0.0 109.488 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.434 ' CD2' HG22 ' A' ' 91' ' ' THR . 56.3 m-85 50.23 67.9 3.94 Favored Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.23 -0.919 . . . . 0.0 109.707 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -61.77 -31.4 85.67 Favored 'Trans proline' 0 C--N 1.318 -1.077 0 C-N-CA 121.399 1.399 . . . . 0.0 109.693 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 88.1 p -83.84 157.3 22.07 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.343 -0.848 . . . . 0.0 109.297 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.603 ' CG ' HH11 ' A' ' 95' ' ' ARG . 0.1 OUTLIER -167.35 -2.14 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.188 -0.945 . . . . 0.0 109.389 -179.938 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -67.91 54.68 0.38 Allowed Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.513 ' N ' ' O ' ' A' ' 95' ' ' ARG . 69.9 m-80 50.74 94.22 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.261 -1.141 . . . . 0.0 109.451 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 10.7 tp -170.91 118.25 0.49 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.317 -0.864 . . . . 0.0 109.317 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.443 ' OD1' ' N ' ' A' ' 100' ' ' ASP . 63.3 t0 -168.71 133.66 1.62 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.25 -0.906 . . . . 0.0 109.535 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.525 ' O ' ' CE2' ' A' ' 102' ' ' PHE . 56.8 m-20 52.07 86.73 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.3 -0.875 . . . . 0.0 109.667 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 22.0 p90 -59.49 -9.37 2.43 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.242 -0.911 . . . . 0.0 109.473 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.525 ' CE2' ' O ' ' A' ' 100' ' ' ASP . 13.2 m-85 60.21 105.99 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.406 -0.808 . . . . 0.0 109.488 -179.823 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -76.52 -32.18 58.11 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.227 -0.921 . . . . 0.0 109.53 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 58.6 ttt180 57.02 167.73 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.217 -0.927 . . . . 0.0 109.321 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.486 ' C ' ' H ' ' A' ' 107' ' ' ASP . 3.5 p30 -131.36 125.19 32.03 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.426 -0.796 . . . . 0.0 109.174 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -71.56 15.59 0.13 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.245 -0.909 . . . . 0.0 109.652 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.486 ' H ' ' C ' ' A' ' 105' ' ' ASP . 8.3 p-10 -171.76 87.85 0.1 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.267 -0.896 . . . . 0.0 109.518 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -66.05 134.62 53.25 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.258 -0.901 . . . . 0.0 109.307 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -63.21 -34.77 78.36 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.231 -0.918 . . . . 0.0 109.465 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -66.69 80.67 0.1 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.291 -0.88 . . . . 0.0 109.483 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 73.4 p -63.72 95.33 0.11 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.317 -0.864 . . . . 0.0 109.436 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.457 ' C ' ' H ' ' A' ' 114' ' ' SER . 69.2 ttt180 -67.86 87.43 0.24 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.245 -0.909 . . . . 0.0 109.428 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.406 ' OG ' ' O ' ' A' ' 112' ' ' ARG . 17.4 p 54.81 7.51 0.17 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.29 -0.881 . . . . 0.0 109.385 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.457 ' H ' ' C ' ' A' ' 112' ' ' ARG . 26.8 p 51.9 -156.55 0.14 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.28 -0.887 . . . . 0.0 109.433 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 32.0 p-80 -69.33 -165.23 0.07 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.345 -0.847 . . . . 0.0 109.554 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -69.55 161.44 29.55 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.261 -0.899 . . . . 0.0 109.403 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -63.14 130.87 46.48 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.193 -0.942 . . . . 0.0 109.517 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -169.33 73.18 0.08 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.33 -0.856 . . . . 0.0 109.259 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 176.66 86.45 0.06 OUTLIER Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 38.1 ttm180 -66.19 139.4 58.11 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.335 -1.097 . . . . 0.0 109.399 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 1.9 t -170.37 26.94 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.238 -0.914 . . . . 0.0 109.526 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 178.91 140.48 3.99 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.587 HD22 ' N ' ' A' ' 123' ' ' LEU . 3.4 mm? -75.4 127.46 33.17 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.219 -1.166 . . . . 0.0 109.064 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.525 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -77.28 161.78 71.58 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.156 -0.965 . . . . 0.0 108.816 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.525 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 1.4 Cg_endo -57.79 154.64 36.59 Favored 'Trans proline' 0 C--N 1.32 -0.951 0 C-N-CA 121.409 1.406 . . . . 0.0 109.804 179.588 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -65.04 -133.94 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.202 -0.936 . . . . 0.0 109.159 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -76.72 -133.37 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.927 -1.108 . . . . 0.0 109.327 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -66.79 -69.31 0.31 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.216 -0.928 . . . . 0.0 109.443 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -172.29 158.84 4.55 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.267 -0.896 . . . . 0.0 109.39 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 10.9 tp -64.76 95.72 0.16 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.317 -0.865 . . . . 0.0 109.321 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' GLY . . . . . 0.425 ' O ' ' O ' ' A' ' 132' ' ' GLU . . . 175.79 31.55 0.04 OUTLIER Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.59 ' CD ' ' H ' ' A' ' 132' ' ' GLU . 0.4 OUTLIER -55.29 -169.12 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.247 -1.149 . . . . 0.0 109.616 -179.934 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 27.8 t -170.93 -87.78 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.286 -0.884 . . . . 0.0 109.503 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 173.04 70.38 0.05 OUTLIER Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.485 -1.446 . . . . 0.0 109.485 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' SER . . . . . 0.401 ' O ' ' O ' ' A' ' 136' ' ' SER . 41.7 t -69.27 176.83 3.08 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.281 -1.129 . . . . 0.0 109.469 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.41 ' C ' ' H ' ' A' ' 138' ' ' SER . 12.8 t 53.19 97.67 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.253 -0.904 . . . . 0.0 109.418 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' SER . . . . . 0.445 ' C ' ' H ' ' A' ' 139' ' ' LYS . 90.7 p -58.39 -6.91 0.75 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.276 -0.89 . . . . 0.0 109.509 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.483 ' O ' ' N ' ' A' ' 140' ' ' THR . 84.8 p -72.7 13.36 0.37 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.316 -0.865 . . . . 0.0 109.401 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.445 ' H ' ' C ' ' A' ' 137' ' ' SER . 61.0 tttp -59.16 84.75 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.266 -0.896 . . . . 0.0 109.47 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 140' ' ' THR . . . . . 0.483 ' N ' ' O ' ' A' ' 138' ' ' SER . 39.9 m -165.4 -44.03 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.279 -0.888 . . . . 0.0 109.492 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 87.6 p -169.86 -167.94 0.71 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.341 -0.849 . . . . 0.0 109.408 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 1.5 t -171.75 164.93 6.62 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.292 -0.88 . . . . 0.0 109.48 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' HIS . . . . . 0.403 ' CG ' ' N ' ' A' ' 144' ' ' SER . 57.9 t-80 -63.0 164.76 7.79 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.195 -0.94 . . . . 0.0 109.444 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 144' ' ' SER . . . . . 0.403 ' N ' ' CG ' ' A' ' 143' ' ' HIS . 89.7 p -169.63 -138.51 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.218 -0.926 . . . . 0.0 109.51 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 19.1 ttpp -163.95 144.55 8.49 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.232 -0.917 . . . . 0.0 109.495 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 45.4 tt0 -169.73 -85.7 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.299 -0.875 . . . . 0.0 109.43 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' PHE . . . . . 0.52 ' CD2' ' O ' ' A' ' 147' ' ' PHE . 70.6 t80 51.15 47.8 24.19 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.234 -0.916 . . . . 0.0 109.47 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 9.0 p -171.16 151.75 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.328 -0.858 . . . . 0.0 109.403 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 31.4 t -170.78 170.2 6.64 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.257 -0.902 . . . . 0.0 109.398 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 81.1 p -169.36 89.73 0.2 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.257 -0.902 . . . . 0.0 109.471 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 14.0 m 52.73 62.55 2.63 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.262 -0.899 . . . . 0.0 109.504 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 152' ' ' THR . . . . . 0.47 ' H ' HG22 ' A' ' 152' ' ' THR . 0.5 OUTLIER -75.43 -30.67 60.1 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.266 -0.896 . . . . 0.0 109.527 179.977 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 24.0 p -77.11 161.23 28.42 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.243 -0.911 . . . . 0.0 109.4 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.428 ' O ' ' O ' ' A' ' 155' ' ' ASN . 38.8 t -72.51 -74.77 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.252 -0.905 . . . . 0.0 109.466 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 155' ' ' ASN . . . . . 0.428 ' O ' ' O ' ' A' ' 154' ' ' VAL . 10.8 m120 -60.88 -149.74 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.279 -0.888 . . . . 0.0 109.561 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 54.6 mtp180 -148.79 100.96 3.15 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.17 -0.956 . . . . 0.0 109.304 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 65.55 82.32 0.11 Allowed Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -66.32 -98.39 0.02 OUTLIER Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 98.3 p -63.28 164.53 8.76 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.249 -1.147 . . . . 0.0 109.525 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.487 ' O ' ' N ' ' A' ' 162' ' ' GLU . . . -67.13 -39.93 86.67 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.256 -0.902 . . . . 0.0 109.443 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 161' ' ' ILE . . . . . 0.431 ' C ' ' H ' ' A' ' 163' ' ' SER . 15.8 pt -68.46 56.5 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.281 -0.887 . . . . 0.0 109.483 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.487 ' N ' ' O ' ' A' ' 160' ' ' ALA . 15.3 pt-20 -73.92 39.7 0.11 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.215 -0.928 . . . . 0.0 109.452 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 163' ' ' SER . . . . . 0.431 ' H ' ' C ' ' A' ' 161' ' ' ILE . 53.4 p 50.69 77.83 0.12 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.187 -0.946 . . . . 0.0 109.495 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -66.92 90.11 0.17 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.166 -0.959 . . . . 0.0 109.443 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 16.1 p-80 -71.84 57.14 0.31 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.253 -0.904 . . . . 0.0 109.425 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 51.8 t80 . . . . . 0 N--CA 1.49 1.542 0 CA-C-O 118.04 -0.981 . . . . 0.0 109.501 179.974 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.3 mtm . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 121.292 0.568 . . . . 0.0 109.528 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -66.69 -112.62 0.01 OUTLIER Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.544 -1.423 . . . . 0.0 109.544 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.402 ' O ' ' N ' ' A' ' 5' ' ' ARG . 42.9 p -152.75 178.75 9.29 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.336 -1.096 . . . . 0.0 109.339 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 34.0 m-85 -70.99 49.42 0.13 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.257 -0.902 . . . . 0.0 109.394 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.402 ' N ' ' O ' ' A' ' 3' ' ' THR . 38.4 ttm180 -71.24 -12.7 61.6 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.152 -0.967 . . . . 0.0 109.445 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -59.3 -84.6 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.247 -0.908 . . . . 0.0 109.296 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.618 ' H ' ' CD ' ' A' ' 7' ' ' GLU . 1.1 pm0 -71.51 80.03 0.79 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.232 -0.918 . . . . 0.0 109.192 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -88.42 -70.44 1.27 Allowed Glycine 0 N--CA 1.494 2.527 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.9 t -172.87 -79.05 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.276 -1.132 . . . . 0.0 109.378 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.7 p -171.54 138.24 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.244 -0.91 . . . . 0.0 109.449 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.9 t -171.05 149.8 2.96 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.181 -0.949 . . . . 0.0 109.553 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.8 t -71.08 -74.69 0.14 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.243 -0.911 . . . . 0.0 109.534 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -171.3 141.81 6.66 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.415 ' OG1' ' N ' ' A' ' 15' ' ' LYS . 75.1 p -72.04 -86.62 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.123 -1.222 . . . . 0.0 109.445 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.415 ' N ' ' OG1' ' A' ' 14' ' ' THR . 61.3 tttm -168.95 75.06 0.1 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.209 -0.932 . . . . 0.0 109.548 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.444 ' N ' ' CD ' ' A' ' 16' ' ' GLN . 3.1 mp0 -73.23 86.85 1.44 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.252 -0.905 . . . . 0.0 109.519 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -67.67 -31.55 71.61 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.292 -0.88 . . . . 0.0 109.397 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 80.9 t80 -72.58 154.49 40.76 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.195 -0.941 . . . . 0.0 109.451 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 77.8 m-70 -58.84 148.68 29.1 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.252 -0.905 . . . . 0.0 109.461 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 60.9 m -62.48 -34.08 76.14 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.237 -0.914 . . . . 0.0 109.443 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.426 ' O ' ' O ' ' A' ' 22' ' ' LYS . . . 69.01 5.55 48.05 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.426 ' O ' ' O ' ' A' ' 21' ' ' GLY . 33.6 ttpt 54.5 172.23 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.208 -1.172 . . . . 0.0 109.283 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.59 ' N ' HD22 ' A' ' 23' ' ' LEU . 3.5 mm? -81.76 158.85 24.0 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.236 -0.915 . . . . 0.0 109.049 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.407 ' O ' ' O ' ' A' ' 25' ' ' THR . 4.8 t 58.95 95.42 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.4 -0.813 . . . . 0.0 109.385 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.407 ' O ' ' O ' ' A' ' 24' ' ' VAL . 61.3 p -50.71 178.27 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.32 -0.863 . . . . 0.0 109.598 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.448 ' C ' ' H ' ' A' ' 28' ' ' GLY . 70.3 p -68.94 155.34 40.48 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.273 -0.892 . . . . 0.0 109.543 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.462 ' O ' ' N ' ' A' ' 29' ' ' ASP . 52.6 tttm -76.3 33.55 0.13 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.225 -0.922 . . . . 0.0 109.182 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.448 ' H ' ' C ' ' A' ' 26' ' ' THR . . . 68.12 -61.45 0.38 Allowed Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.462 ' N ' ' O ' ' A' ' 27' ' ' LYS . 70.3 m-20 -55.83 99.35 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.165 -1.197 . . . . 0.0 109.52 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.7 tttm -171.09 150.32 3.02 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.242 -0.912 . . . . 0.0 109.472 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.45 ' N ' ' CD ' ' A' ' 31' ' ' GLU . 13.9 mp0 -74.25 89.62 2.05 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.281 -0.887 . . . . 0.0 109.424 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 14.6 mt -78.4 -1.07 31.69 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.219 -0.926 . . . . 0.0 109.449 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 11.3 tp -170.87 148.33 2.85 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.233 -0.917 . . . . 0.0 109.303 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 75.5 mt -132.33 102.24 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.461 -0.774 . . . . 0.0 109.172 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -67.72 -160.5 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.277 -0.889 . . . . 0.0 109.491 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -169.55 -39.7 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.315 -0.866 . . . . 0.0 109.346 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -169.21 145.6 3.4 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.204 -0.935 . . . . 0.0 109.379 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 27.0 mtmm -153.27 -47.6 0.1 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.224 -0.923 . . . . 0.0 109.347 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.455 HG22 ' N ' ' A' ' 40' ' ' THR . 7.8 p -170.11 157.96 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.234 -0.916 . . . . 0.0 109.508 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.455 ' N ' HG22 ' A' ' 39' ' ' VAL . 43.8 p -59.54 -160.28 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.252 -0.905 . . . . 0.0 109.43 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 81.0 p -164.5 -15.36 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.278 -0.889 . . . . 0.0 109.429 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -177.82 149.77 9.48 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.417 -1.473 . . . . 0.0 109.417 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 8.1 p80 -174.58 172.54 3.06 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.214 -1.168 . . . . 0.0 109.425 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 25.9 p 49.91 -134.68 1.42 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.278 -0.889 . . . . 0.0 109.556 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.428 ' O ' ' O ' ' A' ' 46' ' ' THR . 80.6 p 43.47 -155.73 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.454 -0.779 . . . . 0.0 110.085 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.492 ' O ' ' N ' ' A' ' 48' ' ' ARG . 7.4 p 55.29 107.71 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.427 -0.796 . . . . 0.0 109.813 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 77.2 p -66.21 69.67 0.06 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.151 -0.968 . . . . 0.0 109.485 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.492 ' N ' ' O ' ' A' ' 46' ' ' THR . 44.7 mtp180 -141.97 143.04 33.02 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.308 -0.87 . . . . 0.0 109.155 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.574 ' CG ' HH11 ' A' ' 49' ' ' ARG . 0.4 OUTLIER -94.35 131.15 40.29 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.177 -0.952 . . . . 0.0 109.995 -179.772 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.446 ' O ' ' O ' ' A' ' 51' ' ' CYS . 31.0 m -70.45 -55.67 8.46 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.261 -0.899 . . . . 0.0 110.217 -179.749 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.446 ' O ' ' O ' ' A' ' 50' ' ' SER . 45.8 t -56.69 -107.88 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.214 -0.929 . . . . 0.0 109.346 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.3 t -51.06 165.89 0.11 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.867 -1.146 . . . . 0.0 108.469 179.476 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 16.4 mmmt -107.53 99.68 9.16 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.268 -0.895 . . . . 0.0 109.524 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.611 HG13 ' O ' ' A' ' 54' ' ' VAL . 9.6 p -129.28 115.79 37.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 179.301 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.9 mm -127.11 118.43 50.16 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.0 m -129.4 112.41 13.79 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.424 -0.797 . . . . 0.0 109.068 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.54 ' N ' ' OG1' ' A' ' 69' ' ' THR . 17.3 mttp -123.1 113.39 18.93 Favored 'General case' 0 N--CA 1.514 2.759 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 178.568 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 58.1 m -114.84 127.05 55.49 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.469 -0.769 . . . . 0.0 109.521 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.432 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.8 m -131.56 123.84 53.17 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.144 0 O-C-N 121.486 -0.759 . . . . 0.0 109.051 179.081 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 73.2 p -108.37 120.61 42.9 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.703 -0.623 . . . . 0.0 110.006 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.545 ' N ' ' OD1' ' A' ' 61' ' ' ASN . 0.7 OUTLIER -108.53 144.16 36.56 Favored 'General case' 0 N--CA 1.512 2.675 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.692 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.426 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -66.66 -31.08 71.52 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 119.949 -1.719 . . . . 0.0 112.474 -177.683 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.433 ' N ' ' OD1' ' A' ' 63' ' ' ASP . 16.1 p-10 -66.96 3.58 1.06 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.295 -1.503 . . . . 0.0 109.798 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.426 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 94.61 5.34 61.61 Favored Glycine 0 N--CA 1.497 2.719 0 N-CA-C 110.586 -1.006 . . . . 0.0 110.586 178.746 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.429 ' O ' ' OD1' ' A' ' 61' ' ' ASN . 63.0 ttt180 -92.3 109.5 20.88 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.608 -1.525 . . . . 0.0 108.086 178.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 17.6 p -134.19 112.5 11.15 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.31 -0.869 . . . . 0.0 109.48 -179.307 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -94.35 130.9 40.48 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.326 -0.859 . . . . 0.0 109.827 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.494 ' CG2' ' O ' ' A' ' 68' ' ' THR . 1.1 t -111.52 110.33 20.7 Favored 'General case' 0 N--CA 1.5 2.052 0 CA-C-O 122.013 0.911 . . . . 0.0 109.525 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.54 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 68.4 p -110.68 28.65 8.47 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 179.727 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.47 ' HZ3' ' HB2' ' A' ' 70' ' ' LYS . 18.4 mtmm -65.68 63.28 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.583 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.527 ' N ' ' O ' ' A' ' 69' ' ' THR . 56.5 mt-10 -102.23 140.83 35.99 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.447 -0.783 . . . . 0.0 109.502 -179.52 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.407 ' O ' HG23 ' A' ' 72' ' ' VAL . 17.9 m -127.78 136.29 60.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 179.499 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 13.2 t -129.79 116.51 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 CA-C-O 121.863 0.839 . . . . 0.0 109.077 179.178 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -53.58 177.2 0.03 OUTLIER 'General case' 0 C--N 1.287 -2.115 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.474 ' C ' ' H ' ' A' ' 77' ' ' ASP . 93.7 p -69.36 123.95 22.57 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.207 -0.933 . . . . 0.0 109.476 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -73.67 20.09 0.1 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.303 -0.873 . . . . 0.0 109.482 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.474 ' H ' ' C ' ' A' ' 75' ' ' SER . 34.1 t70 -165.31 -46.52 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.256 -0.902 . . . . 0.0 109.317 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 83.11 53.43 3.48 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.494 -1.443 . . . . 0.0 109.494 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 95.7 p -64.49 -33.13 75.18 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.258 -1.142 . . . . 0.0 109.505 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -168.57 24.91 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.248 -0.907 . . . . 0.0 109.554 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 59.1 m -126.73 18.77 7.32 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.558 -0.714 . . . . 0.0 109.342 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -161.25 16.29 0.17 Allowed Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.707 -1.357 . . . . 0.0 109.707 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -157.62 141.31 15.71 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.249 -1.148 . . . . 0.0 109.476 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -171.12 54.26 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.343 -0.848 . . . . 0.0 109.497 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -171.06 69.63 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.257 -0.902 . . . . 0.0 109.431 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -57.06 106.11 0.28 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.303 -0.873 . . . . 0.0 109.518 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.471 ' CG ' ' H ' ' A' ' 88' ' ' TRP . 19.0 t70 -167.06 -172.43 2.04 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.209 -0.932 . . . . 0.0 109.599 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' TRP . . . . . 0.471 ' H ' ' CG ' ' A' ' 87' ' ' ASP . 1.8 t-105 -73.09 111.21 7.99 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.276 -0.89 . . . . 0.0 109.218 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -162.31 75.48 0.44 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.2 -0.937 . . . . 0.0 109.519 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -171.64 60.7 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.377 -0.827 . . . . 0.0 109.477 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 71.3 p -148.23 -151.25 0.38 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.249 -0.907 . . . . 0.0 109.284 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.529 ' C ' ' H ' ' A' ' 94' ' ' SER . 45.3 t80 53.52 70.17 1.91 Allowed Pre-proline 0 N--CA 1.49 1.528 0 O-C-N 121.208 -0.933 . . . . 0.0 109.647 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.492 ' C ' ' H ' ' A' ' 95' ' ' ARG . 1.4 Cg_endo -67.11 29.46 0.12 Allowed 'Trans proline' 0 C--N 1.316 -1.132 0 C-N-CA 121.601 1.534 . . . . 0.0 110.385 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.529 ' H ' ' C ' ' A' ' 92' ' ' PHE . 8.4 t 55.29 5.27 0.11 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.001 -1.062 . . . . 0.0 109.628 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.507 ' HG2' HH11 ' A' ' 95' ' ' ARG . 0.0 OUTLIER -91.57 120.06 32.03 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.248 -0.907 . . . . 0.0 109.262 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -171.69 94.03 0.1 Allowed Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.444 ' OD1' ' N ' ' A' ' 98' ' ' LEU . 46.4 t30 -75.06 164.54 26.42 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.335 -1.097 . . . . 0.0 109.525 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.444 ' N ' ' OD1' ' A' ' 97' ' ' ASN . 23.3 tp -65.41 126.81 29.42 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.268 -0.895 . . . . 0.0 109.242 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -157.03 141.92 16.98 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.214 -0.929 . . . . 0.0 109.529 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -172.45 -10.22 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.231 -0.918 . . . . 0.0 109.52 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 51.2 p90 -66.3 -19.83 65.93 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.254 -0.904 . . . . 0.0 109.476 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -64.87 -25.24 67.81 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.171 -0.956 . . . . 0.0 109.496 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.444 ' O ' ' O ' ' A' ' 104' ' ' ARG . 56.2 t-80 -65.92 -22.81 66.52 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.275 -0.891 . . . . 0.0 109.486 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.444 ' O ' ' O ' ' A' ' 103' ' ' HIS . 34.8 ttp180 61.08 133.14 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.566 -0.709 . . . . 0.0 109.705 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -157.58 -33.07 0.08 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.259 -0.901 . . . . 0.0 109.372 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -65.17 141.18 58.76 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.212 -0.93 . . . . 0.0 109.42 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -169.87 39.41 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.226 -0.921 . . . . 0.0 109.511 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 53.2 41.11 32.15 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.29 -0.881 . . . . 0.0 109.516 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -71.75 -40.51 69.31 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.266 -0.896 . . . . 0.0 109.475 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' PHE . . . . . 0.429 ' O ' ' O ' ' A' ' 111' ' ' THR . 71.6 t80 -171.35 -23.52 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.352 -0.842 . . . . 0.0 109.295 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' THR . . . . . 0.429 ' O ' ' O ' ' A' ' 110' ' ' PHE . 3.8 m 61.81 132.48 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.549 -0.719 . . . . 0.0 109.519 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 42.6 ttm180 -68.19 92.69 0.41 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.317 -0.864 . . . . 0.0 109.468 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.452 ' OG ' ' N ' ' A' ' 114' ' ' SER . 48.2 t -74.5 -149.85 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.269 -0.894 . . . . 0.0 109.416 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.452 ' N ' ' OG ' ' A' ' 113' ' ' SER . 80.0 p -171.55 12.93 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.251 -0.906 . . . . 0.0 109.422 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 21.7 t60 -70.4 156.69 39.0 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.221 -0.925 . . . . 0.0 109.403 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -72.64 158.67 35.21 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.203 -0.936 . . . . 0.0 109.51 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.508 ' O ' ' N ' ' A' ' 119' ' ' GLY . 61.5 t80 -74.11 -39.97 63.01 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.261 -0.899 . . . . 0.0 109.454 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 30.3 t0 -54.82 87.48 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.295 -0.878 . . . . 0.0 109.431 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.508 ' N ' ' O ' ' A' ' 117' ' ' PHE . . . -77.9 -87.72 0.41 Allowed Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 -179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 53.1 mtp180 -144.3 -90.98 0.11 Allowed 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.145 -1.209 . . . . 0.0 109.309 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 71.9 m -166.06 -77.27 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.227 -0.92 . . . . 0.0 109.483 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 164.99 -179.61 39.51 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.454 -1.459 . . . . 0.0 109.454 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.593 ' N ' HD12 ' A' ' 123' ' ' LEU . 7.9 mp -67.06 130.99 44.92 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.228 -1.16 . . . . 0.0 109.266 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.54 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -72.24 162.36 74.16 Favored Pre-proline 0 N--CA 1.49 1.545 0 O-C-N 121.192 -0.943 . . . . 0.0 108.862 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.54 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 2.2 Cg_endo -56.47 148.42 62.99 Favored 'Trans proline' 0 C--N 1.319 -0.985 0 C-N-CA 121.317 1.345 . . . . 0.0 109.721 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.432 ' O ' ' O ' ' A' ' 127' ' ' PHE . 38.4 tt0 -77.33 50.84 0.81 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.288 -0.882 . . . . 0.0 109.364 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' PHE . . . . . 0.432 ' O ' ' O ' ' A' ' 126' ' ' GLU . 32.9 t80 60.06 121.99 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.438 -0.789 . . . . 0.0 109.727 -179.782 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -162.97 43.05 0.12 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.216 -0.928 . . . . 0.0 109.365 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -63.99 -155.29 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.318 -0.864 . . . . 0.0 109.503 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.568 ' N ' HD12 ' A' ' 130' ' ' LEU . 9.7 mp -55.6 -15.99 3.54 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.238 -0.914 . . . . 0.0 109.201 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 82.73 -100.39 2.18 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 52.21 -113.25 0.73 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.268 -1.136 . . . . 0.0 109.43 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 97.3 p -77.71 -152.83 0.05 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.184 -0.948 . . . . 0.0 109.468 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 177.14 25.38 0.03 OUTLIER Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 13.4 m 52.77 77.54 0.16 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.176 -1.19 . . . . 0.0 109.51 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 29.6 t -171.26 0.19 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.242 -0.911 . . . . 0.0 109.491 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 78.3 p -169.1 102.86 0.37 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.232 -0.917 . . . . 0.0 109.505 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 92.2 p -73.09 -129.15 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.202 -0.936 . . . . 0.0 109.398 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -58.42 113.05 1.79 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.164 -0.96 . . . . 0.0 109.494 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 67.4 p -78.74 37.08 0.28 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.264 -0.897 . . . . 0.0 109.467 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 29.3 t -169.59 98.41 0.32 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.251 -0.905 . . . . 0.0 109.511 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' THR . . . . . 0.523 ' O ' ' CG ' ' A' ' 143' ' ' HIS . 58.2 p -78.28 -172.75 2.95 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.282 -0.886 . . . . 0.0 109.495 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 143' ' ' HIS . . . . . 0.523 ' CG ' ' O ' ' A' ' 142' ' ' THR . 78.4 m80 -158.14 -58.26 0.08 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.318 -0.864 . . . . 0.0 109.359 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 144' ' ' SER . . . . . 0.405 ' O ' ' O ' ' A' ' 143' ' ' HIS . 11.1 t 53.82 100.44 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.322 -0.861 . . . . 0.0 109.503 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' LYS . . . . . 0.488 ' C ' ' H ' ' A' ' 147' ' ' PHE . 79.3 tttt -61.84 -86.14 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.273 -0.892 . . . . 0.0 109.368 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 39.6 tt0 59.0 1.82 0.22 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.256 -0.902 . . . . 0.0 109.563 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' PHE . . . . . 0.488 ' H ' ' C ' ' A' ' 145' ' ' LYS . 60.4 t80 -57.31 124.21 18.07 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.111 -0.993 . . . . 0.0 109.47 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 37.1 t -70.07 86.54 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.241 -0.912 . . . . 0.0 109.506 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 98.0 p -70.87 109.52 5.07 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.286 -0.883 . . . . 0.0 109.462 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 62.3 m -68.09 102.57 1.35 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.29 -0.881 . . . . 0.0 109.424 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 68.6 p -169.56 -76.56 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.237 -0.914 . . . . 0.0 109.419 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 152' ' ' THR . . . . . 0.411 ' O ' ' OG1' ' A' ' 153' ' ' THR . 6.9 t -75.76 -30.08 59.04 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.258 -0.901 . . . . 0.0 109.461 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 153' ' ' THR . . . . . 0.411 ' OG1' ' O ' ' A' ' 152' ' ' THR . 9.4 p 52.75 177.63 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.247 -0.908 . . . . 0.0 109.524 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 8.2 p -78.94 -31.43 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.206 -0.934 . . . . 0.0 109.533 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 155' ' ' ASN . . . . . 0.43 ' O ' ' O ' ' A' ' 156' ' ' ARG . 49.1 p30 -165.83 177.36 7.23 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.202 -0.936 . . . . 0.0 109.51 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 156' ' ' ARG . . . . . 0.43 ' O ' ' O ' ' A' ' 155' ' ' ASN . 35.6 ttm180 58.89 155.06 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.366 -0.834 . . . . 0.0 109.662 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -81.26 -161.0 26.06 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 171.55 173.95 38.84 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 10.0 t 51.55 -125.69 2.35 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.246 -1.149 . . . . 0.0 109.347 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -150.33 134.72 17.22 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.133 -0.979 . . . . 0.0 109.375 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 161' ' ' ILE . . . . . 0.415 ' O ' ' O ' ' A' ' 162' ' ' GLU . 16.6 tt -168.92 162.18 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.237 -0.915 . . . . 0.0 109.346 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.415 ' O ' ' O ' ' A' ' 161' ' ' ILE . 63.9 mt-10 -58.81 -158.58 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.277 -0.889 . . . . 0.0 109.503 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 41.6 m -156.02 147.58 22.81 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.253 -0.905 . . . . 0.0 109.381 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.406 ' H ' ' HD3' ' A' ' 164' ' ' LYS . 0.0 OUTLIER -89.51 91.08 8.55 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.202 -0.936 . . . . 0.0 109.408 -179.963 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 165' ' ' HIS . . . . . 0.481 ' N ' ' ND1' ' A' ' 165' ' ' HIS . 0.9 OUTLIER -65.55 133.65 51.67 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.231 -0.918 . . . . 0.0 109.4 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 118.071 -0.966 . . . . 0.0 109.448 -179.938 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 8.9 tpt . . . . . 0 N--CA 1.491 1.596 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -71.93 130.24 16.7 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.7 t -169.66 -34.73 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.274 -1.133 . . . . 0.0 109.532 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 50.8 -101.71 0.1 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.213 -0.929 . . . . 0.0 109.458 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -168.47 46.26 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.224 -0.923 . . . . 0.0 109.492 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 52.2 -168.75 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.233 -0.917 . . . . 0.0 109.521 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 52.7 tt0 -66.51 -61.63 1.89 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.319 -0.863 . . . . 0.0 109.561 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 69.8 64.81 2.78 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.445 -1.462 . . . . 0.0 109.445 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.4 m -67.78 -51.85 44.04 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.249 -1.147 . . . . 0.0 109.504 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.408 HG12 ' N ' ' A' ' 11' ' ' SER . 41.4 t -147.98 156.84 9.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.266 -0.896 . . . . 0.0 109.35 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.423 ' OG ' ' N ' ' A' ' 12' ' ' SER . 79.1 p -164.53 -94.69 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.191 -0.943 . . . . 0.0 109.487 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.423 ' N ' ' OG ' ' A' ' 11' ' ' SER . 35.3 t -68.61 -22.92 64.41 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.308 -0.87 . . . . 0.0 109.389 179.855 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 62.94 67.92 1.87 Allowed Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 73.5 p -150.17 -16.63 0.25 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.271 -1.134 . . . . 0.0 109.243 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 89.0 mttt 50.51 67.2 0.96 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.252 -0.905 . . . . 0.0 109.407 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -69.8 179.64 2.14 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.27 -0.894 . . . . 0.0 109.54 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -77.48 -27.39 51.96 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.277 -0.889 . . . . 0.0 109.516 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 48.77 75.07 0.15 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.262 -0.899 . . . . 0.0 109.571 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 62.6 t-80 -170.54 -73.67 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.277 -0.889 . . . . 0.0 109.499 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 63.7 p -68.0 121.83 16.93 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.227 -0.921 . . . . 0.0 109.454 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.405 ' C ' ' H ' ' A' ' 23' ' ' LEU . . . -179.76 -155.41 15.22 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 179.906 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.412 ' O ' ' N ' ' A' ' 24' ' ' VAL . 44.4 mtmt -60.36 -5.39 1.13 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.2 -1.176 . . . . 0.0 109.433 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.405 ' H ' ' C ' ' A' ' 21' ' ' GLY . 16.3 mt -69.5 69.5 0.26 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.208 -0.932 . . . . 0.0 109.523 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.549 HG23 ' N ' ' A' ' 25' ' ' THR . 34.0 m -150.71 -45.36 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 121.28 -0.887 . . . . 0.0 109.354 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.549 ' N ' HG23 ' A' ' 24' ' ' VAL . 40.7 p 46.82 94.06 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.248 -0.907 . . . . 0.0 109.847 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.8 t -168.87 141.15 2.68 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.146 -0.971 . . . . 0.0 109.673 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 51.4 tttp -55.23 170.2 0.22 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.356 -0.84 . . . . 0.0 109.033 179.708 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -67.1 -17.96 68.5 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.249 -1.541 . . . . 0.0 109.249 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -64.42 100.11 0.34 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.26 -1.141 . . . . 0.0 109.383 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 33.1 ttmt -66.76 -65.61 0.66 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.29 -0.881 . . . . 0.0 109.48 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 80.5 mt-10 -59.32 115.65 3.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.232 -0.917 . . . . 0.0 109.422 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 11.5 tp -68.74 -40.96 79.57 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.224 -0.923 . . . . 0.0 109.271 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 16.8 mt -76.67 147.39 37.5 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.353 -0.842 . . . . 0.0 109.357 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.428 ' O ' ' O ' ' A' ' 35' ' ' ASP . 84.1 mt -69.2 -92.63 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.159 -0.963 . . . . 0.0 109.537 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.428 ' O ' ' O ' ' A' ' 34' ' ' ILE . 2.9 m-20 60.27 147.65 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.334 -0.854 . . . . 0.0 109.644 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -159.3 88.67 0.88 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.18 -0.95 . . . . 0.0 109.428 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.455 ' CD ' ' H ' ' A' ' 37' ' ' GLU . 1.9 mp0 -64.69 -14.06 56.87 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.231 -0.918 . . . . 0.0 109.471 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.8 mtpp -67.12 -120.89 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.228 -0.92 . . . . 0.0 109.492 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.9 t 52.68 88.19 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.143 -0.973 . . . . 0.0 109.409 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 81.6 p -73.38 -14.52 61.29 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.21 -0.932 . . . . 0.0 109.51 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 41.5 m 52.13 -111.21 0.56 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.274 -0.891 . . . . 0.0 109.453 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 179.36 16.33 0.03 OUTLIER Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 52.87 23.64 2.92 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.279 -1.13 . . . . 0.0 109.526 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.43 ' O ' ' O ' ' A' ' 45' ' ' THR . 10.8 m -70.71 60.76 0.23 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.335 -0.853 . . . . 0.0 109.493 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.43 ' O ' ' O ' ' A' ' 44' ' ' THR . 4.8 p 55.9 166.01 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.335 -0.853 . . . . 0.0 109.576 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.425 ' H ' HG22 ' A' ' 46' ' ' THR . 0.0 OUTLIER -90.9 117.48 29.54 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.216 -0.927 . . . . 0.0 109.486 -179.896 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 34.3 m -66.26 -49.44 67.13 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.216 -0.928 . . . . 0.0 109.298 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.581 ' CG ' HH11 ' A' ' 48' ' ' ARG . 3.4 mtt-85 -112.42 143.54 43.37 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -111.45 127.6 55.74 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.448 -0.782 . . . . 0.0 109.721 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.444 ' O ' ' O ' ' A' ' 51' ' ' CYS . 50.7 m -63.55 -52.66 60.15 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.215 -0.928 . . . . 0.0 109.862 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.444 ' O ' ' O ' ' A' ' 50' ' ' SER . 36.8 t -48.01 -93.85 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.147 -0.971 . . . . 0.0 109.187 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 11.3 t -63.09 138.29 58.51 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.053 -1.029 . . . . 0.0 108.369 179.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -73.06 104.81 4.27 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 120.918 -1.114 . . . . 0.0 109.543 -179.065 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 21.1 t -125.12 116.19 46.28 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 41.5 mm -126.64 121.6 58.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 22.8 m -128.17 110.59 12.58 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.445 -0.784 . . . . 0.0 109.193 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.528 ' H ' ' HB ' ' A' ' 69' ' ' THR . 7.3 mtmt -124.9 113.91 18.48 Favored 'General case' 0 N--CA 1.511 2.624 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 178.435 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 59.0 p -114.31 132.43 56.18 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.551 -0.718 . . . . 0.0 109.776 -179.455 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 59' ' ' VAL . 2.8 m -131.58 122.79 50.98 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.156 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 65.2 p -107.41 122.96 47.66 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.731 -0.605 . . . . 0.0 110.015 -179.406 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.444 ' ND2' ' O ' ' A' ' 65' ' ' ARG . 3.4 m-20 -113.2 145.16 41.46 Favored 'General case' 0 N--CA 1.511 2.61 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 179.68 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.59 -28.33 64.78 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 119.956 -1.715 . . . . 0.0 112.319 -177.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -67.33 2.38 1.7 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.536 -1.353 . . . . 0.0 109.827 -178.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.25 7.27 58.4 Favored Glycine 0 N--CA 1.496 2.681 0 N-CA-C 110.519 -1.032 . . . . 0.0 110.519 178.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.444 ' O ' ' ND2' ' A' ' 61' ' ' ASN . 16.0 mmm180 -95.98 109.46 21.84 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.876 -1.367 . . . . 0.0 108.344 179.058 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.7 p -134.67 109.24 8.49 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.347 -0.846 . . . . 0.0 109.336 -179.251 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -96.8 132.02 42.94 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.28 -0.887 . . . . 0.0 110.221 -179.069 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.522 HG22 ' H ' ' A' ' 70' ' ' LYS . 81.1 m -108.82 107.25 17.6 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.468 -0.77 . . . . 0.0 109.495 179.698 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.528 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 6.3 m -94.31 32.29 1.57 Allowed 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 178.626 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.522 ' H ' HG22 ' A' ' 68' ' ' THR . 55.0 tttm -73.54 68.83 1.19 Allowed 'General case' 0 N--CA 1.504 2.249 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.276 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -107.5 147.44 30.5 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.529 -0.732 . . . . 0.0 109.598 -179.756 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 38.6 t -128.08 125.99 65.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 20.5 t -128.19 116.06 40.81 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 CA-C-O 122.238 1.018 . . . . 0.0 109.351 179.649 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.491 ' O ' ' N ' ' A' ' 78' ' ' GLY . 1.1 ptpp? -76.77 41.57 0.27 Allowed 'General case' 0 C--N 1.287 -2.115 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.593 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.422 ' OG ' ' O ' ' A' ' 74' ' ' LYS . 11.4 p 55.9 -146.54 0.56 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.123 -0.985 . . . . 0.0 109.502 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.403 ' N ' ' OG ' ' A' ' 75' ' ' SER . 71.9 mt-10 -69.71 -35.17 74.82 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.249 -0.907 . . . . 0.0 109.286 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -171.46 34.98 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.299 -0.875 . . . . 0.0 109.086 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.491 ' N ' ' O ' ' A' ' 74' ' ' LYS . . . 54.6 67.64 2.08 Favored Glycine 0 N--CA 1.489 2.205 0 N-CA-C 109.327 -1.509 . . . . 0.0 109.327 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 71.8 m -47.88 -90.6 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.28 -1.129 . . . . 0.0 109.561 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 38.4 t0 -83.62 27.16 0.63 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.244 -0.91 . . . . 0.0 109.542 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 66.0 m -150.76 32.29 0.62 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.24 -0.912 . . . . 0.0 109.833 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.522 ' O ' ' N ' ' A' ' 84' ' ' ALA . . . -169.2 -59.41 0.03 OUTLIER Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.81 -1.316 . . . . 0.0 109.81 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 6.9 t70 66.5 -41.21 0.38 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.485 -1.009 . . . . 0.0 109.635 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.522 ' N ' ' O ' ' A' ' 82' ' ' GLY . . . -159.36 173.91 15.54 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.094 -1.004 . . . . 0.0 109.471 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.53 ' O ' ' N ' ' A' ' 87' ' ' ASP . 26.6 t70 -167.07 6.29 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.304 -0.873 . . . . 0.0 109.516 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.487 ' O ' ' N ' ' A' ' 88' ' ' TRP . 2.8 m-85 64.73 -67.64 0.11 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.369 -0.832 . . . . 0.0 109.567 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.53 ' N ' ' O ' ' A' ' 85' ' ' ASP . 2.9 p30 42.44 22.23 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.564 -0.71 . . . . 0.0 110.311 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' TRP . . . . . 0.487 ' N ' ' O ' ' A' ' 86' ' ' PHE . 6.7 m0 -91.73 -52.93 4.51 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.143 -0.973 . . . . 0.0 109.307 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 61.7 t60 -81.97 138.19 34.99 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.243 -0.911 . . . . 0.0 109.453 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.582 ' ND1' ' N ' ' A' ' 91' ' ' THR . 11.1 p80 -173.53 -52.44 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.293 -0.88 . . . . 0.0 109.536 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.582 ' N ' ' ND1' ' A' ' 90' ' ' HIS . 5.6 t -80.24 -130.23 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.267 -0.896 . . . . 0.0 109.657 -179.751 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.494 ' N ' HG23 ' A' ' 91' ' ' THR . 95.7 m-85 -155.14 77.06 5.04 Favored Pre-proline 0 N--CA 1.494 1.727 0 O-C-N 121.195 -0.941 . . . . 0.0 109.609 -179.551 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -64.87 -50.1 2.5 Favored 'Trans proline' 0 C--N 1.319 -1.007 0 C-N-CA 121.337 1.358 . . . . 0.0 109.746 -179.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 23.1 p 53.97 -153.43 0.28 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.347 -0.845 . . . . 0.0 109.535 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 52.4 mtp180 -151.32 -46.08 0.11 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.226 -0.921 . . . . 0.0 109.329 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -179.7 120.96 0.71 Allowed Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.452 -1.459 . . . . 0.0 109.452 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 10.3 p-10 -170.83 51.45 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.29 -1.124 . . . . 0.0 109.478 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.575 ' N ' HD12 ' A' ' 98' ' ' LEU . 7.8 mp -71.11 -111.47 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.33 -0.856 . . . . 0.0 109.251 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.436 ' O ' ' O ' ' A' ' 100' ' ' ASP . 73.1 m-20 -80.03 -108.12 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.219 -0.926 . . . . 0.0 109.406 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.436 ' O ' ' O ' ' A' ' 99' ' ' ASP . 7.8 m-20 58.12 111.26 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.298 -0.876 . . . . 0.0 109.603 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -59.42 -20.38 54.58 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.247 -0.908 . . . . 0.0 109.359 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -143.91 125.71 15.17 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.277 -0.89 . . . . 0.0 109.391 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 44.6 m80 -58.85 -46.57 87.43 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.269 -0.894 . . . . 0.0 109.407 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 78.9 mtm180 -64.4 176.5 1.06 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.302 -0.874 . . . . 0.0 109.511 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -169.58 121.91 0.72 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.319 -0.863 . . . . 0.0 109.319 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.466 ' CB ' ' NZ ' ' A' ' 106' ' ' LYS . 0.3 OUTLIER -65.92 133.25 50.48 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.246 -0.909 . . . . 0.0 109.414 179.952 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -78.95 86.38 4.83 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.207 -0.933 . . . . 0.0 109.443 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -167.35 65.61 0.08 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.198 -0.939 . . . . 0.0 109.529 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -65.16 -49.27 70.5 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.223 -0.923 . . . . 0.0 109.432 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' PHE . . . . . 0.49 ' CG ' ' N ' ' A' ' 111' ' ' THR . 37.5 t80 -127.81 -170.82 2.3 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.516 -0.74 . . . . 0.0 109.221 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' THR . . . . . 0.49 ' N ' ' CG ' ' A' ' 110' ' ' PHE . 78.0 p -48.43 113.87 0.84 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.156 -0.965 . . . . 0.0 109.542 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -69.75 -165.45 0.09 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.238 -0.914 . . . . 0.0 109.483 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 68.5 m -64.72 -83.57 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.219 -0.925 . . . . 0.0 109.44 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 13.5 t 52.63 51.55 15.83 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.238 -0.914 . . . . 0.0 109.468 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 63.5 t60 -64.4 148.19 51.0 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.335 -0.853 . . . . 0.0 109.412 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -167.28 -126.59 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.218 -0.926 . . . . 0.0 109.292 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 30.2 p90 -173.11 154.06 2.67 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.185 -0.947 . . . . 0.0 109.513 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -157.79 -88.27 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.259 -0.901 . . . . 0.0 109.392 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -46.23 148.53 2.25 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.865 -1.294 . . . . 0.0 109.865 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -160.84 -38.56 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.279 -1.13 . . . . 0.0 109.569 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 7.1 p 54.31 -169.34 0.06 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.187 -0.946 . . . . 0.0 109.511 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -161.16 -38.18 0.02 OUTLIER Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.582 ' N ' HD12 ' A' ' 123' ' ' LEU . 7.7 mp -80.57 147.37 30.81 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.179 -1.189 . . . . 0.0 109.221 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.534 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -68.44 162.15 64.09 Favored Pre-proline 0 N--CA 1.49 1.571 0 O-C-N 121.294 -0.879 . . . . 0.0 108.836 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.534 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 1.9 Cg_endo -57.11 -61.23 0.33 Allowed 'Trans proline' 0 C--N 1.319 -0.99 0 C-N-CA 121.372 1.381 . . . . 0.0 109.726 179.594 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.597 ' H ' ' CD ' ' A' ' 126' ' ' GLU . 13.4 mp0 -52.01 127.9 22.79 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.374 -0.829 . . . . 0.0 109.621 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' PHE . . . . . 0.522 ' O ' ' N ' ' A' ' 129' ' ' ALA . 95.6 m-85 -79.12 135.62 36.89 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.295 -0.878 . . . . 0.0 109.419 179.9 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.15 71.76 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.186 -0.946 . . . . 0.0 109.468 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.522 ' N ' ' O ' ' A' ' 127' ' ' PHE . . . -79.43 0.68 28.39 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.317 -0.865 . . . . 0.0 109.448 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 11.0 tp -56.22 -48.39 76.56 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.266 -0.896 . . . . 0.0 109.314 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -176.59 177.34 48.02 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -166.08 -77.21 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.333 -1.098 . . . . 0.0 109.364 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 98.7 p -57.0 125.96 25.0 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.161 -0.962 . . . . 0.0 109.422 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -67.79 -148.9 0.16 Allowed Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.509 -1.437 . . . . 0.0 109.509 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 46.6 t -64.51 -30.88 71.91 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.235 -1.156 . . . . 0.0 109.515 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.458 ' C ' ' H ' ' A' ' 138' ' ' SER . 12.3 m 53.13 70.61 0.57 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.253 -0.904 . . . . 0.0 109.431 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 49.2 m -75.27 34.3 0.11 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.226 -0.921 . . . . 0.0 109.535 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.458 ' H ' ' C ' ' A' ' 136' ' ' SER . 30.0 t -171.36 142.65 1.72 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.203 -0.936 . . . . 0.0 109.482 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -168.09 -43.98 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.3 -0.875 . . . . 0.0 109.438 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' THR . . . . . 0.429 ' O ' ' O ' ' A' ' 141' ' ' SER . 34.6 m -62.92 -28.91 70.38 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.226 -0.921 . . . . 0.0 109.402 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 141' ' ' SER . . . . . 0.429 ' O ' ' O ' ' A' ' 140' ' ' THR . 2.5 m 59.83 151.74 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.362 -0.836 . . . . 0.0 109.568 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 142' ' ' THR . . . . . 0.419 ' OG1' ' O ' ' A' ' 141' ' ' SER . 5.5 m -166.7 48.48 0.07 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.27 -0.894 . . . . 0.0 109.306 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 143' ' ' HIS . . . . . 0.481 ' N ' ' ND1' ' A' ' 143' ' ' HIS . 0.0 OUTLIER -80.73 85.38 6.1 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.175 -0.953 . . . . 0.0 109.476 -179.961 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 45.8 m -62.51 -60.96 2.8 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.309 -0.869 . . . . 0.0 109.431 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 11.6 ttmm -170.09 -53.84 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.129 -0.982 . . . . 0.0 109.469 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 36.7 tp60 -170.77 -76.78 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.237 -0.914 . . . . 0.0 109.484 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -82.03 107.0 14.39 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.177 -0.952 . . . . 0.0 109.419 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 39.6 t -75.75 -18.83 15.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.291 -0.88 . . . . 0.0 109.418 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 55.1 m -55.16 -52.99 61.53 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.251 -0.906 . . . . 0.0 109.474 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 150' ' ' SER . . . . . 0.423 ' OG ' ' N ' ' A' ' 151' ' ' SER . 32.0 t -168.43 -171.11 1.38 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.186 -0.946 . . . . 0.0 109.501 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 151' ' ' SER . . . . . 0.423 ' N ' ' OG ' ' A' ' 150' ' ' SER . 66.6 m -165.69 59.77 0.11 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.347 -0.846 . . . . 0.0 109.378 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 152' ' ' THR . . . . . 0.437 ' OG1' ' N ' ' A' ' 153' ' ' THR . 2.0 t -58.97 -174.49 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.239 -0.913 . . . . 0.0 109.352 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 153' ' ' THR . . . . . 0.437 ' N ' ' OG1' ' A' ' 152' ' ' THR . 81.9 p -61.61 150.18 37.0 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.197 -0.94 . . . . 0.0 109.472 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 30.4 m -63.27 -10.95 7.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.279 -0.888 . . . . 0.0 109.443 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -56.7 115.72 2.72 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.251 -0.906 . . . . 0.0 109.482 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 156' ' ' ARG . . . . . 0.576 ' CG ' HH11 ' A' ' 156' ' ' ARG . 3.4 mtt-85 -66.03 -55.74 15.09 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.231 -0.918 . . . . 0.0 109.366 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -175.59 89.85 0.08 OUTLIER Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.511 -1.435 . . . . 0.0 109.511 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 158' ' ' GLY . . . . . 0.489 ' C ' ' H ' ' A' ' 160' ' ' ALA . . . -164.08 135.57 3.83 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.514 -1.435 . . . . 0.0 109.514 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 4.9 m 56.58 4.63 0.16 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.255 -1.144 . . . . 0.0 109.533 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.489 ' H ' ' C ' ' A' ' 158' ' ' GLY . . . -86.86 -7.75 57.93 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.194 -0.941 . . . . 0.0 109.549 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 3.5 tp -160.16 -32.15 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.209 -0.932 . . . . 0.0 109.335 -179.872 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -65.43 -34.1 77.5 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.178 -0.951 . . . . 0.0 109.611 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 45.0 t -64.7 170.0 4.52 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.226 -0.921 . . . . 0.0 109.546 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -63.95 141.49 58.75 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.261 -0.899 . . . . 0.0 109.444 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 47.8 m80 -65.51 103.43 0.84 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.206 -0.934 . . . . 0.0 109.456 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 . . . . . 0 N--CA 1.489 1.514 0 CA-C-O 118.036 -0.983 . . . . 0.0 109.509 179.982 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.575 ' N ' ' SD ' ' A' ' 1' ' ' MET . 2.0 mpt? . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 65.81 43.29 94.25 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.524 -1.431 . . . . 0.0 109.524 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 40.5 m -71.15 -21.59 62.16 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.236 -1.156 . . . . 0.0 109.514 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 -61.51 -160.26 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.192 -0.943 . . . . 0.0 109.47 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -168.91 33.35 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.171 -0.956 . . . . 0.0 109.541 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 48.4 tt0 -153.64 -38.14 0.1 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.238 -0.914 . . . . 0.0 109.353 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -69.42 -147.08 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.182 -0.949 . . . . 0.0 109.414 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -173.79 176.05 46.35 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 51.4 m -60.79 113.9 2.74 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.231 -1.158 . . . . 0.0 109.426 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.9 p -65.8 -32.56 58.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.279 -0.888 . . . . 0.0 109.485 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.7 t -171.56 152.81 3.28 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.268 -0.895 . . . . 0.0 109.43 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 91.2 p -66.63 -165.6 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.199 -0.938 . . . . 0.0 109.459 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 65.82 49.7 57.64 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.533 ' O ' ' N ' ' A' ' 16' ' ' GLN . 69.1 p -58.94 160.45 5.93 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.211 -1.17 . . . . 0.0 109.454 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 9.8 ttmm 60.25 -75.4 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.479 -0.763 . . . . 0.0 109.746 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.533 ' N ' ' O ' ' A' ' 14' ' ' THR . 4.7 tp-100 57.21 53.89 7.32 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.278 -0.889 . . . . 0.0 109.46 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -74.64 -28.68 60.97 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.274 -0.891 . . . . 0.0 109.398 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.591 ' CD2' ' N ' ' A' ' 19' ' ' HIS . 54.9 t80 -165.85 170.49 13.78 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.223 -0.923 . . . . 0.0 109.469 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.591 ' N ' ' CD2' ' A' ' 18' ' ' PHE . 41.3 t60 -166.98 124.9 1.3 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.27 -0.894 . . . . 0.0 109.547 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 48.3 m -72.63 153.19 41.36 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.294 -0.879 . . . . 0.0 109.479 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -170.7 125.4 1.22 Allowed Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.45 ' C ' ' H ' ' A' ' 24' ' ' VAL . 15.6 ptpt -172.88 -2.49 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.196 -1.179 . . . . 0.0 109.493 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.46 ' C ' ' H ' ' A' ' 25' ' ' THR . 21.2 mt -72.51 39.75 0.08 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.228 -0.92 . . . . 0.0 109.416 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.461 ' O ' ' N ' ' A' ' 26' ' ' THR . 29.8 m -71.72 40.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.223 -0.923 . . . . 0.0 109.462 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.46 ' H ' ' C ' ' A' ' 23' ' ' LEU . 1.2 t -69.23 62.32 0.13 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.23 -0.919 . . . . 0.0 109.46 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.461 ' N ' ' O ' ' A' ' 24' ' ' VAL . 37.2 m -57.61 -50.31 73.56 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.241 -0.912 . . . . 0.0 109.398 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -72.77 80.68 1.14 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.28 -0.887 . . . . 0.0 109.391 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.06 76.49 0.06 OUTLIER Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -71.24 -16.47 62.49 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.317 -1.108 . . . . 0.0 109.328 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.489 ' CB ' ' NZ ' ' A' ' 30' ' ' LYS . 9.1 mtmp? -152.97 83.14 1.21 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.326 -0.859 . . . . 0.0 109.18 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 63.4 mt-10 -151.05 39.82 0.7 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.292 -0.88 . . . . 0.0 109.472 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.588 ' H ' HD23 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -83.68 -3.5 57.81 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.192 -0.943 . . . . 0.0 108.997 179.94 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 26.1 mt 55.65 77.37 0.23 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.311 -0.868 . . . . 0.0 109.547 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 25.0 pt -66.17 -155.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.266 -0.896 . . . . 0.0 109.18 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -61.23 167.26 3.23 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.934 -1.104 . . . . 0.0 109.417 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 32.7 m120 -66.86 143.04 57.1 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.239 -0.913 . . . . 0.0 109.463 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.437 ' N ' ' CD ' ' A' ' 37' ' ' GLU . 3.3 mp0 -71.69 152.47 42.77 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.374 -0.829 . . . . 0.0 109.508 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 45.9 mtmt -72.95 166.72 22.49 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.252 -0.905 . . . . 0.0 109.486 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.0 p -69.79 143.68 14.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.205 -0.934 . . . . 0.0 109.439 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 25.8 m 53.13 95.94 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.26 -0.9 . . . . 0.0 109.413 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 47.8 t -61.45 -170.29 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.28 -0.887 . . . . 0.0 109.474 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 70.19 147.63 0.36 Allowed Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 22.7 t-160 -59.67 106.03 0.43 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.241 -1.153 . . . . 0.0 109.298 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.533 ' OG1' ' N ' ' A' ' 45' ' ' THR . 2.2 t -64.33 -130.87 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.169 -0.957 . . . . 0.0 109.529 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.533 ' N ' ' OG1' ' A' ' 44' ' ' THR . 1.8 t -173.91 -26.94 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.11 -0.994 . . . . 0.0 109.433 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.403 ' C ' ' H ' ' A' ' 48' ' ' ARG . 5.4 t -72.92 39.83 0.09 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.295 -0.878 . . . . 0.0 109.346 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.45 ' H ' ' C ' ' A' ' 45' ' ' THR . 2.6 t -62.55 -3.52 1.5 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.351 -0.843 . . . . 0.0 109.477 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.403 ' H ' ' C ' ' A' ' 46' ' ' THR . 33.6 ptt180 -145.99 143.18 29.31 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.14 -0.975 . . . . 0.0 109.471 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.568 ' CG ' HH11 ' A' ' 49' ' ' ARG . 3.6 mtt-85 -93.41 144.58 25.2 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.299 -0.876 . . . . 0.0 109.806 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.4 m 54.42 175.42 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.286 -0.884 . . . . 0.0 110.151 179.462 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 32.3 t -62.35 -73.27 0.11 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.375 -0.828 . . . . 0.0 109.398 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 76.6 p -47.59 144.66 3.04 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.207 -0.933 . . . . 0.0 108.912 179.596 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.415 ' O ' ' O ' ' A' ' 73' ' ' VAL . 24.9 mtpp -75.19 102.65 5.06 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 120.895 -1.128 . . . . 0.0 109.794 -178.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.578 HG13 ' O ' ' A' ' 54' ' ' VAL . 11.4 p -124.67 120.51 59.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.429 HG23 ' O ' ' A' ' 55' ' ' ILE . 15.8 tt -126.29 130.52 71.98 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 24.4 m -128.57 117.89 22.04 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.546 -0.721 . . . . 0.0 109.483 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.544 ' H ' ' HB ' ' A' ' 69' ' ' THR . 26.4 ttpt -126.52 114.33 17.98 Favored 'General case' 0 N--CA 1.519 3.015 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 177.828 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 54.7 m -119.13 137.51 53.54 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.547 -0.721 . . . . 0.0 109.902 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 59' ' ' VAL . 2.8 m -132.25 120.79 44.4 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.78 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 33.9 p -109.66 133.5 53.04 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.739 -0.6 . . . . 0.0 109.555 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 18.2 t30 -134.65 169.59 17.08 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 121.352 -0.843 . . . . 0.0 109.424 179.463 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.13 -42.78 99.15 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.811 -1.18 . . . . 0.0 112.552 -177.244 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -68.8 2.65 2.41 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.393 -1.442 . . . . 0.0 110.457 -177.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.537 ' O ' ' N ' ' A' ' 66' ' ' THR . . . 95.01 10.89 57.08 Favored Glycine 0 N--CA 1.494 2.511 0 N-CA-C 110.059 -1.217 . . . . 0.0 110.059 179.123 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.582 ' CG ' HH11 ' A' ' 65' ' ' ARG . 0.1 OUTLIER -64.34 78.64 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.42 0 O-C-N 120.785 -1.421 . . . . 0.0 107.926 179.133 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.537 ' N ' ' O ' ' A' ' 64' ' ' GLY . 71.0 p -109.68 75.85 0.96 Allowed 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 -179.209 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -93.3 115.89 28.46 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.439 -0.788 . . . . 0.0 109.097 -179.098 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.7 m -97.74 109.99 22.64 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.186 -0.946 . . . . 0.0 109.703 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.544 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 3.6 m -85.27 35.09 0.58 Allowed 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 178.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 40.4 pttt -64.45 61.53 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.536 ' N ' ' O ' ' A' ' 69' ' ' THR . 13.2 mm-40 -88.09 150.21 23.5 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.061 -1.025 . . . . 0.0 109.547 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 15.8 t -129.0 116.24 39.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.415 ' O ' ' O ' ' A' ' 53' ' ' LYS . 98.7 t -109.71 129.82 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 CA-C-O 122.142 0.973 . . . . 0.0 109.151 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -86.54 163.56 17.41 Favored 'General case' 0 C--N 1.29 -2.018 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.527 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 70.0 m -63.6 112.09 2.66 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.303 -0.873 . . . . 0.0 109.53 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -85.33 -11.19 55.22 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.217 -0.927 . . . . 0.0 109.58 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -158.04 36.93 0.25 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.237 -0.914 . . . . 0.0 109.635 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -83.94 -28.65 33.9 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.308 -1.517 . . . . 0.0 109.308 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 11.3 t 53.83 13.19 0.5 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.341 -1.094 . . . . 0.0 109.526 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -171.06 25.68 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.198 -0.939 . . . . 0.0 109.575 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 51.2 t -158.97 67.61 0.43 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.292 -0.88 . . . . 0.0 109.532 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 167.87 -64.43 0.19 Allowed Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -78.61 114.98 18.0 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.232 -1.158 . . . . 0.0 109.438 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.418 ' O ' ' O ' ' A' ' 85' ' ' ASP . . . -63.63 -25.24 68.13 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.261 -0.899 . . . . 0.0 109.438 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.418 ' O ' ' O ' ' A' ' 84' ' ' ALA . 20.4 t70 55.96 167.23 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.21 -0.931 . . . . 0.0 109.508 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -81.64 148.81 28.86 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.23 -0.919 . . . . 0.0 109.471 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -69.15 104.4 2.16 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.171 -0.956 . . . . 0.0 109.402 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' TRP . . . . . 0.492 ' CD1' ' N ' ' A' ' 89' ' ' HIS . 76.7 t-105 -61.39 -101.12 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.308 -0.87 . . . . 0.0 109.46 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.492 ' N ' ' CD1' ' A' ' 88' ' ' TRP . 52.4 t-80 52.2 10.71 0.13 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.212 -0.93 . . . . 0.0 109.471 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.451 ' N ' ' C ' ' A' ' 88' ' ' TRP . 64.1 t60 -63.95 134.87 55.89 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.29 -0.882 . . . . 0.0 109.54 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.411 HG22 ' N ' ' A' ' 92' ' ' PHE . 41.8 m -156.79 157.79 35.66 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.256 -0.902 . . . . 0.0 109.366 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.411 ' N ' HG22 ' A' ' 91' ' ' THR . 97.3 m-85 -57.92 148.64 58.63 Favored Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.211 -0.931 . . . . 0.0 108.981 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -57.08 -58.23 1.0 Allowed 'Trans proline' 0 C--N 1.323 -0.772 0 C-N-CA 120.893 1.062 . . . . 0.0 109.788 179.602 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 23.1 t -57.27 178.36 0.07 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.29 -0.882 . . . . 0.0 109.539 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -165.88 -15.89 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.339 -0.851 . . . . 0.0 109.4 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -163.22 46.15 0.32 Allowed Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -57.97 133.04 55.15 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.304 -1.115 . . . . 0.0 109.437 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 16.7 mt -69.31 -169.15 0.19 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.347 -0.846 . . . . 0.0 109.451 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -157.84 140.97 15.16 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.277 -0.889 . . . . 0.0 109.396 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -62.56 119.97 10.24 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.218 -0.926 . . . . 0.0 109.424 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 31.5 p90 -65.44 -18.79 65.59 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.321 -0.862 . . . . 0.0 109.45 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 83.0 t80 43.04 82.81 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.555 -0.716 . . . . 0.0 110.103 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -71.62 -47.96 51.12 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.164 -0.96 . . . . 0.0 109.484 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.583 HH11 ' CG ' ' A' ' 104' ' ' ARG . 0.3 OUTLIER -171.25 -60.25 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.263 -0.898 . . . . 0.0 109.355 179.959 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -158.22 142.04 15.54 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.276 -0.89 . . . . 0.0 109.365 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.469 ' O ' ' N ' ' A' ' 108' ' ' ASP . 86.3 tttt -65.76 90.12 0.12 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.222 -0.924 . . . . 0.0 109.455 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 17.7 t70 50.69 -93.93 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.244 -0.91 . . . . 0.0 109.495 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.469 ' N ' ' O ' ' A' ' 106' ' ' LYS . 25.2 t70 -169.97 133.28 1.17 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.335 -0.853 . . . . 0.0 109.471 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 69.1 m-85 -67.93 -47.1 69.66 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.255 -0.903 . . . . 0.0 109.442 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' PHE . . . . . 0.462 ' CD2' ' N ' ' A' ' 111' ' ' THR . 70.0 t80 51.47 -101.27 0.1 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.319 -0.863 . . . . 0.0 109.553 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' THR . . . . . 0.462 ' N ' ' CD2' ' A' ' 110' ' ' PHE . 93.0 m -74.53 156.56 36.73 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.132 -0.98 . . . . 0.0 109.47 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.424 ' N ' HG22 ' A' ' 111' ' ' THR . 71.6 ttt180 -168.4 -36.56 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.272 -0.893 . . . . 0.0 109.44 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 66.1 m -165.85 48.16 0.08 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.322 -0.861 . . . . 0.0 109.479 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 88.7 p -71.25 89.06 0.86 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.192 -0.943 . . . . 0.0 109.497 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -71.12 167.18 19.86 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.164 -0.96 . . . . 0.0 109.484 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 51.3 tt0 53.27 73.0 0.39 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.319 -0.863 . . . . 0.0 109.459 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -72.77 147.41 45.57 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.228 -0.92 . . . . 0.0 109.447 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -171.03 -166.49 0.48 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.162 -0.961 . . . . 0.0 109.554 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.416 ' O ' ' N ' ' A' ' 121' ' ' THR . . . -179.11 40.27 0.08 OUTLIER Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.409 -1.476 . . . . 0.0 109.409 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -70.03 66.73 0.27 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.257 -1.143 . . . . 0.0 109.528 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.416 ' N ' ' O ' ' A' ' 119' ' ' GLY . 73.8 p -55.85 179.27 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.184 -0.947 . . . . 0.0 109.483 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -69.33 150.48 49.98 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.43 -1.468 . . . . 0.0 109.43 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 14.8 mt -68.59 148.42 50.52 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.123 -1.222 . . . . 0.0 109.681 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.54 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -66.7 162.31 52.63 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.33 -0.856 . . . . 0.0 108.844 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.54 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 2.1 Cg_endo -56.56 -45.14 39.31 Favored 'Trans proline' 0 C--N 1.32 -0.968 0 C-N-CA 121.436 1.424 . . . . 0.0 110.009 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 58.36 169.98 0.05 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.258 -0.901 . . . . 0.0 109.311 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' PHE . . . . . 0.474 ' CD1' ' O ' ' A' ' 127' ' ' PHE . 52.3 p90 -75.27 133.22 41.38 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.251 -0.906 . . . . 0.0 109.478 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -169.14 -88.77 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.199 -0.938 . . . . 0.0 109.407 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -162.94 -168.84 1.87 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.266 -0.896 . . . . 0.0 109.47 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 44.6 tp -166.61 75.88 0.18 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.222 -0.924 . . . . 0.0 109.415 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 65.08 -126.93 32.2 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.753 -1.339 . . . . 0.0 109.753 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -66.83 86.99 0.13 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.26 -1.141 . . . . 0.0 109.694 -179.692 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 71.7 m -84.51 158.4 20.99 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.223 -0.923 . . . . 0.0 109.335 179.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 177.0 -166.5 37.23 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 31.4 t -166.96 -11.25 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.279 -1.13 . . . . 0.0 109.4 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.2 t 53.62 -119.64 1.53 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.305 -0.872 . . . . 0.0 109.44 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 93.5 p -167.62 139.06 3.03 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.282 -0.886 . . . . 0.0 109.49 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.47 ' OG ' ' N ' ' A' ' 139' ' ' LYS . 30.9 t -171.73 -168.55 0.6 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.273 -0.892 . . . . 0.0 109.438 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.47 ' N ' ' OG ' ' A' ' 138' ' ' SER . 7.5 mtpm? 50.99 -179.64 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.251 -0.905 . . . . 0.0 109.498 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 35.0 m -72.56 137.12 46.02 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.266 -0.896 . . . . 0.0 109.503 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 28.6 t -172.97 -63.81 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.248 -0.908 . . . . 0.0 109.404 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 77.0 p -64.87 114.76 4.73 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.236 -0.915 . . . . 0.0 109.521 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.09 -143.76 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.231 -0.918 . . . . 0.0 109.445 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 43.8 t -62.42 176.55 0.61 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.206 -0.934 . . . . 0.0 109.542 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm 54.3 80.08 0.13 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.287 -0.883 . . . . 0.0 109.429 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 72.3 mm-40 -72.42 -80.4 0.06 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.263 -0.898 . . . . 0.0 109.374 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -171.29 -29.21 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.233 -0.917 . . . . 0.0 109.414 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 38.7 t -58.8 -75.38 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.275 -0.891 . . . . 0.0 109.473 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 33.3 t -70.16 116.96 11.13 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.221 -0.924 . . . . 0.0 109.436 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 30.7 t -170.07 30.11 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.271 -0.893 . . . . 0.0 109.404 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 50.6 m -79.84 -64.53 1.16 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.264 -0.898 . . . . 0.0 109.368 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 80.5 p -70.12 -30.85 68.14 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.296 -0.877 . . . . 0.0 109.543 -179.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 16.3 m -69.0 102.4 1.6 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.196 -0.94 . . . . 0.0 109.494 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 11.1 p -170.97 -34.15 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.272 -0.892 . . . . 0.0 109.391 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 155' ' ' ASN . . . . . 0.502 ' C ' ' H ' ' A' ' 157' ' ' GLY . 77.2 m-20 51.48 -105.61 0.22 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.281 -0.887 . . . . 0.0 109.545 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 156' ' ' ARG . . . . . 0.565 ' CG ' HH11 ' A' ' 156' ' ' ARG . 0.2 OUTLIER 60.99 -1.47 0.25 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.347 -0.846 . . . . 0.0 109.588 -179.867 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 157' ' ' GLY . . . . . 0.502 ' H ' ' C ' ' A' ' 155' ' ' ASN . . . -179.07 -166.14 34.52 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 46.89 -139.6 7.64 Favored Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.675 -1.37 . . . . 0.0 109.675 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 13.0 t 51.05 -137.96 1.1 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.263 -1.139 . . . . 0.0 109.53 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . 57.19 45.39 20.63 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.334 -0.854 . . . . 0.0 109.455 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 74.7 mt -67.65 101.23 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.268 -0.895 . . . . 0.0 109.472 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -73.05 158.03 36.19 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.304 -0.872 . . . . 0.0 109.515 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 41.6 t -162.43 0.45 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.186 -0.946 . . . . 0.0 109.439 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 59.8 mttm 52.95 -151.2 0.32 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.319 -0.863 . . . . 0.0 109.476 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 76.1 t60 -59.75 127.66 33.05 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.237 -0.915 . . . . 0.0 109.463 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 57.3 t80 . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 118.016 -0.992 . . . . 0.0 109.441 179.966 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.0 mtt . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -68.11 136.0 30.32 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 77.3 p -68.79 89.47 0.39 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.207 -1.173 . . . . 0.0 109.502 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -49.59 -54.49 17.96 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.26 -0.9 . . . . 0.0 109.498 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -169.92 -28.03 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.252 -0.905 . . . . 0.0 109.548 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.427 ' CD ' ' N ' ' A' ' 6' ' ' GLU . 20.7 mp0 -66.5 156.87 33.65 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.294 -0.879 . . . . 0.0 109.54 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 56.61 41.14 28.88 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.342 -0.849 . . . . 0.0 109.408 -179.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 62.83 141.78 0.01 OUTLIER Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.415 ' O ' ' O ' ' A' ' 10' ' ' VAL . 40.9 t -71.55 -42.08 68.31 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.328 -1.101 . . . . 0.0 109.386 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.415 ' O ' ' O ' ' A' ' 9' ' ' SER . 16.9 t 53.53 99.73 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.25 -0.906 . . . . 0.0 109.436 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.2 m -163.97 125.38 2.3 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.288 -0.882 . . . . 0.0 109.434 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.5 t -168.68 -52.52 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.198 -0.939 . . . . 0.0 109.435 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -69.56 70.49 0.52 Allowed Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.4 ' OG1' ' N ' ' A' ' 15' ' ' LYS . 82.6 p -66.41 -105.49 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.214 -1.168 . . . . 0.0 109.485 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.4 ' N ' ' OG1' ' A' ' 14' ' ' THR . 22.8 pttm -173.0 -24.31 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.283 -0.885 . . . . 0.0 109.514 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 54.2 tt0 -62.1 98.96 0.11 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.28 -0.887 . . . . 0.0 109.532 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.646 ' CD ' ' H ' ' A' ' 17' ' ' GLU . 1.7 pm0 -73.29 -28.06 61.9 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.294 -0.879 . . . . 0.0 109.437 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.48 ' CD2' ' N ' ' A' ' 19' ' ' HIS . 80.2 t80 -170.3 -97.51 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.184 -0.947 . . . . 0.0 109.532 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.505 ' O ' ' N ' ' A' ' 21' ' ' GLY . 56.4 t-80 51.1 59.39 4.64 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.207 -0.933 . . . . 0.0 109.525 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.1 m 66.25 -46.26 0.42 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.605 -0.684 . . . . 0.0 109.764 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.505 ' N ' ' O ' ' A' ' 19' ' ' HIS . . . 72.17 46.38 35.39 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 94.2 mttt 52.55 -174.1 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.254 -1.145 . . . . 0.0 109.48 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 15.4 tp -71.27 -78.51 0.08 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.232 -0.917 . . . . 0.0 109.165 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 8.3 p -67.65 140.36 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.254 -0.904 . . . . 0.0 109.411 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.402 ' O ' ' OG1' ' A' ' 26' ' ' THR . 61.6 p -77.47 -167.59 0.97 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.257 -0.902 . . . . 0.0 109.494 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.402 ' OG1' ' O ' ' A' ' 25' ' ' THR . 54.6 m -166.29 109.71 0.77 Allowed 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.241 -0.912 . . . . 0.0 109.486 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.1 pttm -170.53 12.16 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.284 -0.885 . . . . 0.0 109.489 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 176.01 -159.28 26.59 Favored Glycine 0 N--CA 1.49 2.261 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.3 m-20 -104.47 -64.99 1.06 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.437 -1.037 . . . . 0.0 109.36 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -71.01 114.01 8.63 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.335 -0.853 . . . . 0.0 109.473 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.411 ' C ' ' H ' ' A' ' 33' ' ' LEU . 46.5 mt-10 -65.17 126.01 26.79 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.173 -0.954 . . . . 0.0 109.458 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.562 ' N ' HD12 ' A' ' 32' ' ' LEU . 8.2 mp -64.79 -0.14 1.37 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.238 -0.914 . . . . 0.0 109.162 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.426 ' O ' ' O ' ' A' ' 32' ' ' LEU . 10.7 tp 53.88 100.33 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.338 -0.851 . . . . 0.0 109.456 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 15.6 mm -58.0 160.52 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.296 -0.878 . . . . 0.0 109.463 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -160.84 -44.09 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.32 -0.863 . . . . 0.0 109.32 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -157.51 84.05 0.9 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.379 -0.826 . . . . 0.0 109.388 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.0 tt0 -73.48 -68.45 0.5 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.255 -0.903 . . . . 0.0 109.709 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -95.36 -171.72 2.47 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.202 -0.936 . . . . 0.0 109.354 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 19.2 m -77.67 -13.62 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.27 -0.894 . . . . 0.0 109.376 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 20.5 p 50.1 40.61 22.05 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.231 -0.918 . . . . 0.0 109.474 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 41.4 t -75.51 -8.9 57.95 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.264 -0.897 . . . . 0.0 109.481 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 68.93 -135.0 27.8 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 53.35 -172.41 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.267 -1.137 . . . . 0.0 109.436 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 55.9 m -85.61 146.81 26.7 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.265 -0.897 . . . . 0.0 109.398 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.439 ' O ' ' O ' ' A' ' 46' ' ' THR . 74.4 p -65.86 136.17 55.79 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.175 -0.953 . . . . 0.0 109.429 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.557 ' C ' ' H ' ' A' ' 48' ' ' ARG . 1.3 m -60.24 -146.16 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.398 -0.814 . . . . 0.0 109.595 -179.538 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.551 ' H ' HG22 ' A' ' 46' ' ' THR . 2.6 m 65.05 -14.3 0.11 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.286 -0.884 . . . . 0.0 110.007 -179.75 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.557 ' H ' ' C ' ' A' ' 46' ' ' THR . 37.9 ttm180 -146.69 143.59 28.86 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 120.983 -1.073 . . . . 0.0 109.076 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 -87.71 142.42 27.84 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.256 -0.902 . . . . 0.0 109.403 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.425 ' O ' ' O ' ' A' ' 51' ' ' CYS . 87.8 p -66.72 163.0 20.07 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.244 -0.91 . . . . 0.0 109.308 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.425 ' O ' ' O ' ' A' ' 50' ' ' SER . 4.3 t 62.3 139.17 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.324 -0.86 . . . . 0.0 109.395 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.583 ' N ' ' SG ' ' A' ' 81' ' ' CYS . 10.1 t 51.61 178.25 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.283 -0.886 . . . . 0.0 109.425 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.435 ' N ' ' OG ' ' A' ' 52' ' ' SER . 56.7 mttp -113.86 111.64 22.06 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.527 -0.733 . . . . 0.0 109.536 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 91.7 t -126.68 117.17 47.34 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.452 -0.78 . . . . 0.0 109.565 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 29.1 mm -111.3 116.04 51.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.945 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 179.403 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.6 m -129.27 113.49 15.07 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.423 -0.798 . . . . 0.0 109.593 -179.59 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.516 ' N ' ' OG1' ' A' ' 69' ' ' THR . 1.5 mtmm -122.73 111.64 16.96 Favored 'General case' 0 N--CA 1.511 2.587 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 178.294 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 63.4 m -119.36 135.37 54.75 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.477 -0.765 . . . . 0.0 109.446 -179.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.523 HG23 ' O ' ' A' ' 59' ' ' VAL . 2.9 m -131.81 118.93 39.99 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.212 0 O-C-N 121.544 -0.722 . . . . 0.0 109.571 179.123 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 81.2 p -112.8 136.46 52.39 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 179.402 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.521 ' OD1' ' N ' ' A' ' 62' ' ' ALA . 7.0 t30 -163.91 163.88 23.49 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 120.586 -1.322 . . . . 0.0 110.095 179.356 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.521 ' N ' ' OD1' ' A' ' 61' ' ' ASN . . . -74.68 -10.45 59.54 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.013 -1.055 . . . . 0.0 110.898 -179.346 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.408 ' CB ' ' ND2' ' A' ' 61' ' ' ASN . 26.7 t70 -75.25 6.25 4.61 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.187 -0.946 . . . . 0.0 109.752 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.19 10.89 79.54 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 108.91 -1.676 . . . . 0.0 108.91 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -92.61 97.56 10.88 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.936 -1.332 . . . . 0.0 108.779 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 54.1 p -127.41 68.77 1.29 Allowed 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 179.693 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -94.24 129.46 40.86 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.523 -0.736 . . . . 0.0 111.053 -178.027 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -111.28 111.76 23.05 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 178.712 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.516 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 22.4 p -109.91 37.22 2.73 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 179.167 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 45.4 pttt -65.72 61.39 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.906 0 C-N-CA 120.252 -0.579 . . . . 0.0 109.46 179.287 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.514 ' N ' ' O ' ' A' ' 69' ' ' THR . 50.0 mt-10 -84.92 146.78 27.08 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.169 -0.957 . . . . 0.0 109.609 -179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 22.4 m -127.44 143.23 41.31 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 12.3 t -128.55 119.17 49.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.027 0 CA-C-O 122.029 0.918 . . . . 0.0 109.064 179.319 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -69.76 162.3 28.09 Favored 'General case' 0 C--N 1.291 -1.954 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.542 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 13.2 m -75.52 144.32 42.03 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.314 -0.866 . . . . 0.0 109.483 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -85.3 -13.92 48.2 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.312 -0.867 . . . . 0.0 109.271 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -172.27 46.62 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.345 -0.847 . . . . 0.0 109.364 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.498 ' C ' ' H ' ' A' ' 80' ' ' ASP . . . -81.44 -28.45 43.84 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.667 -1.373 . . . . 0.0 109.667 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 6.3 t 58.03 3.31 0.23 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.329 -1.1 . . . . 0.0 109.327 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.498 ' H ' ' C ' ' A' ' 78' ' ' GLY . 23.6 m-20 -160.38 27.21 0.16 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.319 -0.863 . . . . 0.0 108.922 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.583 ' SG ' ' N ' ' A' ' 52' ' ' SER . 4.5 t -165.62 38.16 0.06 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.471 -0.768 . . . . 0.0 109.607 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 175.59 -75.12 0.08 OUTLIER Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.455 ' O ' ' HB3' ' A' ' 84' ' ' ALA . 6.6 m-20 -73.46 -28.71 62.09 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.233 -1.157 . . . . 0.0 109.595 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.455 ' HB3' ' O ' ' A' ' 83' ' ' ASP . . . 64.26 165.17 0.14 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.312 -0.868 . . . . 0.0 109.398 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 54.03 -159.34 0.16 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.205 -0.935 . . . . 0.0 109.289 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 34.0 p90 -165.49 26.22 0.05 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.148 -0.97 . . . . 0.0 109.419 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -170.55 171.19 6.5 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.226 -0.921 . . . . 0.0 109.493 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' TRP . . . . . 0.441 ' O ' ' NE2' ' A' ' 90' ' ' HIS . 5.4 m0 -88.86 99.58 12.5 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.17 -0.956 . . . . 0.0 109.354 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.524 ' O ' ' CG ' ' A' ' 90' ' ' HIS . 46.5 p-80 -55.22 -170.08 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.246 -0.908 . . . . 0.0 109.475 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.524 ' CG ' ' O ' ' A' ' 89' ' ' HIS . 91.4 m-70 -157.18 111.71 2.71 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.295 -0.878 . . . . 0.0 109.503 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 29.3 m -51.87 114.27 1.24 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.275 -0.89 . . . . 0.0 109.413 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -61.03 149.2 82.57 Favored Pre-proline 0 N--CA 1.49 1.542 0 O-C-N 121.297 -0.877 . . . . 0.0 109.032 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -56.66 -166.94 0.02 OUTLIER 'Trans proline' 0 C--N 1.323 -0.804 0 C-N-CA 120.965 1.11 . . . . 0.0 109.724 179.594 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 74.8 m -167.79 -165.26 0.63 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.249 -0.907 . . . . 0.0 109.359 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 43.6 ttp180 -168.93 115.26 0.61 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.246 -0.909 . . . . 0.0 109.52 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 175.17 -53.16 0.13 Allowed Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -173.6 -13.23 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.33 -1.1 . . . . 0.0 109.525 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 36.8 mt -72.13 -72.69 0.22 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.276 -0.89 . . . . 0.0 109.383 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -76.57 79.18 3.25 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.181 -0.949 . . . . 0.0 109.565 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -71.6 82.79 0.84 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.271 -0.893 . . . . 0.0 109.216 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -71.49 -56.75 5.3 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.296 -0.877 . . . . 0.0 109.585 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -87.86 117.61 26.82 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.13 -0.981 . . . . 0.0 109.114 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 10.3 m80 -58.68 -38.73 78.84 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.267 -0.896 . . . . 0.0 109.813 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 62.4 ttt180 56.39 60.83 2.95 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.269 -0.895 . . . . 0.0 109.464 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -161.41 -33.95 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.235 -0.916 . . . . 0.0 109.542 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 18.2 tptm -59.54 135.78 57.78 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.172 -0.955 . . . . 0.0 109.414 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.405 ' OD1' ' N ' ' A' ' 107' ' ' ASP . 16.5 p-10 -171.19 156.17 4.62 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.328 -0.858 . . . . 0.0 109.458 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.48 ' CG ' ' H ' ' A' ' 109' ' ' PHE . 25.5 t70 -68.61 -168.64 0.13 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.288 -0.882 . . . . 0.0 109.4 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.48 ' H ' ' CG ' ' A' ' 108' ' ' ASP . 69.5 t80 -59.55 -29.45 67.93 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.245 -0.909 . . . . 0.0 109.242 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' PHE . . . . . 0.515 ' O ' ' CD2' ' A' ' 110' ' ' PHE . 64.1 t80 -154.79 13.52 0.4 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.245 -0.909 . . . . 0.0 109.438 -179.821 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 7.5 m 57.32 103.12 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.317 -0.864 . . . . 0.0 109.559 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 14.9 ptm180 -55.86 165.2 0.97 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.282 -0.887 . . . . 0.0 109.502 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 57.3 p -172.07 -102.24 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.257 -0.902 . . . . 0.0 109.448 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 57.4 m -75.39 119.94 20.16 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.293 -0.879 . . . . 0.0 109.485 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -74.29 -135.97 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.293 -0.88 . . . . 0.0 109.502 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.474 ' CD ' ' N ' ' A' ' 116' ' ' GLU . 1.4 pm0 -165.11 41.95 0.08 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.236 -0.915 . . . . 0.0 109.487 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -71.49 145.23 49.33 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.206 -0.934 . . . . 0.0 109.43 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.475 ' CG ' ' H ' ' A' ' 119' ' ' GLY . 3.8 p-10 -73.68 -104.55 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.267 -0.896 . . . . 0.0 109.508 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.475 ' H ' ' CG ' ' A' ' 118' ' ' ASP . . . -67.79 -92.89 0.05 OUTLIER Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.574 -1.411 . . . . 0.0 109.574 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 37.7 ttm180 -165.93 125.26 1.65 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.321 -1.106 . . . . 0.0 109.474 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 52.9 m -73.87 121.45 20.93 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.251 -0.905 . . . . 0.0 109.446 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 158.56 107.57 0.24 Allowed Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.365 -1.494 . . . . 0.0 109.365 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.59 ' N ' HD12 ' A' ' 123' ' ' LEU . 7.5 mp -88.01 147.92 24.77 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.233 -1.157 . . . . 0.0 109.195 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.513 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -70.95 162.14 73.95 Favored Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 121.161 -0.962 . . . . 0.0 108.784 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.513 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 2.1 Cg_endo -56.5 -178.78 0.08 OUTLIER 'Trans proline' 0 C--N 1.318 -1.051 0 C-N-CA 121.369 1.379 . . . . 0.0 109.765 179.642 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.423 ' O ' ' O ' ' A' ' 127' ' ' PHE . 46.8 mt-10 49.18 39.73 16.13 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.271 -0.893 . . . . 0.0 109.437 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' PHE . . . . . 0.423 ' O ' ' O ' ' A' ' 126' ' ' GLU . 45.8 m-85 49.72 -176.76 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.265 -0.897 . . . . 0.0 109.494 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -78.33 -51.73 9.67 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.342 -0.849 . . . . 0.0 109.348 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -64.73 110.99 2.57 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.287 -0.883 . . . . 0.0 109.406 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.475 ' O ' ' N ' ' A' ' 132' ' ' GLU . 16.5 mt -70.36 -38.64 74.83 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.24 -0.912 . . . . 0.0 109.42 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 131' ' ' GLY . . . . . 0.425 ' O ' ' O ' ' A' ' 132' ' ' GLU . . . 67.84 -63.39 0.33 Allowed Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.475 ' N ' ' O ' ' A' ' 130' ' ' LEU . 12.8 tp10 59.07 155.13 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.385 -1.068 . . . . 0.0 109.572 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 40.7 t -53.89 132.15 41.31 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.224 -0.923 . . . . 0.0 109.5 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 68.99 159.55 1.84 Allowed Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 98.8 p -169.93 27.84 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.186 -1.184 . . . . 0.0 109.409 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 30.1 t -170.46 -46.85 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.323 -0.861 . . . . 0.0 109.522 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 40.5 t -67.98 -8.16 34.97 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.252 -0.905 . . . . 0.0 109.439 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 60.8 m -59.53 -80.93 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.27 -0.894 . . . . 0.0 109.415 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -61.97 155.25 24.19 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.215 -0.928 . . . . 0.0 109.534 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' THR . . . . . 0.479 ' OG1' ' N ' ' A' ' 141' ' ' SER . 3.1 t -167.42 -167.02 0.83 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.242 -0.911 . . . . 0.0 109.475 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 141' ' ' SER . . . . . 0.479 ' N ' ' OG1' ' A' ' 140' ' ' THR . 85.6 p -167.42 17.91 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.348 -0.845 . . . . 0.0 109.413 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 142' ' ' THR . . . . . 0.409 ' O ' ' O ' ' A' ' 143' ' ' HIS . 2.8 m 57.58 20.89 6.6 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.297 -0.877 . . . . 0.0 109.332 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 143' ' ' HIS . . . . . 0.409 ' O ' ' O ' ' A' ' 142' ' ' THR . 11.5 m170 54.29 173.95 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.255 -0.903 . . . . 0.0 109.524 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 144' ' ' SER . . . . . 0.412 ' O ' ' OG ' ' A' ' 144' ' ' SER . 53.5 p 50.48 79.3 0.09 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.231 -0.918 . . . . 0.0 109.508 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 145' ' ' LYS . . . . . 0.453 ' C ' ' H ' ' A' ' 147' ' ' PHE . 60.7 mttp -65.16 168.14 7.16 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.29 -0.881 . . . . 0.0 109.471 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 146' ' ' GLN . . . . . 0.453 ' C ' ' H ' ' A' ' 148' ' ' VAL . 84.4 mt-30 -75.35 21.23 0.14 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.256 -0.902 . . . . 0.0 109.42 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 147' ' ' PHE . . . . . 0.515 ' CD2' ' O ' ' A' ' 147' ' ' PHE . 65.6 t80 -74.19 16.6 0.23 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.282 -0.886 . . . . 0.0 109.48 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 148' ' ' VAL . . . . . 0.453 ' H ' ' C ' ' A' ' 146' ' ' GLN . 21.6 t 53.1 89.94 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.275 -0.89 . . . . 0.0 109.431 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 14.7 m 52.03 -173.45 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.25 -0.906 . . . . 0.0 109.489 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 29.4 t -168.72 -64.92 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.274 -0.891 . . . . 0.0 109.465 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 53.4 m -68.8 124.36 23.46 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.276 -0.89 . . . . 0.0 109.495 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 80.4 p -68.51 104.67 1.99 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.297 -0.877 . . . . 0.0 109.551 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 31.7 m -69.91 -30.7 68.18 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.259 -0.9 . . . . 0.0 109.431 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 23.6 t 53.36 80.69 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.305 -0.872 . . . . 0.0 109.471 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 20.8 p30 -73.72 -27.64 61.3 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.214 -0.929 . . . . 0.0 109.366 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 59.9 ttt180 -48.85 169.13 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.261 -0.899 . . . . 0.0 109.42 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -154.76 133.5 3.86 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.546 -1.421 . . . . 0.0 109.546 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -56.16 -33.69 61.5 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 61.6 m -162.55 85.5 0.56 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.178 -1.19 . . . . 0.0 109.511 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -170.35 45.68 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.255 -0.903 . . . . 0.0 109.368 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 20.1 pt -152.29 42.11 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.336 -0.852 . . . . 0.0 109.275 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -169.04 16.95 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.308 -0.87 . . . . 0.0 109.479 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 163' ' ' SER . . . . . 0.434 ' O ' ' O ' ' A' ' 164' ' ' LYS . 66.8 m -165.13 97.63 0.72 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.207 -0.933 . . . . 0.0 109.426 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.434 ' O ' ' O ' ' A' ' 163' ' ' SER . 35.6 mttp 60.66 139.54 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.421 -0.799 . . . . 0.0 109.731 -179.943 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -76.69 138.21 39.87 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.11 -0.994 . . . . 0.0 109.411 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 57.7 t80 . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 117.998 -1.001 . . . . 0.0 109.525 179.976 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.3 mtt . . . . . 0 N--CA 1.491 1.598 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 175.76 41.56 0.05 OUTLIER Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.421 ' H ' ' H ' ' A' ' 4' ' ' PHE . 1.5 t -170.42 -16.42 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.296 -1.12 . . . . 0.0 109.369 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.475 ' O ' ' N ' ' A' ' 6' ' ' GLU . 55.6 m-85 53.06 -144.96 0.61 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.229 -0.919 . . . . 0.0 109.465 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 52.2 -91.48 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.358 -0.839 . . . . 0.0 109.473 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.475 ' N ' ' O ' ' A' ' 4' ' ' PHE . 28.5 tt0 -83.95 120.97 26.74 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.075 -1.016 . . . . 0.0 109.373 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -56.85 -10.71 1.14 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.239 -0.913 . . . . 0.0 109.448 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.427 ' H ' ' HG2' ' A' ' 6' ' ' GLU . . . -50.59 146.34 9.2 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.423 ' OG ' ' N ' ' A' ' 10' ' ' VAL . 47.8 t -72.22 -136.94 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.299 -1.118 . . . . 0.0 109.419 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.425 HG13 ' N ' ' A' ' 11' ' ' SER . 9.1 p -163.12 -36.0 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.222 -0.924 . . . . 0.0 109.519 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.425 ' N ' HG13 ' A' ' 10' ' ' VAL . 87.4 p -71.27 -153.45 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.159 -0.963 . . . . 0.0 109.487 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 39.0 t -169.22 50.6 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.209 -0.932 . . . . 0.0 109.52 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 65.51 114.59 0.01 OUTLIER Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.426 ' OG1' ' N ' ' A' ' 15' ' ' LYS . 60.0 p -53.39 -74.28 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.225 -1.161 . . . . 0.0 109.448 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.426 ' N ' ' OG1' ' A' ' 14' ' ' THR . 32.9 ttmt -170.73 44.34 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.209 -0.932 . . . . 0.0 109.424 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -81.06 127.05 32.18 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.201 -0.937 . . . . 0.0 109.368 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.499 ' O ' ' N ' ' A' ' 19' ' ' HIS . 68.3 mt-10 -69.12 -49.31 58.14 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.173 -0.955 . . . . 0.0 109.599 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -44.01 92.73 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.405 -0.809 . . . . 0.0 110.044 -179.691 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.537 ' H ' ' CD2' ' A' ' 19' ' ' HIS . 9.4 p80 -82.66 -128.47 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.374 -0.829 . . . . 0.0 109.403 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.476 ' N ' ' CG ' ' A' ' 19' ' ' HIS . 1.6 t -174.85 157.6 2.45 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.195 -0.941 . . . . 0.0 109.561 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.448 ' O ' ' N ' ' A' ' 23' ' ' LEU . . . 65.78 171.28 3.54 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -68.83 66.4 0.13 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.222 -1.164 . . . . 0.0 109.421 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.448 ' N ' ' O ' ' A' ' 21' ' ' GLY . 9.7 tp 49.2 -118.95 1.16 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.266 -0.896 . . . . 0.0 109.372 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 46.3 t -144.31 115.76 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.115 -0.991 . . . . 0.0 109.31 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 59.3 p -60.38 -61.23 2.75 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.288 -0.883 . . . . 0.0 109.437 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.4 t -166.73 173.25 9.76 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.275 -0.89 . . . . 0.0 109.475 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.1 ptmm? -171.49 33.93 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.257 -0.902 . . . . 0.0 109.44 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -66.62 163.0 44.1 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -70.43 126.69 30.35 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.247 -1.149 . . . . 0.0 109.439 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.489 ' CB ' ' NZ ' ' A' ' 30' ' ' LYS . 2.6 ttmp? -73.08 50.01 0.26 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.221 -0.924 . . . . 0.0 109.348 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -172.62 88.01 0.08 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.253 -0.904 . . . . 0.0 109.181 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 11.1 tp -56.99 -29.77 63.58 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.291 -0.88 . . . . 0.0 109.444 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.412 ' CG ' ' H ' ' A' ' 34' ' ' ILE . 6.6 tp -165.49 -132.59 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.157 -0.965 . . . . 0.0 109.513 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.412 ' H ' ' CG ' ' A' ' 33' ' ' LEU . 38.2 mt -139.22 -55.54 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.356 -0.84 . . . . 0.0 109.252 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.16 63.04 2.34 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.207 -0.933 . . . . 0.0 109.439 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -168.29 -84.02 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.228 -0.92 . . . . 0.0 109.469 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -71.96 100.36 2.44 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.283 -0.886 . . . . 0.0 109.439 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.4 ' H ' ' H ' ' A' ' 39' ' ' VAL . 58.4 tttp -167.9 -20.23 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.258 -0.901 . . . . 0.0 109.451 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.4 ' H ' ' H ' ' A' ' 38' ' ' LYS . 31.4 m -57.78 146.78 7.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.267 -0.895 . . . . 0.0 109.495 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.8 t -65.35 174.78 1.96 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.363 -0.835 . . . . 0.0 109.429 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 71.8 p -170.43 176.65 4.34 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.333 -0.854 . . . . 0.0 109.367 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 179.76 165.43 33.73 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -167.96 19.69 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.235 -1.156 . . . . 0.0 109.423 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 30.5 m -78.8 74.74 5.32 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.302 -0.874 . . . . 0.0 109.42 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 72.8 p -77.19 104.2 7.56 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.154 -0.966 . . . . 0.0 109.42 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.409 ' O ' HG23 ' A' ' 47' ' ' THR . 66.1 p -73.22 -133.94 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.268 -0.895 . . . . 0.0 109.452 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.409 HG23 ' O ' ' A' ' 46' ' ' THR . 33.7 p -155.24 41.46 0.43 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.268 -0.895 . . . . 0.0 109.061 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.569 ' CG ' HH11 ' A' ' 48' ' ' ARG . 0.0 OUTLIER -145.84 167.63 22.75 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.301 -0.874 . . . . 0.0 109.374 -179.802 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.428 ' O ' ' O ' ' A' ' 50' ' ' SER . 95.5 mtt180 -87.8 126.14 34.84 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.217 -0.927 . . . . 0.0 109.614 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.428 ' O ' ' O ' ' A' ' 49' ' ' ARG . 47.1 t -59.07 -156.65 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.234 -0.916 . . . . 0.0 109.494 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.502 ' SG ' ' O ' ' A' ' 81' ' ' CYS . 4.8 t 50.74 -118.24 1.2 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.101 -0.999 . . . . 0.0 108.716 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.6 ' N ' ' SG ' ' A' ' 81' ' ' CYS . 26.6 t -56.97 -167.11 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.502 0 O-C-N 120.712 -1.242 . . . . 0.0 108.966 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.491 ' N ' ' OG ' ' A' ' 52' ' ' SER . 50.5 mttp -126.4 103.65 7.75 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.326 -0.858 . . . . 0.0 109.45 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 51.0 t -127.66 116.15 42.28 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.569 -0.707 . . . . 0.0 109.192 179.678 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.473 HG23 ' O ' ' A' ' 55' ' ' ILE . 14.8 tt -128.66 125.25 63.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.564 -0.71 . . . . 0.0 109.415 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 81.0 p -127.85 113.33 15.78 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.402 -0.811 . . . . 0.0 109.323 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.505 ' H ' ' HB ' ' A' ' 69' ' ' THR . 41.7 tttm -127.59 113.64 16.36 Favored 'General case' 0 N--CA 1.519 3.022 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.314 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 91.5 m -108.94 125.22 51.79 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.496 -0.752 . . . . 0.0 109.436 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.5 m -132.56 119.92 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.178 0 O-C-N 121.45 -0.781 . . . . 0.0 109.071 178.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 60.8 m -109.65 134.44 51.96 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.753 -0.592 . . . . 0.0 109.655 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -127.19 162.29 26.51 Favored 'General case' 0 N--CA 1.516 2.85 0 O-C-N 121.385 -0.822 . . . . 0.0 109.347 179.416 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.44 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -71.59 -33.37 68.99 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.538 -1.351 . . . . 0.0 112.6 -177.531 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -69.48 7.26 0.85 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.453 -1.405 . . . . 0.0 109.813 -178.521 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.44 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 87.84 5.02 78.29 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.412 HH11 ' CG ' ' A' ' 65' ' ' ARG . 1.9 ttt-85 -81.15 96.55 7.24 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 120.705 -1.468 . . . . 0.0 107.865 178.811 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.6 p -122.08 94.89 4.45 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.607 -0.683 . . . . 0.0 109.196 -179.069 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -94.66 119.64 33.62 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.228 -0.92 . . . . 0.0 109.864 -179.105 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.487 ' OG1' ' NZ ' ' A' ' 70' ' ' LYS . 40.7 p -102.36 108.53 19.91 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.377 -0.827 . . . . 0.0 109.631 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.545 ' O ' ' N ' ' A' ' 71' ' ' GLU . 3.2 m -87.87 31.38 0.78 Allowed 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 178.693 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.487 ' NZ ' ' OG1' ' A' ' 68' ' ' THR . 22.0 pttm -65.13 56.7 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 179.831 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.545 ' N ' ' O ' ' A' ' 69' ' ' THR . 75.0 mt-10 -93.8 135.94 34.59 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.962 -1.086 . . . . 0.0 109.943 -179.621 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 47.8 t -128.03 129.17 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 179.239 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.422 ' O ' ' OG ' ' A' ' 52' ' ' SER . 16.6 t -128.61 116.2 40.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 CA-C-O 121.946 0.879 . . . . 0.0 109.236 179.677 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 45.9 mtmt -83.99 51.52 2.08 Favored 'General case' 0 C--N 1.289 -2.052 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 6.0 m 55.6 -153.3 0.34 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.235 -0.916 . . . . 0.0 109.463 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.432 ' N ' ' CD ' ' A' ' 76' ' ' GLU . 4.5 mp0 -85.22 -65.9 0.96 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.321 -0.862 . . . . 0.0 109.22 179.778 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 20.2 p-10 -162.0 82.05 0.56 Allowed 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.304 -0.872 . . . . 0.0 109.211 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.522 ' O ' ' N ' ' A' ' 80' ' ' ASP . . . 50.89 45.73 49.68 Favored Glycine 0 N--CA 1.489 2.233 0 N-CA-C 109.395 -1.482 . . . . 0.0 109.395 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 42.9 t -68.31 50.33 0.07 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.271 -1.135 . . . . 0.0 109.513 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.522 ' N ' ' O ' ' A' ' 78' ' ' GLY . 0.8 OUTLIER 54.16 44.75 28.71 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.299 -0.876 . . . . 0.0 109.614 179.948 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.6 ' SG ' ' N ' ' A' ' 52' ' ' SER . 3.0 t -95.64 53.28 1.43 Allowed 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.189 -0.944 . . . . 0.0 109.072 179.656 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 48.83 22.77 3.06 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.711 -1.355 . . . . 0.0 109.711 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -171.03 96.62 0.2 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.208 -1.172 . . . . 0.0 109.646 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -79.19 -141.3 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.184 -0.947 . . . . 0.0 109.265 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.462 ' CG ' ' H ' ' A' ' 86' ' ' PHE . 5.8 p-10 -69.54 -107.46 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.202 -0.936 . . . . 0.0 109.404 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.534 ' O ' ' N ' ' A' ' 88' ' ' TRP . 96.3 m-85 50.01 -161.74 0.06 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.273 -0.892 . . . . 0.0 109.437 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 9.2 t70 60.76 -75.27 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.413 -0.805 . . . . 0.0 109.73 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' TRP . . . . . 0.534 ' N ' ' O ' ' A' ' 86' ' ' PHE . 73.8 m95 53.59 -172.57 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.221 -0.924 . . . . 0.0 109.465 -179.81 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.409 ' O ' ' CG ' ' A' ' 89' ' ' HIS . 79.2 t60 -163.29 4.09 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.256 -0.902 . . . . 0.0 109.232 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -168.82 98.85 0.39 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.314 -0.866 . . . . 0.0 109.342 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.518 ' OG1' ' CD2' ' A' ' 92' ' ' PHE . 80.3 p -83.02 -159.04 0.31 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.339 -0.85 . . . . 0.0 109.428 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.518 ' CD2' ' OG1' ' A' ' 91' ' ' THR . 62.9 m-85 51.63 67.74 3.88 Favored Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.246 -0.909 . . . . 0.0 109.671 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -61.45 -3.21 3.1 Favored 'Trans proline' 0 C--N 1.318 -1.067 0 C-N-CA 121.361 1.374 . . . . 0.0 109.724 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.402 ' H ' ' C ' ' A' ' 92' ' ' PHE . 29.1 t -165.49 120.03 1.25 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.288 -0.883 . . . . 0.0 109.437 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -70.53 -45.68 65.09 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.214 -0.929 . . . . 0.0 109.352 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 73.02 85.03 0.23 Allowed Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.62 ' ND2' ' H ' ' A' ' 98' ' ' LEU . 4.2 p-10 -55.7 -70.63 0.11 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.212 -1.169 . . . . 0.0 109.51 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.62 ' H ' ' ND2' ' A' ' 97' ' ' ASN . 1.4 tt -76.94 41.4 0.28 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.19 -0.944 . . . . 0.0 109.003 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 49.82 -163.07 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.242 -0.911 . . . . 0.0 109.529 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 57.0 m-20 -157.89 -17.91 0.08 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.252 -0.905 . . . . 0.0 109.362 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -61.93 -53.05 61.13 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.206 -0.934 . . . . 0.0 109.447 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -72.46 66.87 0.71 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.303 -0.873 . . . . 0.0 109.435 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -65.59 -47.67 74.96 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.273 -0.892 . . . . 0.0 109.409 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -79.85 -153.68 0.08 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.226 -0.921 . . . . 0.0 109.439 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -157.96 100.49 1.73 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.317 -0.864 . . . . 0.0 109.426 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.4 tttm 51.5 86.68 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.315 -0.865 . . . . 0.0 109.517 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -61.19 177.53 0.34 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.238 -0.913 . . . . 0.0 109.5 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -167.2 108.44 0.63 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.327 -0.858 . . . . 0.0 109.391 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -68.84 -0.53 5.58 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.233 -0.917 . . . . 0.0 109.612 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 48.7 t80 58.43 67.51 0.93 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.307 -0.87 . . . . 0.0 109.541 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 68.5 p -57.44 127.1 30.28 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.303 -0.873 . . . . 0.0 109.355 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 84.7 mtm180 -73.41 -5.44 39.88 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.26 -0.9 . . . . 0.0 109.558 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 78.6 p -171.77 161.97 6.08 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.214 -0.929 . . . . 0.0 109.549 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 13.0 t 52.57 -146.43 0.51 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.263 -0.898 . . . . 0.0 109.519 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 41.7 p-80 -165.8 -40.22 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.224 -0.922 . . . . 0.0 109.491 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -170.16 -54.99 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.314 -0.866 . . . . 0.0 109.517 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -61.75 -61.08 2.76 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.234 -0.916 . . . . 0.0 109.426 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 33.6 t70 54.05 89.83 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.24 -0.913 . . . . 0.0 109.457 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 168.05 36.66 0.02 OUTLIER Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.541 -1.424 . . . . 0.0 109.541 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.55 ' CG ' HH11 ' A' ' 120' ' ' ARG . 0.0 OUTLIER -73.72 -35.69 65.12 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.256 -1.144 . . . . 0.0 109.515 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 1.7 t -61.57 164.71 5.62 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.25 -0.906 . . . . 0.0 109.556 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -178.79 -92.73 0.08 OUTLIER Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.43 -1.468 . . . . 0.0 109.43 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 15.3 mt -69.84 127.2 32.06 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.275 -1.132 . . . . 0.0 109.294 179.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.521 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -72.23 161.94 76.3 Favored Pre-proline 0 N--CA 1.489 1.524 0 O-C-N 121.148 -0.97 . . . . 0.0 108.908 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.521 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 1.8 Cg_endo -57.08 -157.88 0.01 OUTLIER 'Trans proline' 0 C--N 1.32 -0.952 0 C-N-CA 121.346 1.364 . . . . 0.0 109.709 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.439 ' O ' ' O ' ' A' ' 127' ' ' PHE . 66.6 mm-40 -76.92 120.29 21.84 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.244 -0.91 . . . . 0.0 109.372 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' PHE . . . . . 0.541 ' CD2' ' N ' ' A' ' 128' ' ' ALA . 60.6 t80 -51.62 -176.39 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.306 -0.871 . . . . 0.0 109.775 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.541 ' N ' ' CD2' ' A' ' 127' ' ' PHE . . . -76.24 136.85 39.68 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.288 -0.883 . . . . 0.0 109.411 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -167.93 174.0 7.76 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.227 -0.921 . . . . 0.0 109.489 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.559 ' N ' HD12 ' A' ' 130' ' ' LEU . 9.7 mp -52.94 135.89 35.69 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.247 -0.908 . . . . 0.0 109.274 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 62.28 168.2 0.73 Allowed Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -63.1 -27.4 69.37 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.203 -1.175 . . . . 0.0 109.475 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 28.0 t -171.16 12.22 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.34 -0.85 . . . . 0.0 109.482 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -62.71 179.67 4.92 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.443 -1.463 . . . . 0.0 109.443 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 66.0 m -166.16 -37.59 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.209 -1.171 . . . . 0.0 109.437 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 30.6 t -171.09 73.55 0.06 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.279 -0.888 . . . . 0.0 109.374 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 38.9 t -66.66 -19.8 65.84 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.303 -0.873 . . . . 0.0 109.416 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 49.7 m -64.49 100.25 0.36 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.258 -0.901 . . . . 0.0 109.467 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.539 ' C ' ' HG1' ' A' ' 140' ' ' THR . 68.4 mttm -64.47 124.34 21.56 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.251 -0.906 . . . . 0.0 109.447 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 140' ' ' THR . . . . . 0.539 ' HG1' ' C ' ' A' ' 139' ' ' LYS . 58.7 p 48.07 -93.89 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.257 -0.902 . . . . 0.0 109.589 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 141' ' ' SER . . . . . 0.524 ' N ' ' OG1' ' A' ' 140' ' ' THR . 40.5 t -166.24 56.85 0.1 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.205 -0.935 . . . . 0.0 109.463 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 2.5 t -61.48 146.5 48.35 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.208 -0.932 . . . . 0.0 109.46 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 16.6 t60 -68.76 145.41 53.83 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.207 -0.933 . . . . 0.0 109.498 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 41.4 t -61.55 139.17 58.29 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.233 -0.917 . . . . 0.0 109.436 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 23.7 mtpp -66.05 98.91 0.46 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.193 -0.942 . . . . 0.0 109.58 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 41.3 tp60 -167.48 129.61 1.6 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.199 -0.938 . . . . 0.0 109.358 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 50.72 87.78 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.214 -0.929 . . . . 0.0 109.396 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 35.8 m -59.45 139.07 19.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.254 -0.904 . . . . 0.0 109.425 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 92.0 p -78.4 159.2 28.44 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.33 -0.856 . . . . 0.0 109.459 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 52.5 m -71.03 99.22 1.77 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.262 -0.899 . . . . 0.0 109.395 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 151' ' ' SER . . . . . 0.415 ' O ' ' O ' ' A' ' 152' ' ' THR . 49.6 m -63.39 -41.94 98.79 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.237 -0.915 . . . . 0.0 109.471 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 152' ' ' THR . . . . . 0.497 ' OG1' ' N ' ' A' ' 153' ' ' THR . 1.9 t -56.26 -166.87 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.291 -0.881 . . . . 0.0 109.485 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 153' ' ' THR . . . . . 0.497 ' N ' ' OG1' ' A' ' 152' ' ' THR . 69.1 p -74.06 150.07 40.81 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.315 -0.866 . . . . 0.0 109.492 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 8.7 p -167.39 145.31 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.191 -0.943 . . . . 0.0 109.553 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -171.6 137.8 1.07 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.278 -0.889 . . . . 0.0 109.491 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 56.3 mtp180 -59.22 -19.64 47.27 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.258 -0.901 . . . . 0.0 109.5 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -65.69 -167.2 1.98 Allowed Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 177.18 -21.98 0.05 OUTLIER Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 91.9 p -64.28 98.44 0.23 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.263 -1.14 . . . . 0.0 109.499 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -64.7 -178.39 0.4 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.221 -0.924 . . . . 0.0 109.391 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 18.5 pt -60.72 -177.98 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.226 -0.921 . . . . 0.0 109.475 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -66.07 138.07 57.5 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.162 -0.961 . . . . 0.0 109.455 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 50.1 m -77.6 165.04 24.79 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.151 -0.968 . . . . 0.0 109.508 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 58.3 pttt -69.08 146.06 52.92 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.235 -0.915 . . . . 0.0 109.468 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 12.1 m80 -67.14 -70.45 0.25 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.299 -0.876 . . . . 0.0 109.487 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 64.4 t80 . . . . . 0 N--CA 1.49 1.563 0 CA-C-O 118.045 -0.979 . . . . 0.0 109.532 179.975 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 73.9 mtp . . . . . 0 N--CA 1.489 1.508 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -178.62 124.92 0.95 Allowed Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 64.7 p -67.74 156.99 35.71 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.222 -1.163 . . . . 0.0 109.437 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -66.32 141.94 57.82 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.296 -0.877 . . . . 0.0 109.508 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -70.07 137.5 51.28 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.228 -0.92 . . . . 0.0 109.416 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -148.55 -144.86 0.16 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.254 -0.904 . . . . 0.0 109.294 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.468 ' CD ' ' N ' ' A' ' 7' ' ' GLU . 1.4 pm0 -166.61 153.81 9.36 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.152 -0.968 . . . . 0.0 109.456 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -60.74 134.45 49.57 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.432 ' O ' ' O ' ' A' ' 10' ' ' VAL . 77.5 p -68.4 -89.75 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.288 -1.125 . . . . 0.0 109.547 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.432 ' O ' ' O ' ' A' ' 9' ' ' SER . 4.1 t 58.73 154.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.43 -0.794 . . . . 0.0 109.645 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.6 t 48.61 26.49 1.22 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.198 -0.939 . . . . 0.0 109.615 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.9 t -69.12 -134.4 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.236 -0.915 . . . . 0.0 109.46 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -168.59 36.38 0.2 Allowed Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.463 ' C ' ' H ' ' A' ' 16' ' ' GLN . 64.2 p -81.74 -23.61 36.57 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.265 -1.138 . . . . 0.0 109.419 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -75.48 32.89 0.11 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.272 -0.893 . . . . 0.0 109.505 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.463 ' H ' ' C ' ' A' ' 14' ' ' THR . 0.0 OUTLIER -171.47 4.44 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.25 -0.906 . . . . 0.0 109.515 -179.984 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -70.3 -28.5 65.23 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.221 -0.925 . . . . 0.0 109.493 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 31.3 p90 -163.3 -172.76 3.09 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.203 -0.936 . . . . 0.0 109.453 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.408 ' O ' ' O ' ' A' ' 20' ' ' THR . 61.2 t-80 -165.15 -11.02 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.255 -0.903 . . . . 0.0 109.481 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.408 ' O ' ' O ' ' A' ' 19' ' ' HIS . 22.7 m 53.29 97.76 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.258 -0.901 . . . . 0.0 109.431 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -168.27 -105.24 0.18 Allowed Glycine 0 N--CA 1.489 2.232 0 N-CA-C 109.452 -1.459 . . . . 0.0 109.452 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -67.77 101.7 1.1 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.282 -1.128 . . . . 0.0 109.468 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.9 tp -73.22 75.44 1.3 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.233 -0.917 . . . . 0.0 109.371 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 34.4 m -75.72 1.74 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.214 -0.928 . . . . 0.0 109.53 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.416 ' O ' ' OG1' ' A' ' 26' ' ' THR . 30.4 p -64.08 -31.18 72.28 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.215 -0.928 . . . . 0.0 109.493 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.416 ' OG1' ' O ' ' A' ' 25' ' ' THR . 56.9 m -166.34 145.71 5.88 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.265 -0.897 . . . . 0.0 109.384 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 15.2 pttp -169.3 122.99 0.79 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.253 -0.904 . . . . 0.0 109.433 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 55.26 175.26 0.13 Allowed Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.556 -1.417 . . . . 0.0 109.556 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 48.1 m-20 -154.34 130.36 10.25 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.371 -1.076 . . . . 0.0 109.363 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.428 ' O ' ' O ' ' A' ' 31' ' ' GLU . 0.4 OUTLIER -65.99 -136.4 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.259 -0.901 . . . . 0.0 109.481 -179.982 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.428 ' O ' ' O ' ' A' ' 30' ' ' LYS . 15.6 mm-40 52.13 97.14 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.906 -1.121 . . . . 0.0 109.113 -179.704 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.574 ' N ' HD12 ' A' ' 32' ' ' LEU . 8.3 mp -64.5 -40.99 96.68 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.229 -0.92 . . . . 0.0 109.265 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 15.5 mt -79.23 89.99 4.91 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.277 -0.889 . . . . 0.0 109.373 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 21.2 pt -70.06 159.53 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.142 -0.974 . . . . 0.0 109.468 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 53.23 82.82 0.07 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.218 -0.927 . . . . 0.0 109.472 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -71.85 104.18 3.38 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.289 -0.882 . . . . 0.0 109.416 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -70.45 111.11 5.76 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.274 -0.891 . . . . 0.0 109.43 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 68.2 mttm 50.78 -101.29 0.1 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.286 -0.884 . . . . 0.0 109.41 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.45 ' O ' ' N ' ' A' ' 41' ' ' SER . 8.6 p -169.41 -32.85 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.364 -0.835 . . . . 0.0 109.446 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 81.2 p -62.83 80.58 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.219 -0.925 . . . . 0.0 109.464 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.45 ' N ' ' O ' ' A' ' 39' ' ' VAL . 44.4 t -73.35 6.96 2.52 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.26 -0.9 . . . . 0.0 109.476 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 68.72 63.4 3.53 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.692 ' H ' ' CD2' ' A' ' 43' ' ' HIS . 5.1 p80 -69.71 -104.16 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.25 -1.147 . . . . 0.0 109.429 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.524 ' H ' ' CG ' ' A' ' 43' ' ' HIS . 4.8 m 57.46 45.53 19.53 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.21 -0.931 . . . . 0.0 109.316 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 52.6 m -89.13 111.2 21.91 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.272 -0.892 . . . . 0.0 109.358 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.7 t -60.16 144.71 49.28 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.228 -0.92 . . . . 0.0 109.543 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -167.87 66.63 0.08 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.18 -0.95 . . . . 0.0 109.588 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.587 ' CG ' HH11 ' A' ' 48' ' ' ARG . 3.2 mtt-85 -145.54 142.89 29.59 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.207 -0.933 . . . . 0.0 109.328 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 53.6 mtp180 -88.62 137.6 32.17 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.346 -0.846 . . . . 0.0 110.059 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.9 m 58.22 169.99 0.05 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.383 -0.823 . . . . 0.0 110.149 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.44 ' SG ' ' N ' ' A' ' 52' ' ' SER . 31.2 p -66.83 -38.08 85.74 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.436 -0.79 . . . . 0.0 109.397 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.527 ' OG ' ' N ' ' A' ' 53' ' ' LYS . 15.0 t -58.09 -161.36 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.371 -0.831 . . . . 0.0 108.984 179.807 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.527 ' N ' ' OG ' ' A' ' 52' ' ' SER . 36.1 ttpt -121.83 102.01 7.93 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.263 -0.898 . . . . 0.0 109.252 179.393 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 74.5 t -129.33 117.81 44.14 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.409 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.6 ' O ' HD12 ' A' ' 55' ' ' ILE . 1.0 OUTLIER -127.28 132.0 69.99 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 O-C-N 121.431 -0.793 . . . . 0.0 109.077 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 69.4 p -129.22 114.9 16.85 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.381 -0.824 . . . . 0.0 109.185 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.584 ' H ' ' HB ' ' A' ' 69' ' ' THR . 9.1 ttmm -127.19 113.99 17.08 Favored 'General case' 0 N--CA 1.52 3.056 0 N-CA-C 109.3 -0.629 . . . . 0.0 109.3 178.671 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 33.7 p -119.76 132.06 55.53 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.494 -0.754 . . . . 0.0 109.429 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 59' ' ' VAL . 2.8 m -132.54 120.25 41.63 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.177 0 O-C-N 121.383 -0.823 . . . . 0.0 109.534 179.133 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 35.9 p -109.77 133.01 53.62 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.781 -0.574 . . . . 0.0 109.523 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -136.3 170.23 16.37 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.263 -0.898 . . . . 0.0 109.674 179.74 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.42 -40.78 98.1 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.88 -1.138 . . . . 0.0 112.766 -177.275 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.425 ' OD1' ' N ' ' A' ' 63' ' ' ASP . 18.6 p-10 -68.54 5.24 1.09 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.38 -1.45 . . . . 0.0 110.065 -178.305 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.528 ' O ' ' N ' ' A' ' 66' ' ' THR . . . 90.51 8.9 65.38 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.978 -1.249 . . . . 0.0 109.978 179.098 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 36.4 ttp180 -65.21 78.77 0.05 Allowed 'General case' 0 N--CA 1.486 1.343 0 O-C-N 120.689 -1.477 . . . . 0.0 107.915 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.528 ' N ' ' O ' ' A' ' 64' ' ' GLY . 70.3 p -110.03 77.65 1.07 Allowed 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 -179.356 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.0 tm-20 -92.78 119.81 32.52 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.418 -0.801 . . . . 0.0 109.214 -179.28 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 12.7 p -99.31 109.71 22.31 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.353 -0.842 . . . . 0.0 109.677 -179.531 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.584 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 4.2 m -97.02 25.41 5.41 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 107.173 -1.418 . . . . 0.0 107.173 178.561 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -65.76 70.13 0.05 Allowed 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 179.143 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.504 ' N ' ' O ' ' A' ' 69' ' ' THR . 81.2 mt-10 -110.13 155.04 22.46 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.538 -0.726 . . . . 0.0 110.043 -179.052 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.418 ' O ' HG23 ' A' ' 72' ' ' VAL . 21.9 m -127.78 134.85 64.54 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 179.251 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 16.4 t -128.91 116.32 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 CA-C-O 121.996 0.903 . . . . 0.0 109.382 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.4 ptmm? -52.69 178.56 0.02 OUTLIER 'General case' 0 C--N 1.289 -2.023 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 85.2 p -66.02 -112.88 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.239 -0.913 . . . . 0.0 109.311 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.411 ' OE1' ' OD2' ' A' ' 77' ' ' ASP . 0.4 OUTLIER -168.2 -56.27 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.187 -0.945 . . . . 0.0 109.155 179.834 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.411 ' OD2' ' OE1' ' A' ' 76' ' ' GLU . 79.0 m-20 -125.08 -6.31 7.24 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.589 -0.694 . . . . 0.0 109.409 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 82.38 43.36 8.0 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 109.292 -1.523 . . . . 0.0 109.292 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 90.7 p -68.07 -20.75 64.98 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.329 -1.101 . . . . 0.0 109.7 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -164.84 27.3 0.06 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.105 -0.997 . . . . 0.0 109.651 -179.878 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.466 ' C ' ' H ' ' A' ' 83' ' ' ASP . 11.7 m -146.08 -75.04 0.21 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.211 -0.931 . . . . 0.0 109.601 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -68.15 7.67 2.38 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.466 ' H ' ' C ' ' A' ' 81' ' ' CYS . 47.9 m-20 49.92 -164.77 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.211 -1.17 . . . . 0.0 109.369 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -171.23 37.16 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.221 -0.924 . . . . 0.0 109.493 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -65.88 -16.83 64.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.242 -0.911 . . . . 0.0 109.472 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -70.5 -174.59 0.89 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.184 -0.948 . . . . 0.0 109.498 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 26.0 t70 53.12 42.54 32.18 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.253 -0.904 . . . . 0.0 109.599 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 29.8 t90 -66.04 -75.98 0.08 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.264 -0.898 . . . . 0.0 109.445 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.616 ' CG ' ' H ' ' A' ' 90' ' ' HIS . 13.1 t60 -70.81 -171.38 0.52 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.284 -0.885 . . . . 0.0 109.405 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.616 ' H ' ' CG ' ' A' ' 89' ' ' HIS . 13.7 p80 -158.0 54.25 0.46 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.208 -0.932 . . . . 0.0 109.421 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.43 ' O ' ' O ' ' A' ' 92' ' ' PHE . 17.5 m -165.3 66.68 0.13 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.308 -0.87 . . . . 0.0 109.378 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.43 ' O ' ' O ' ' A' ' 91' ' ' THR . 3.9 m-85 62.11 149.59 0.1 OUTLIER Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 121.406 -0.809 . . . . 0.0 108.853 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -56.54 153.99 32.68 Favored 'Trans proline' 0 C--N 1.323 -0.798 0 C-N-CA 120.887 1.058 . . . . 0.0 109.634 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 30.7 t -74.07 125.59 28.66 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.246 -0.909 . . . . 0.0 109.28 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.723 ' H ' ' NE ' ' A' ' 95' ' ' ARG . 0.1 OUTLIER -65.32 -166.72 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.198 -0.939 . . . . 0.0 109.159 -179.922 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -156.5 -57.05 0.01 OUTLIER Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.441 -1.463 . . . . 0.0 109.441 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -68.98 91.99 0.5 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.258 -1.142 . . . . 0.0 109.405 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.409 ' C ' ' H ' ' A' ' 100' ' ' ASP . 15.0 mt -68.51 -147.4 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.235 -0.915 . . . . 0.0 109.524 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.522 ' O ' ' N ' ' A' ' 101' ' ' PHE . 0.8 OUTLIER -55.98 -8.83 0.49 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.213 -0.929 . . . . 0.0 109.502 -179.923 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.409 ' H ' ' C ' ' A' ' 98' ' ' LEU . 65.1 t0 -68.29 45.71 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.264 -0.897 . . . . 0.0 109.413 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.522 ' N ' ' O ' ' A' ' 99' ' ' ASP . 52.9 t80 -77.43 -22.39 51.56 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.3 -0.875 . . . . 0.0 109.457 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -87.22 142.82 27.62 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.246 -0.908 . . . . 0.0 109.447 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 24.7 m80 -73.33 -22.7 60.26 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.232 -0.917 . . . . 0.0 109.477 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.571 HH11 ' CG ' ' A' ' 104' ' ' ARG . 3.4 mtt-85 50.93 -100.57 0.09 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.181 -0.949 . . . . 0.0 109.445 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.468 ' CG ' ' H ' ' A' ' 106' ' ' LYS . 31.5 t70 53.35 -176.74 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.221 -0.924 . . . . 0.0 109.394 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.468 ' H ' ' CG ' ' A' ' 105' ' ' ASP . 40.3 tptt -68.78 68.34 0.15 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.231 -0.918 . . . . 0.0 109.414 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.444 ' C ' ' H ' ' A' ' 109' ' ' PHE . 27.8 p30 -75.07 -6.19 48.17 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.287 -0.883 . . . . 0.0 109.5 -179.874 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -62.56 0.11 0.53 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.262 -0.899 . . . . 0.0 109.474 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.444 ' H ' ' C ' ' A' ' 107' ' ' ASP . 84.1 t80 -68.26 -12.35 60.87 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.242 -0.911 . . . . 0.0 109.494 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -70.9 -21.02 62.43 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.313 -0.867 . . . . 0.0 109.452 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 69.8 p -63.38 -75.91 0.07 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.273 -0.892 . . . . 0.0 109.498 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.584 ' CG ' HH11 ' A' ' 112' ' ' ARG . 0.3 OUTLIER 52.93 76.67 0.19 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.242 -0.911 . . . . 0.0 109.493 -179.984 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.503 ' O ' ' N ' ' A' ' 115' ' ' HIS . 46.2 t -170.35 -144.09 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.249 -0.907 . . . . 0.0 109.495 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.447 ' N ' ' OG ' ' A' ' 113' ' ' SER . 41.5 t -66.53 64.6 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.28 -0.888 . . . . 0.0 109.438 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' HIS . . . . . 0.503 ' N ' ' O ' ' A' ' 113' ' ' SER . 52.4 t-80 -166.26 63.37 0.1 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.232 -0.918 . . . . 0.0 109.458 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -151.5 -56.43 0.15 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.235 -0.916 . . . . 0.0 109.347 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.518 ' O ' ' N ' ' A' ' 119' ' ' GLY . 72.3 t80 -65.68 -11.19 42.94 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.25 -0.907 . . . . 0.0 109.459 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 20.0 t70 50.99 -90.59 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.229 -0.92 . . . . 0.0 109.578 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' A' ' 117' ' ' PHE . . . -162.17 -179.72 36.98 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.449 -1.461 . . . . 0.0 109.449 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.466 ' C ' ' H ' ' A' ' 122' ' ' GLY . 51.3 mtp180 -57.31 160.79 3.71 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.264 -1.139 . . . . 0.0 109.52 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 76.5 p -72.18 13.84 0.28 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.291 -0.881 . . . . 0.0 109.444 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' GLY . . . . . 0.466 ' H ' ' C ' ' A' ' 120' ' ' ARG . . . -165.53 105.75 0.25 Allowed Glycine 0 N--CA 1.49 2.261 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 15.9 mt -67.56 127.56 33.2 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.24 -1.153 . . . . 0.0 109.212 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.531 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -73.32 162.15 75.75 Favored Pre-proline 0 N--CA 1.489 1.482 0 O-C-N 121.229 -0.919 . . . . 0.0 108.814 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.531 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 2.3 Cg_endo -55.99 177.79 0.13 Allowed 'Trans proline' 0 C--N 1.319 -1.021 0 C-N-CA 121.354 1.37 . . . . 0.0 109.69 179.625 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -78.43 29.22 0.19 Allowed 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.215 -0.928 . . . . 0.0 109.443 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' PHE . . . . . 0.514 ' CG ' ' N ' ' A' ' 128' ' ' ALA . 68.7 t80 -76.06 176.39 8.01 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.219 -0.926 . . . . 0.0 109.381 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.514 ' N ' ' CG ' ' A' ' 127' ' ' PHE . . . -161.17 -136.36 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.319 -0.863 . . . . 0.0 109.528 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -169.16 -69.82 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.185 -0.947 . . . . 0.0 109.449 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.464 HD23 ' C ' ' A' ' 130' ' ' LEU . 1.8 tt -62.26 -73.67 0.1 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.167 -0.958 . . . . 0.0 109.026 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' GLY . . . . . 0.421 ' O ' ' O ' ' A' ' 130' ' ' LEU . . . 61.17 146.66 0.01 OUTLIER Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.674 -1.37 . . . . 0.0 109.674 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.621 ' CD ' ' H ' ' A' ' 132' ' ' GLU . 1.4 pm0 -54.59 -26.42 32.35 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.25 -1.147 . . . . 0.0 109.39 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 69.0 m -83.36 96.01 8.39 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.317 -0.864 . . . . 0.0 109.477 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -67.45 -14.05 63.9 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' SER . . . . . 0.485 ' OG ' ' N ' ' A' ' 136' ' ' SER . 28.8 t -172.52 -130.59 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.307 -1.114 . . . . 0.0 109.439 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.485 ' N ' ' OG ' ' A' ' 135' ' ' SER . 18.4 p 54.77 13.6 0.74 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.242 -0.911 . . . . 0.0 109.479 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 42.9 t -72.71 151.27 42.28 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.341 -0.849 . . . . 0.0 109.499 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 10.7 m 53.88 -121.73 1.88 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.241 -0.912 . . . . 0.0 109.438 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 56.4 mttp -61.75 -153.17 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.202 -0.936 . . . . 0.0 109.432 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' THR . . . . . 0.421 ' O ' ' O ' ' A' ' 141' ' ' SER . 1.3 t -164.99 -22.45 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.264 -0.898 . . . . 0.0 109.407 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 141' ' ' SER . . . . . 0.421 ' O ' ' O ' ' A' ' 140' ' ' THR . 5.4 p 61.17 149.22 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.372 -0.83 . . . . 0.0 109.447 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 69.5 p -78.89 52.59 1.26 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.312 -0.867 . . . . 0.0 109.52 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 10.3 m80 51.79 -158.57 0.11 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.234 -0.917 . . . . 0.0 109.453 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' SER . . . . . 0.438 ' O ' ' N ' ' A' ' 146' ' ' GLN . 74.6 m -166.6 48.65 0.07 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.174 -0.954 . . . . 0.0 109.461 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -69.65 65.02 0.2 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.282 -0.886 . . . . 0.0 109.462 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' GLN . . . . . 0.438 ' N ' ' O ' ' A' ' 144' ' ' SER . 11.2 tt0 -73.02 75.86 1.2 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.234 -0.916 . . . . 0.0 109.55 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -71.1 154.39 41.79 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.273 -0.892 . . . . 0.0 109.471 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 148' ' ' VAL . . . . . 0.516 HG22 ' N ' ' A' ' 149' ' ' SER . 8.2 p -170.12 161.66 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.292 -0.88 . . . . 0.0 109.474 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 149' ' ' SER . . . . . 0.516 ' N ' HG22 ' A' ' 148' ' ' VAL . 73.6 m -158.07 -95.59 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.233 -0.917 . . . . 0.0 109.469 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 150' ' ' SER . . . . . 0.417 ' H ' ' H ' ' A' ' 151' ' ' SER . 18.0 t -172.41 -2.73 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.253 -0.904 . . . . 0.0 109.487 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 151' ' ' SER . . . . . 0.417 ' H ' ' H ' ' A' ' 150' ' ' SER . 44.0 t -62.47 111.35 2.0 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.183 -0.948 . . . . 0.0 109.511 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 24.8 m 53.26 94.49 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.259 -0.901 . . . . 0.0 109.482 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 153' ' ' THR . . . . . 0.447 HG22 ' H ' ' A' ' 153' ' ' THR . 0.1 OUTLIER -67.67 79.84 0.19 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.295 -0.878 . . . . 0.0 109.499 -179.999 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 27.4 m -61.62 -17.7 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.232 -0.918 . . . . 0.0 109.485 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 155' ' ' ASN . . . . . 0.419 ' CG ' ' H ' ' A' ' 156' ' ' ARG . 24.1 t-20 -61.31 178.69 0.26 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.195 -0.941 . . . . 0.0 109.424 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 156' ' ' ARG . . . . . 0.419 ' H ' ' CG ' ' A' ' 155' ' ' ASN . 28.7 ptt180 -168.66 52.53 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.304 -0.873 . . . . 0.0 109.505 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -70.89 -65.82 2.36 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 170.57 150.65 7.06 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 27.4 m -165.08 154.74 13.07 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.254 -1.144 . . . . 0.0 109.478 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -82.58 33.67 0.42 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.222 -0.923 . . . . 0.0 109.498 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 95.8 mt -67.22 -71.26 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.202 -0.936 . . . . 0.0 109.488 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -78.86 109.59 13.27 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.285 -0.884 . . . . 0.0 109.45 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 89.8 p -163.95 126.16 2.42 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.231 -0.918 . . . . 0.0 109.473 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 4.8 tmtp? 56.7 34.61 24.87 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.253 -0.904 . . . . 0.0 109.129 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 75.8 m-70 48.04 -168.48 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.189 -0.944 . . . . 0.0 109.72 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 63.8 t80 . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 117.954 -1.022 . . . . 0.0 109.489 -179.918 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.6 mmt . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -61.92 -60.71 7.62 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 24.4 m 52.94 96.8 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.254 -1.145 . . . . 0.0 109.45 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.516 ' CD2' ' O ' ' A' ' 4' ' ' PHE . 70.9 t80 -169.22 36.44 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.242 -0.911 . . . . 0.0 109.475 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 52.94 70.39 0.59 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.184 -0.948 . . . . 0.0 109.524 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -170.36 135.18 1.23 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.317 -0.864 . . . . 0.0 109.439 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -170.01 -163.09 0.34 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.133 -0.979 . . . . 0.0 109.472 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -166.34 89.6 0.1 Allowed Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 84.8 p -170.47 120.75 0.59 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.346 -1.09 . . . . 0.0 109.379 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 28.7 m -64.13 166.05 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.272 -0.893 . . . . 0.0 109.482 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 68.2 m -166.85 87.24 0.3 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.334 -0.854 . . . . 0.0 109.418 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.6 m -72.7 -134.61 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.216 -0.928 . . . . 0.0 109.392 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -52.55 118.17 7.42 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 80.8 p -64.09 104.23 0.7 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.271 -1.135 . . . . 0.0 109.476 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.528 ' O ' ' N ' ' A' ' 17' ' ' GLU . 59.7 mttm 52.57 -133.04 1.87 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.35 -0.844 . . . . 0.0 109.498 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 52.25 -88.52 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.285 -0.884 . . . . 0.0 109.562 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.528 ' N ' ' O ' ' A' ' 15' ' ' LYS . 43.3 tt0 -64.73 -48.65 73.81 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.227 -0.921 . . . . 0.0 109.528 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -82.59 50.72 1.71 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.286 -0.884 . . . . 0.0 109.549 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -171.47 -69.22 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.229 -0.919 . . . . 0.0 109.646 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 82.7 p -63.15 176.15 0.8 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.348 -0.845 . . . . 0.0 109.701 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -158.01 -149.35 5.43 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.14 -1.584 . . . . 0.0 109.14 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 75.3 mttt 58.56 -152.55 0.4 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.143 -1.21 . . . . 0.0 109.579 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.9 tp 68.71 172.21 0.29 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.226 -0.921 . . . . 0.0 108.991 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.549 ' C ' ' HG1' ' A' ' 25' ' ' THR . 13.1 p -69.51 -5.95 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.119 -0.988 . . . . 0.0 109.472 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.549 ' HG1' ' C ' ' A' ' 24' ' ' VAL . 69.1 p 48.39 -92.02 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.255 -0.903 . . . . 0.0 109.667 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.506 ' N ' ' O ' ' A' ' 24' ' ' VAL . 29.9 m -162.34 -0.71 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.195 -0.941 . . . . 0.0 109.462 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -80.85 46.95 0.93 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.105 -0.997 . . . . 0.0 109.496 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -160.5 -152.45 6.57 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.514 -1.435 . . . . 0.0 109.514 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.405 ' H ' ' H ' ' A' ' 30' ' ' LYS . 22.9 t70 -164.15 -0.17 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.248 -1.148 . . . . 0.0 109.385 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.405 ' H ' ' H ' ' A' ' 29' ' ' ASP . 24.2 ttpp -60.66 99.03 0.07 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.242 -0.911 . . . . 0.0 109.427 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.404 ' HG3' ' H ' ' A' ' 33' ' ' LEU . 9.6 tp10 -68.62 143.29 54.87 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.226 -0.921 . . . . 0.0 109.318 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.4 tp -66.76 -22.07 66.05 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.229 -0.919 . . . . 0.0 109.439 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.585 ' N ' HD12 ' A' ' 33' ' ' LEU . 8.5 mp -78.08 120.49 22.98 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.325 -0.86 . . . . 0.0 109.291 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.426 ' O ' ' O ' ' A' ' 33' ' ' LEU . 67.3 mt 52.63 99.69 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.295 -0.878 . . . . 0.0 109.598 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.416 ' OD1' ' N ' ' A' ' 35' ' ' ASP . 15.3 p-10 -75.18 122.83 24.23 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.239 -0.913 . . . . 0.0 109.395 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 -67.86 94.74 0.48 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.223 -0.923 . . . . 0.0 109.509 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 50.15 -148.72 0.29 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.261 -0.9 . . . . 0.0 109.535 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 19.7 pttp -163.92 57.19 0.16 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.212 -0.93 . . . . 0.0 109.436 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 20.8 t 53.35 72.68 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.242 -0.911 . . . . 0.0 109.479 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 62.2 m -78.17 155.75 30.23 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.244 -0.91 . . . . 0.0 109.436 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 90.8 p -60.9 104.88 0.4 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.292 -0.88 . . . . 0.0 109.533 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 173.48 144.65 4.79 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.441 ' ND1' ' N ' ' A' ' 44' ' ' THR . 3.0 p80 -170.06 -16.55 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.331 -1.099 . . . . 0.0 109.439 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.441 ' N ' ' ND1' ' A' ' 43' ' ' HIS . 37.3 m -62.74 -72.82 0.12 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.271 -0.893 . . . . 0.0 109.481 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 81.6 p -68.77 101.14 1.27 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.28 -0.887 . . . . 0.0 109.429 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 41.1 p -152.86 -39.33 0.1 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.269 -0.894 . . . . 0.0 109.441 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.9 m -165.85 31.08 0.05 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.289 -0.882 . . . . 0.0 109.382 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 10.1 ptp180 -146.12 143.37 29.3 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.121 -0.987 . . . . 0.0 109.214 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.467 ' CD ' ' N ' ' A' ' 49' ' ' ARG . 11.1 mpt_? -88.14 127.4 35.43 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.068 -1.02 . . . . 0.0 109.448 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.413 ' O ' ' O ' ' A' ' 51' ' ' CYS . 98.6 p -58.24 -62.48 1.8 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.292 -0.88 . . . . 0.0 109.663 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.415 ' SG ' ' N ' ' A' ' 52' ' ' SER . 36.8 t -50.81 -97.14 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.213 -0.929 . . . . 0.0 109.703 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.415 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 30.8 t -51.1 150.12 3.36 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.294 -0.879 . . . . 0.0 109.721 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -85.2 105.01 15.59 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.28 -0.888 . . . . 0.0 109.106 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.41 ' HB ' ' H ' ' A' ' 49' ' ' ARG . 99.4 t -126.55 119.68 54.3 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.517 -0.739 . . . . 0.0 110.021 -179.46 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.453 HG23 ' O ' ' A' ' 55' ' ' ILE . 19.3 tt -127.13 128.74 70.73 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 179.204 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 48.7 p -130.42 120.71 24.64 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.247 -0.908 . . . . 0.0 110.357 -179.013 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.481 ' H ' ' HB ' ' A' ' 69' ' ' THR . 9.6 mttp -121.04 111.34 17.34 Favored 'General case' 0 N--CA 1.509 2.506 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 177.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 52.0 p -119.26 139.43 51.9 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.377 -0.827 . . . . 0.0 109.498 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.8 m -132.48 121.12 44.74 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 O-C-N 121.542 -0.724 . . . . 0.0 109.184 178.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -109.49 135.55 50.32 Favored 'General case' 0 N--CA 1.497 1.909 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 179.607 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.423 ' OD1' ' N ' ' A' ' 62' ' ' ALA . 30.6 t-20 -153.11 153.49 32.92 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 120.661 -1.274 . . . . 0.0 109.536 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.423 ' N ' ' OD1' ' A' ' 61' ' ' ASN . . . -74.36 -11.9 60.38 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 120.498 -1.376 . . . . 0.0 112.091 -178.556 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 11.7 p30 -74.32 2.19 9.87 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.043 -1.036 . . . . 0.0 109.743 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.78 11.16 62.24 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 36.9 ttm180 -96.08 99.09 10.88 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.011 -1.288 . . . . 0.0 109.123 179.734 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 68.4 p -125.8 83.4 2.16 Favored 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -94.99 129.76 41.92 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.348 -0.845 . . . . 0.0 111.065 -178.327 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.1 p -108.45 112.43 24.83 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 179.022 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.522 ' O ' ' N ' ' A' ' 71' ' ' GLU . 3.6 m -106.47 31.06 5.47 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 179.106 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.9 mttm -64.13 70.79 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 119.808 -0.757 . . . . 0.0 109.388 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.522 ' N ' ' O ' ' A' ' 69' ' ' THR . 51.7 mt-10 -89.55 140.18 29.8 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.242 -0.911 . . . . 0.0 109.274 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.409 ' O ' HG23 ' A' ' 72' ' ' VAL . 23.6 m -127.39 136.31 60.94 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 17.2 t -128.2 117.38 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.976 0 CA-C-O 122.186 0.993 . . . . 0.0 109.122 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.412 ' O ' ' O ' ' A' ' 75' ' ' SER . 94.1 mttt -94.08 -2.95 52.05 Favored 'General case' 0 C--N 1.291 -1.949 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.561 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.412 ' O ' ' O ' ' A' ' 74' ' ' LYS . 8.4 m 51.34 -178.89 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.252 -0.905 . . . . 0.0 109.235 -179.762 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.466 ' N ' ' CD ' ' A' ' 76' ' ' GLU . 1.4 pm0 -157.94 44.84 0.33 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.213 -0.929 . . . . 0.0 109.604 -179.812 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -153.5 17.85 0.54 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.278 -0.889 . . . . 0.0 109.722 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 70.42 63.91 3.06 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 109.614 -1.395 . . . . 0.0 109.614 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 49.5 m -52.88 -53.94 41.75 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.216 -1.167 . . . . 0.0 109.293 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -155.45 9.61 0.29 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.248 -0.908 . . . . 0.0 109.158 179.684 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 85.6 m -131.72 -89.72 0.44 Allowed 'General case' 0 N--CA 1.498 1.952 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.459 ' C ' ' H ' ' A' ' 84' ' ' ALA . . . -179.44 31.13 0.06 OUTLIER Glycine 0 N--CA 1.489 2.203 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 68.6 m-20 -64.02 1.34 0.7 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.233 -1.157 . . . . 0.0 109.446 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.459 ' H ' ' C ' ' A' ' 82' ' ' GLY . . . -65.11 -144.29 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.266 -0.896 . . . . 0.0 109.422 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.522 ' O ' ' CG ' ' A' ' 86' ' ' PHE . 6.1 p-10 -168.86 -115.71 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.288 -0.883 . . . . 0.0 109.423 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.522 ' CG ' ' O ' ' A' ' 85' ' ' ASP . 90.7 m-85 -158.91 78.12 0.76 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.294 -0.879 . . . . 0.0 109.456 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -157.71 46.46 0.37 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.284 -0.885 . . . . 0.0 109.348 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 26.4 t-105 -57.24 150.15 18.44 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.229 -0.919 . . . . 0.0 109.476 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.522 ' O ' ' CG ' ' A' ' 90' ' ' HIS . 29.4 t-80 -166.19 93.38 0.52 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.246 -0.909 . . . . 0.0 109.472 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.522 ' CG ' ' O ' ' A' ' 89' ' ' HIS . 61.5 m80 -157.27 176.67 12.4 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.247 -0.908 . . . . 0.0 109.313 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.539 HG22 ' H ' ' A' ' 92' ' ' PHE . 1.4 m -69.13 -145.09 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.215 -0.928 . . . . 0.0 109.245 -179.894 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.539 ' H ' HG22 ' A' ' 91' ' ' THR . 52.1 t80 45.42 67.25 4.38 Favored Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 121.222 -0.924 . . . . 0.0 109.922 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -61.95 -163.9 0.04 OUTLIER 'Trans proline' 0 C--N 1.317 -1.095 0 C-N-CA 121.371 1.381 . . . . 0.0 109.768 -179.824 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 62.4 m -163.1 109.22 1.15 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.296 -0.877 . . . . 0.0 109.385 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 36.0 ttp180 -64.96 134.1 53.18 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.239 -0.913 . . . . 0.0 109.499 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -73.81 107.71 2.32 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -78.72 48.3 0.8 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.213 -1.169 . . . . 0.0 109.464 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 17.0 mt -69.46 172.93 6.48 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.163 -0.96 . . . . 0.0 109.392 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.501 ' O ' ' N ' ' A' ' 101' ' ' PHE . 34.9 t70 -168.58 -75.06 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.204 -0.935 . . . . 0.0 109.461 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -65.5 68.68 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.302 -0.873 . . . . 0.0 109.522 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.501 ' N ' ' O ' ' A' ' 99' ' ' ASP . 81.5 t80 -77.81 -28.21 50.3 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.214 -0.929 . . . . 0.0 109.421 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.521 ' CD2' ' O ' ' A' ' 102' ' ' PHE . 81.2 t80 -169.54 7.58 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.193 -0.942 . . . . 0.0 109.555 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -63.5 -42.62 98.5 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.18 -0.95 . . . . 0.0 109.533 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -65.75 169.03 6.9 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.336 -0.852 . . . . 0.0 109.523 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 52.57 75.05 0.25 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.222 -0.924 . . . . 0.0 109.515 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 18.8 ttpp -63.74 124.19 20.81 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.222 -0.924 . . . . 0.0 109.459 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -167.13 102.42 0.53 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.237 -0.914 . . . . 0.0 109.497 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.451 ' C ' ' H ' ' A' ' 110' ' ' PHE . 13.4 p-10 -170.05 -4.09 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.218 -0.926 . . . . 0.0 109.478 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.51 ' O ' ' CD2' ' A' ' 109' ' ' PHE . 78.5 t80 -65.64 3.06 0.8 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.196 -0.94 . . . . 0.0 109.484 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' PHE . . . . . 0.519 ' O ' ' CD2' ' A' ' 110' ' ' PHE . 37.8 p90 -162.28 114.07 1.64 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.241 -0.912 . . . . 0.0 109.415 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 78.7 p -67.15 -171.1 0.14 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.29 -0.881 . . . . 0.0 109.501 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.539 ' CG ' HH11 ' A' ' 112' ' ' ARG . 0.2 OUTLIER -71.21 -36.27 71.83 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.311 -0.868 . . . . 0.0 109.496 -179.948 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 24.3 t -173.09 -16.7 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.312 -0.867 . . . . 0.0 109.419 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 92.6 p -63.24 94.7 0.08 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.213 -0.93 . . . . 0.0 109.388 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' HIS . . . . . 0.494 ' CG ' ' N ' ' A' ' 116' ' ' GLU . 0.4 OUTLIER -72.79 -116.39 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.215 -0.928 . . . . 0.0 109.481 -179.995 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.494 ' N ' ' CG ' ' A' ' 115' ' ' HIS . 37.2 mt-10 -152.56 127.01 9.31 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.134 -0.979 . . . . 0.0 109.284 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -74.21 -104.24 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.314 -0.867 . . . . 0.0 109.566 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.429 ' OD1' ' N ' ' A' ' 119' ' ' GLY . 18.4 p30 -70.23 -116.78 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.292 -0.88 . . . . 0.0 109.546 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.429 ' N ' ' OD1' ' A' ' 118' ' ' ASP . . . 72.06 -158.79 53.52 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.427 ' O ' ' O ' ' A' ' 119' ' ' GLY . 32.8 ptt180 -56.56 -166.45 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.259 -1.142 . . . . 0.0 109.303 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 71.8 p -148.64 -75.94 0.17 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.129 -0.982 . . . . 0.0 109.408 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -171.48 -149.14 6.4 Favored Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 10.7 tp -65.24 136.19 56.31 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.231 -1.158 . . . . 0.0 109.287 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.539 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -72.04 162.43 73.57 Favored Pre-proline 0 N--CA 1.491 1.596 0 O-C-N 121.256 -0.903 . . . . 0.0 108.814 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.539 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 2.3 Cg_endo -56.18 143.82 83.25 Favored 'Trans proline' 0 C--N 1.32 -0.947 0 C-N-CA 121.3 1.333 . . . . 0.0 109.73 179.589 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -72.11 -21.71 61.44 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.216 -0.928 . . . . 0.0 109.344 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -140.64 115.87 9.92 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.334 -0.853 . . . . 0.0 109.295 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -72.55 -63.61 1.12 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.235 -0.916 . . . . 0.0 109.502 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -168.67 142.95 3.18 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.219 -0.925 . . . . 0.0 109.568 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.46 ' C ' ' H ' ' A' ' 132' ' ' GLU . 14.3 mt -71.61 51.62 0.19 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.314 -0.866 . . . . 0.0 109.353 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -74.25 35.88 0.94 Allowed Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.46 ' H ' ' C ' ' A' ' 130' ' ' LEU . 44.7 mm-40 -72.0 121.35 19.01 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.286 -1.126 . . . . 0.0 109.51 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 133' ' ' SER . . . . . 0.451 ' OG ' ' N ' ' A' ' 134' ' ' GLY . 47.9 t -71.0 -151.75 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.25 -0.906 . . . . 0.0 109.493 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 134' ' ' GLY . . . . . 0.521 ' O ' ' N ' ' A' ' 136' ' ' SER . . . -61.59 -146.84 0.01 OUTLIER Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.485 -1.446 . . . . 0.0 109.485 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 3.8 t 62.35 -73.04 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.393 -1.063 . . . . 0.0 109.643 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.521 ' N ' ' O ' ' A' ' 134' ' ' GLY . 29.9 t -48.5 -85.34 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.266 -0.896 . . . . 0.0 109.512 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 69.6 m -165.31 72.6 0.19 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.25 -0.906 . . . . 0.0 109.474 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 77.4 p -170.58 37.94 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.254 -0.904 . . . . 0.0 109.511 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -70.67 -28.24 64.64 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.199 -0.938 . . . . 0.0 109.43 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 32.7 p 48.93 56.95 6.98 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.214 -0.929 . . . . 0.0 109.57 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 39.3 t -68.97 -125.93 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.23 -0.919 . . . . 0.0 109.393 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 80.6 p -67.81 -174.79 0.48 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.203 -0.936 . . . . 0.0 109.447 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 46.2 m170 -68.89 -57.47 5.49 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.214 -0.929 . . . . 0.0 109.421 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 31.7 t -169.79 106.79 0.36 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.228 -0.92 . . . . 0.0 109.504 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -69.92 -100.03 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.21 -0.931 . . . . 0.0 109.446 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -170.24 89.25 0.15 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.281 -0.887 . . . . 0.0 109.512 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' PHE . . . . . 0.441 ' C ' ' H ' ' A' ' 149' ' ' SER . 70.0 m-85 -71.31 152.73 42.96 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.195 -0.941 . . . . 0.0 109.451 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 148' ' ' VAL . . . . . 0.455 ' O ' ' N ' ' A' ' 150' ' ' SER . 33.5 m -69.5 7.7 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.226 -0.922 . . . . 0.0 109.491 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 149' ' ' SER . . . . . 0.441 ' H ' ' C ' ' A' ' 147' ' ' PHE . 66.3 m -69.96 49.12 0.1 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.237 -0.914 . . . . 0.0 109.49 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 150' ' ' SER . . . . . 0.455 ' N ' ' O ' ' A' ' 148' ' ' VAL . 75.6 m -166.84 28.85 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.257 -0.902 . . . . 0.0 109.467 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 151' ' ' SER . . . . . 0.43 ' O ' ' N ' ' A' ' 153' ' ' THR . 12.2 t 52.8 53.79 11.56 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.214 -0.929 . . . . 0.0 109.451 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 46.5 p -70.81 48.28 0.11 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.258 -0.901 . . . . 0.0 109.458 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 153' ' ' THR . . . . . 0.54 HG22 ' N ' ' A' ' 154' ' ' VAL . 54.0 m -55.49 165.92 0.73 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.218 -0.927 . . . . 0.0 109.416 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.54 ' N ' HG22 ' A' ' 153' ' ' THR . 28.3 t -48.2 -32.53 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.246 -0.909 . . . . 0.0 109.558 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 48.4 m-20 52.62 95.44 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.249 -0.907 . . . . 0.0 109.601 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 70.4 ttt180 -62.14 112.04 2.21 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.238 -0.914 . . . . 0.0 109.445 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 73.34 -147.58 39.34 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 174.04 -147.37 9.28 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.621 -1.391 . . . . 0.0 109.621 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 90.1 p -59.66 -19.48 49.72 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.244 -1.151 . . . . 0.0 109.436 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -60.67 168.39 2.26 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.221 -0.924 . . . . 0.0 109.45 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 20.6 pt -69.32 167.63 1.74 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.286 -0.884 . . . . 0.0 109.459 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.415 ' O ' ' O ' ' A' ' 163' ' ' SER . 52.4 mt-10 -67.55 -25.76 65.97 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.29 -0.881 . . . . 0.0 109.428 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 163' ' ' SER . . . . . 0.415 ' O ' ' O ' ' A' ' 162' ' ' GLU . 12.5 t 52.85 176.95 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.21 -0.931 . . . . 0.0 109.475 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -73.22 -76.64 0.12 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.137 -0.977 . . . . 0.0 109.491 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 165' ' ' HIS . . . . . 0.442 ' CG ' ' O ' ' A' ' 165' ' ' HIS . 53.9 t-80 -169.49 13.52 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.221 -0.924 . . . . 0.0 109.492 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 57.3 t80 . . . . . 0 N--CA 1.489 1.515 0 CA-C-O 117.992 -1.004 . . . . 0.0 109.488 -179.97 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.1 ptt? . . . . . 0 N--CA 1.49 1.559 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 177.51 33.16 0.05 OUTLIER Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -162.53 72.89 0.36 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.253 -1.145 . . . . 0.0 109.45 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -66.15 -21.32 66.33 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.231 -0.918 . . . . 0.0 109.527 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.418 ' HG2' ' H ' ' A' ' 5' ' ' ARG . 3.0 ptp180 -63.23 -112.77 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.269 -0.894 . . . . 0.0 109.447 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 50.73 36.47 14.35 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.119 -0.988 . . . . 0.0 109.296 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -80.67 -69.05 0.63 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.306 -0.871 . . . . 0.0 109.464 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 178.44 -67.02 0.08 OUTLIER Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.424 ' O ' ' O ' ' A' ' 10' ' ' VAL . 13.0 m 52.19 38.23 23.97 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.225 -1.162 . . . . 0.0 109.458 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.447 ' C ' ' H ' ' A' ' 12' ' ' SER . 32.9 m -61.92 -146.61 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.192 -0.943 . . . . 0.0 109.376 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 87.9 p -58.2 -4.92 0.4 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.196 -0.94 . . . . 0.0 109.491 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.447 ' H ' ' C ' ' A' ' 10' ' ' VAL . 32.6 t -53.01 -86.83 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.157 -0.964 . . . . 0.0 109.496 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 67.03 144.27 0.07 OUTLIER Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.446 ' O ' ' O ' ' A' ' 15' ' ' LYS . 40.0 m -62.65 141.22 58.61 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.223 -1.163 . . . . 0.0 109.493 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.446 ' O ' ' O ' ' A' ' 14' ' ' THR . 18.4 mmmt 54.5 164.37 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.584 -0.698 . . . . 0.0 109.954 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -90.42 73.6 6.95 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.041 -1.037 . . . . 0.0 109.227 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -65.13 -46.44 80.93 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.265 -0.897 . . . . 0.0 109.733 -179.643 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.51 ' O ' ' CD2' ' A' ' 18' ' ' PHE . 52.6 t80 51.89 29.49 6.1 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.111 -0.993 . . . . 0.0 109.462 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.432 ' O ' ' CG ' ' A' ' 19' ' ' HIS . 46.1 t-80 -170.0 17.18 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.229 -0.919 . . . . 0.0 109.523 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.1 m -69.25 -48.6 61.36 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.266 -0.897 . . . . 0.0 109.467 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 71.62 41.39 57.29 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 32.6 tptt -71.63 1.87 6.04 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.276 -1.132 . . . . 0.0 109.175 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 16.4 mt -63.07 120.91 12.35 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.334 -0.854 . . . . 0.0 109.439 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.9 t -75.47 -28.13 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.282 -0.886 . . . . 0.0 109.444 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.418 ' O ' ' OG1' ' A' ' 26' ' ' THR . 40.9 m -164.02 144.96 8.58 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.245 -0.909 . . . . 0.0 109.518 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.505 HG22 ' N ' ' A' ' 27' ' ' LYS . 49.7 m -166.51 163.88 17.13 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.384 -0.823 . . . . 0.0 109.24 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.505 ' N ' HG22 ' A' ' 26' ' ' THR . 2.5 tmtm? -158.13 73.93 0.69 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.203 -0.936 . . . . 0.0 109.159 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -155.93 -172.42 23.4 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.457 ' O ' ' N ' ' A' ' 31' ' ' GLU . 15.2 t70 -164.68 -74.54 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.215 -1.167 . . . . 0.0 109.482 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.472 ' N ' ' CD ' ' A' ' 30' ' ' LYS . 11.9 mptt 50.82 -95.01 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.228 -0.92 . . . . 0.0 109.189 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.457 ' N ' ' O ' ' A' ' 29' ' ' ASP . 34.0 tt0 55.17 58.61 4.56 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.311 -0.868 . . . . 0.0 109.475 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 15.5 mt -76.68 2.16 14.99 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.213 -0.93 . . . . 0.0 109.387 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.477 HD23 ' N ' ' A' ' 34' ' ' ILE . 1.6 tt -78.75 111.62 15.05 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.267 -0.895 . . . . 0.0 109.11 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.477 ' N ' HD23 ' A' ' 33' ' ' LEU . 16.2 tt -162.08 152.22 3.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.229 -0.919 . . . . 0.0 109.427 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -64.25 108.98 1.73 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.304 -0.872 . . . . 0.0 109.434 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -170.15 111.88 0.43 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.275 -0.89 . . . . 0.0 109.483 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.631 ' CD ' ' H ' ' A' ' 37' ' ' GLU . 9.0 pm0 -63.06 139.49 58.78 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.207 -0.933 . . . . 0.0 109.524 -179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -93.55 80.25 4.32 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.186 -0.946 . . . . 0.0 109.48 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.6 p -170.56 142.17 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.206 -0.934 . . . . 0.0 109.551 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.5 t -174.38 -27.87 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.249 -0.907 . . . . 0.0 109.436 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 24.2 t -171.78 161.55 5.96 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.289 -0.882 . . . . 0.0 109.521 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 178.74 -79.46 0.06 OUTLIER Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 15.6 p-80 -52.8 173.96 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.224 -1.163 . . . . 0.0 109.441 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.9 p -149.36 -134.95 0.07 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.291 -0.881 . . . . 0.0 109.421 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.445 ' O ' ' O ' ' A' ' 46' ' ' THR . 67.8 p -79.38 -30.19 42.4 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.187 -0.945 . . . . 0.0 109.488 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.521 ' O ' ' N ' ' A' ' 48' ' ' ARG . 4.3 p 57.0 109.76 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.402 -0.811 . . . . 0.0 109.727 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 70.7 p -66.68 49.46 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.311 -0.868 . . . . 0.0 110.026 -179.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.521 ' N ' ' O ' ' A' ' 46' ' ' THR . 84.8 mtt180 -146.0 142.51 28.72 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.174 -0.954 . . . . 0.0 108.946 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 11.3 tpp180 -96.73 121.77 38.95 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.082 -1.011 . . . . 0.0 109.538 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 89.3 p -60.28 -166.33 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.162 -0.961 . . . . 0.0 109.171 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 4.4 t 48.87 -125.67 1.99 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.104 -0.997 . . . . 0.0 109.048 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.442 ' N ' ' SG ' ' A' ' 81' ' ' CYS . 25.0 t -50.18 132.08 23.75 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.802 -1.186 . . . . 0.0 109.059 179.517 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.443 ' O ' ' O ' ' A' ' 73' ' ' VAL . 59.3 tttm -76.9 105.3 7.88 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.86 -1.15 . . . . 0.0 109.558 -179.489 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 47.5 t -123.88 116.08 46.98 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 O-C-N 121.484 -0.76 . . . . 0.0 109.454 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 43.7 mm -122.91 115.97 47.39 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.628 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 75.4 p -128.6 111.6 13.39 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.328 -0.858 . . . . 0.0 109.243 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.498 ' N ' ' OG1' ' A' ' 69' ' ' THR . 7.3 mtmt -124.67 113.46 18.03 Favored 'General case' 0 N--CA 1.515 2.775 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.793 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 58.9 p -119.4 131.84 55.73 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.549 -0.719 . . . . 0.0 109.117 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.406 ' CG2' ' OE1' ' A' ' 67' ' ' GLU . 2.8 m -133.47 126.79 52.58 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.2 0 O-C-N 121.476 -0.765 . . . . 0.0 109.605 179.421 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' THR . . . . . 0.404 HG23 ' O ' ' A' ' 60' ' ' THR . 8.6 t -108.13 134.16 51.39 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.429 -0.795 . . . . 0.0 109.34 179.753 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -125.89 162.02 26.13 Favored 'General case' 0 N--CA 1.516 2.875 0 O-C-N 121.503 -0.748 . . . . 0.0 109.304 179.802 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.05 -36.4 66.88 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.648 -1.283 . . . . 0.0 111.895 -178.238 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -72.83 7.05 2.17 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.571 -1.33 . . . . 0.0 109.874 -179.053 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.19 7.49 83.1 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.334 -1.506 . . . . 0.0 109.334 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 18.0 tpt180 -82.8 109.32 16.84 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 120.949 -1.324 . . . . 0.0 107.818 178.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.9 p -140.42 151.42 44.9 Favored 'General case' 0 C--N 1.306 -1.301 0 O-C-N 121.217 -0.927 . . . . 0.0 108.678 -178.616 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.406 ' OE1' ' CG2' ' A' ' 59' ' ' VAL . 24.4 mp0 -131.43 117.43 18.84 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 179.428 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.8 p -100.89 105.97 17.28 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.189 -0.944 . . . . 0.0 110.16 -179.24 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.504 ' O ' ' N ' ' A' ' 71' ' ' GLU . 78.3 p -109.82 30.51 6.62 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 178.626 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.0 ptpt -66.74 66.0 0.06 Allowed 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 179.663 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.504 ' N ' ' O ' ' A' ' 69' ' ' THR . 63.2 mm-40 -108.17 151.59 25.71 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.425 -0.797 . . . . 0.0 110.147 -179.152 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 72' ' ' VAL . 12.7 m -127.97 135.11 63.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 179.368 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.443 ' O ' ' O ' ' A' ' 53' ' ' LYS . 16.4 t -129.34 115.64 36.22 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 CA-C-O 122.235 1.017 . . . . 0.0 109.625 179.662 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 45.5 mttp -74.02 150.06 40.88 Favored 'General case' 0 C--N 1.289 -2.027 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.428 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 32.2 t -74.92 111.65 10.34 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.238 -0.914 . . . . 0.0 109.489 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 -71.37 -10.84 60.41 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.25 -0.906 . . . . 0.0 109.237 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -105.78 -18.19 14.14 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.49 -0.756 . . . . 0.0 109.522 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.34 -37.93 90.96 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.399 -1.481 . . . . 0.0 109.399 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 6.2 m 55.83 11.44 0.69 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.34 -1.094 . . . . 0.0 109.719 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -163.69 20.22 0.07 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.087 -1.008 . . . . 0.0 109.628 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.442 ' SG ' ' N ' ' A' ' 52' ' ' SER . 6.2 t -136.39 115.07 12.01 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.527 -0.733 . . . . 0.0 109.313 -179.803 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.47 -46.36 3.55 Favored Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.4 -1.48 . . . . 0.0 109.4 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -81.45 122.99 28.21 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.29 -1.123 . . . . 0.0 109.386 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -169.0 33.01 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.301 -0.874 . . . . 0.0 109.384 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -76.38 41.26 0.24 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.194 -0.941 . . . . 0.0 109.215 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 85.0 m-85 -64.38 -179.43 0.46 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.411 -0.806 . . . . 0.0 109.297 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.424 ' O ' ' N ' ' A' ' 89' ' ' HIS . 59.5 m-20 -157.55 -66.95 0.1 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.274 -0.891 . . . . 0.0 109.38 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' TRP . . . . . 0.5 ' C ' ' H ' ' A' ' 90' ' ' HIS . 96.9 m95 51.49 -95.27 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.25 -0.906 . . . . 0.0 109.57 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.424 ' N ' ' O ' ' A' ' 87' ' ' ASP . 0.8 OUTLIER 61.54 -4.18 0.18 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.507 -0.746 . . . . 0.0 109.98 -179.886 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.5 ' H ' ' C ' ' A' ' 88' ' ' TRP . 30.2 m-70 45.4 58.95 3.83 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.121 -0.987 . . . . 0.0 109.904 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.43 ' O ' ' O ' ' A' ' 90' ' ' HIS . 5.5 m 56.88 165.29 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.247 -0.908 . . . . 0.0 109.337 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -59.56 149.97 68.13 Favored Pre-proline 0 N--CA 1.49 1.573 0 O-C-N 121.214 -0.929 . . . . 0.0 108.936 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -57.17 -42.74 59.94 Favored 'Trans proline' 0 C--N 1.323 -0.805 0 C-N-CA 121.006 1.137 . . . . 0.0 109.719 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 8.6 t 55.81 63.58 2.0 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.297 -0.877 . . . . 0.0 109.451 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 55.1 mtp180 -74.09 -144.23 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.29 -0.881 . . . . 0.0 109.48 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -175.29 9.76 0.03 OUTLIER Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -70.12 -21.5 63.1 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.287 -1.125 . . . . 0.0 109.495 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 59.5 tp -59.25 131.74 51.91 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.282 -0.886 . . . . 0.0 109.233 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.412 ' O ' ' O ' ' A' ' 100' ' ' ASP . 26.3 t0 -168.18 68.51 0.08 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.249 -0.907 . . . . 0.0 109.556 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.412 ' O ' ' O ' ' A' ' 99' ' ' ASP . 29.6 m-20 50.72 -177.9 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.213 -0.929 . . . . 0.0 109.516 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -76.83 -53.8 7.44 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.249 -0.907 . . . . 0.0 109.467 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 51.8 91.61 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.222 -0.924 . . . . 0.0 109.0 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 -76.59 -22.64 53.95 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.236 -0.915 . . . . 0.0 109.274 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.583 HH11 ' CG ' ' A' ' 104' ' ' ARG . 0.0 OUTLIER -167.55 137.27 2.75 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.246 -0.909 . . . . 0.0 109.4 179.974 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.51 ' O ' ' N ' ' A' ' 107' ' ' ASP . 3.8 p30 -73.83 122.36 22.35 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.233 -0.917 . . . . 0.0 109.48 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 19.8 mtpp -62.6 77.25 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.262 -0.899 . . . . 0.0 109.347 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.51 ' N ' ' O ' ' A' ' 105' ' ' ASP . 5.6 p-10 -57.83 167.89 1.05 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.341 -0.849 . . . . 0.0 109.628 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.413 ' OD1' ' N ' ' A' ' 108' ' ' ASP . 19.3 p-10 -167.24 65.68 0.09 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.312 -0.868 . . . . 0.0 109.173 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 46.6 m-85 -59.93 -46.22 90.09 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.272 -0.892 . . . . 0.0 109.858 -179.664 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 -51.55 151.36 3.21 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.023 -1.048 . . . . 0.0 109.822 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 81.6 p -135.94 -62.44 0.68 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.547 -0.721 . . . . 0.0 109.12 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 17.3 tpt180 -75.02 122.65 23.84 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.295 -0.878 . . . . 0.0 109.288 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 72.4 m -165.73 -99.68 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.225 -0.922 . . . . 0.0 109.493 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.407 ' H ' ' H ' ' A' ' 115' ' ' HIS . 23.8 t -170.34 2.56 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.301 -0.874 . . . . 0.0 109.498 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' HIS . . . . . 0.407 ' H ' ' H ' ' A' ' 114' ' ' SER . 31.6 m80 -59.73 -22.16 61.67 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.166 -0.959 . . . . 0.0 109.462 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -70.87 135.19 47.88 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.249 -0.907 . . . . 0.0 109.422 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -70.71 102.59 2.34 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.194 -0.941 . . . . 0.0 109.46 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -169.11 59.38 0.05 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.251 -0.906 . . . . 0.0 109.486 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 161.98 -0.13 0.06 OUTLIER Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.54 ' CG ' HH11 ' A' ' 120' ' ' ARG . 0.3 OUTLIER -75.32 -103.89 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.274 -1.133 . . . . 0.0 109.451 -179.92 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 4.3 m 57.71 -127.08 1.67 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.12 -0.988 . . . . 0.0 109.419 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 169.39 160.96 18.85 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 10.7 tp -73.36 146.89 44.85 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.277 -1.131 . . . . 0.0 109.318 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -67.61 153.63 94.66 Favored Pre-proline 0 N--CA 1.489 1.518 0 O-C-N 121.102 -0.999 . . . . 0.0 108.82 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -57.08 -24.63 59.21 Favored 'Trans proline' 0 C--N 1.323 -0.808 0 C-N-CA 121.02 1.147 . . . . 0.0 109.683 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 23.9 tp10 -159.48 -124.85 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.329 -0.857 . . . . 0.0 109.458 -179.758 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -102.37 -168.2 1.5 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.285 -0.884 . . . . 0.0 109.405 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -76.89 -84.52 0.06 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.237 -0.915 . . . . 0.0 109.341 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -75.88 -135.01 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.324 -0.86 . . . . 0.0 109.404 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.435 HD23 ' C ' ' A' ' 130' ' ' LEU . 1.6 tt -169.31 101.79 0.35 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.252 -0.905 . . . . 0.0 109.218 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 131' ' ' GLY . . . . . 0.426 ' O ' ' N ' ' A' ' 133' ' ' SER . . . 169.31 2.15 0.03 OUTLIER Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 73.0 mt-10 -70.35 58.43 0.18 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.327 -1.102 . . . . 0.0 109.484 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' SER . . . . . 0.426 ' N ' ' O ' ' A' ' 131' ' ' GLY . 89.8 p -64.42 157.02 27.57 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.261 -0.899 . . . . 0.0 109.427 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -62.65 -81.07 0.1 OUTLIER Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.521 -1.431 . . . . 0.0 109.521 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 20.4 m -64.92 -153.77 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.23 -1.159 . . . . 0.0 109.464 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.431 ' H ' ' H ' ' A' ' 137' ' ' SER . 89.1 p -169.12 -2.52 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.209 -0.932 . . . . 0.0 109.422 179.939 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 137' ' ' SER . . . . . 0.431 ' H ' ' H ' ' A' ' 136' ' ' SER . 79.2 p -170.3 136.72 1.4 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.235 -0.915 . . . . 0.0 109.383 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 30.1 t -170.9 84.29 0.09 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.222 -0.924 . . . . 0.0 109.554 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -65.67 143.91 57.26 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.23 -0.918 . . . . 0.0 109.313 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 67.4 p -87.09 -131.19 0.06 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.231 -0.918 . . . . 0.0 109.359 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 99.3 p -62.85 115.25 4.2 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.236 -0.915 . . . . 0.0 109.412 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 39.4 m -69.14 141.52 54.61 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.339 -0.85 . . . . 0.0 109.495 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 54.0 m-70 -68.84 -75.73 0.1 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.307 -0.871 . . . . 0.0 109.445 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 14.7 t 51.85 63.42 2.25 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.203 -0.936 . . . . 0.0 109.407 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -69.92 5.19 1.65 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.251 -0.906 . . . . 0.0 109.548 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -63.6 -62.49 1.63 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.27 -0.894 . . . . 0.0 109.443 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -63.65 88.83 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.325 -0.86 . . . . 0.0 109.487 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 26.9 m -69.15 143.48 14.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.197 -0.939 . . . . 0.0 109.412 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 43.8 t -69.87 -39.22 76.46 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.317 -0.865 . . . . 0.0 109.52 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 27.2 m -65.84 -157.25 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.271 -0.893 . . . . 0.0 109.513 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 49.4 m -61.97 143.81 55.97 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.329 -0.857 . . . . 0.0 109.459 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 152' ' ' THR . . . . . 0.518 ' O ' ' N ' ' A' ' 154' ' ' VAL . 24.4 m -71.16 72.27 0.61 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.259 -0.901 . . . . 0.0 109.464 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 98.1 m 51.71 -89.25 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.295 -0.878 . . . . 0.0 109.52 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.518 ' N ' ' O ' ' A' ' 152' ' ' THR . 30.0 m -64.52 160.94 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.224 -0.923 . . . . 0.0 109.437 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 155' ' ' ASN . . . . . 0.515 ' ND2' ' H ' ' A' ' 156' ' ' ARG . 12.6 p-10 -169.05 -112.69 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.305 -0.872 . . . . 0.0 109.56 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 156' ' ' ARG . . . . . 0.515 ' H ' ' ND2' ' A' ' 155' ' ' ASN . 11.6 tpp180 -68.07 -56.0 10.47 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.161 -0.962 . . . . 0.0 109.413 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -171.91 -43.57 0.04 OUTLIER Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -171.67 -118.78 0.49 Allowed Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 31.3 t -172.93 159.74 4.13 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.173 -1.192 . . . . 0.0 109.453 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -68.1 94.82 0.52 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.251 -0.906 . . . . 0.0 109.334 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 161' ' ' ILE . . . . . 0.498 HG23 ' O ' ' A' ' 161' ' ' ILE . 13.6 tt -70.83 117.33 13.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.182 -0.948 . . . . 0.0 109.552 -179.828 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -168.36 -58.1 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.154 -0.967 . . . . 0.0 109.422 -179.783 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 66.1 m -166.59 140.04 3.93 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.321 -0.862 . . . . 0.0 109.445 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 62.2 tttp -167.62 -15.02 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.222 -0.924 . . . . 0.0 109.545 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -162.78 165.3 25.61 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.311 -0.868 . . . . 0.0 109.438 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 . . . . . 0 N--CA 1.489 1.507 0 CA-C-O 118.002 -0.999 . . . . 0.0 109.451 -179.939 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.7 ttp . . . . . 0 N--CA 1.491 1.592 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -176.81 131.07 1.76 Allowed Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 65.9 p -64.18 -45.34 88.79 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.236 -1.155 . . . . 0.0 109.32 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 66.3 t80 -66.73 130.96 44.88 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.205 -0.934 . . . . 0.0 109.482 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.584 ' CG ' HH11 ' A' ' 5' ' ' ARG . 0.2 OUTLIER -170.39 -80.95 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.255 -0.903 . . . . 0.0 109.343 179.953 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.401 ' O ' ' O ' ' A' ' 5' ' ' ARG . 36.5 mt-10 -63.64 -134.37 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.173 -0.954 . . . . 0.0 109.493 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 58.01 100.83 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.24 -0.913 . . . . 0.0 109.268 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.423 ' C ' ' H ' ' A' ' 10' ' ' VAL . . . -172.61 133.65 2.73 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 90.2 p -73.08 11.83 0.64 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.209 -1.171 . . . . 0.0 109.468 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.423 ' H ' ' C ' ' A' ' 8' ' ' GLY . 34.0 t -60.85 128.83 22.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.262 -0.899 . . . . 0.0 109.565 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 92.9 p -62.16 174.47 0.9 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.335 -0.853 . . . . 0.0 109.506 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.3 t -174.1 68.33 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.231 -0.918 . . . . 0.0 109.515 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -179.5 50.07 0.09 OUTLIER Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.479 -1.449 . . . . 0.0 109.479 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 73.1 p -64.45 -11.85 37.64 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.296 -1.12 . . . . 0.0 109.447 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.449 ' C ' ' H ' ' A' ' 17' ' ' GLU . 18.8 tptm -70.39 53.93 0.14 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.189 -0.944 . . . . 0.0 109.406 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 36.1 mm-40 -75.68 34.26 0.12 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.268 -0.895 . . . . 0.0 109.456 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.449 ' H ' ' C ' ' A' ' 15' ' ' LYS . 25.0 mm-40 -73.47 -43.85 59.31 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.263 -0.898 . . . . 0.0 109.463 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -73.92 -69.06 0.46 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.21 -0.932 . . . . 0.0 109.498 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 69.0 t60 -76.13 121.07 22.3 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.225 -0.922 . . . . 0.0 109.466 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.6 t -174.08 -31.21 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.241 -0.912 . . . . 0.0 109.494 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -75.47 -117.65 0.11 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.458 ' CB ' ' NZ ' ' A' ' 22' ' ' LYS . 0.1 OUTLIER -167.99 63.2 0.07 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.287 -1.125 . . . . 0.0 109.449 -179.921 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 16.5 mt -66.15 -50.7 63.04 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.211 -0.931 . . . . 0.0 109.547 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.415 ' C ' ' HG1' ' A' ' 25' ' ' THR . 13.2 t 55.48 -113.32 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.258 -0.901 . . . . 0.0 109.218 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.491 HG22 ' H ' ' A' ' 26' ' ' THR . 0.2 OUTLIER -164.75 -166.49 1.07 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.882 -1.137 . . . . 0.0 109.222 -179.996 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.491 ' H ' HG22 ' A' ' 25' ' ' THR . 59.5 p -45.44 -38.25 5.91 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.219 -0.926 . . . . 0.0 109.892 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 46.8 mtmt -148.94 -133.93 0.06 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.228 -0.92 . . . . 0.0 109.436 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 76.07 -8.26 24.65 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.443 ' CG ' ' H ' ' A' ' 30' ' ' LYS . 15.6 t70 -169.72 -135.83 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.251 -1.147 . . . . 0.0 109.474 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.443 ' H ' ' CG ' ' A' ' 29' ' ' ASP . 65.1 tttm 50.16 85.32 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.232 -0.918 . . . . 0.0 109.449 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.43 ' OE1' ' O ' ' A' ' 31' ' ' GLU . 1.7 pp20? -172.57 26.03 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.264 -0.897 . . . . 0.0 109.606 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 20.2 mt -67.01 -20.53 65.88 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.25 -0.906 . . . . 0.0 109.425 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.563 ' H ' HD23 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -89.93 28.2 1.42 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.294 -0.879 . . . . 0.0 109.224 -179.982 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.549 HG23 ' N ' ' A' ' 35' ' ' ASP . 16.4 tt -64.62 -45.55 95.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.164 -0.96 . . . . 0.0 109.366 -179.867 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.549 ' N ' HG23 ' A' ' 34' ' ' ILE . 65.9 m-20 46.75 37.49 4.78 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.202 -0.936 . . . . 0.0 109.683 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 51.9 77.0 0.16 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.189 -0.945 . . . . 0.0 109.381 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.497 ' O ' ' N ' ' A' ' 39' ' ' VAL . 39.1 tt0 -62.91 118.6 8.0 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.25 -0.906 . . . . 0.0 109.564 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt -68.08 53.76 0.07 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.243 -0.911 . . . . 0.0 109.5 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.497 ' N ' ' O ' ' A' ' 37' ' ' GLU . 35.9 m -46.16 146.8 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.232 -0.917 . . . . 0.0 109.798 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.7 t -170.95 174.95 4.57 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.334 -0.854 . . . . 0.0 109.401 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 43.0 t -66.97 -58.34 5.14 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.271 -0.893 . . . . 0.0 109.444 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -173.19 113.16 0.46 Allowed Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.333 -1.507 . . . . 0.0 109.333 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -81.64 -68.01 0.73 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.33 -1.1 . . . . 0.0 109.42 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.9 p -75.95 73.29 2.85 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.231 -0.918 . . . . 0.0 109.308 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 61.3 p -75.45 140.66 43.02 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.182 -0.949 . . . . 0.0 109.447 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.6 t -147.44 31.98 0.89 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.247 -0.908 . . . . 0.0 109.42 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 41.9 m -71.06 -71.66 0.25 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.31 -0.869 . . . . 0.0 109.288 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 26.2 ttp180 -146.01 142.8 28.98 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.301 -0.874 . . . . 0.0 109.32 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.4 mmt180 -100.69 134.66 43.33 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.315 -0.865 . . . . 0.0 109.839 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.464 ' O ' ' O ' ' A' ' 51' ' ' CYS . 18.7 m -71.53 -61.22 1.86 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.2 -0.937 . . . . 0.0 110.52 -179.444 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.587 ' SG ' ' N ' ' A' ' 52' ' ' SER . 32.5 t -56.23 -108.74 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.194 -0.942 . . . . 0.0 109.526 -179.542 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.587 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 62.0 m -52.57 113.91 1.21 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 120.944 -1.097 . . . . 0.0 108.2 179.35 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.436 ' O ' ' O ' ' A' ' 73' ' ' VAL . 18.0 tptm -74.2 100.83 3.79 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.75 -1.219 . . . . 0.0 109.553 -178.602 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.62 HG13 ' O ' ' A' ' 54' ' ' VAL . 8.3 p -128.55 116.12 40.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 179.421 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.599 ' O ' HD12 ' A' ' 55' ' ' ILE . 1.0 OUTLIER -127.97 130.87 69.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 179.841 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 16.6 m -128.56 111.96 13.8 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.378 -0.826 . . . . 0.0 108.896 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.532 ' H ' ' HB ' ' A' ' 69' ' ' THR . 14.9 mttm -124.19 113.37 18.22 Favored 'General case' 0 N--CA 1.511 2.583 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 178.623 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 71.6 p -113.04 134.73 54.39 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.49 -0.756 . . . . 0.0 109.742 -179.492 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 59' ' ' VAL . 2.8 m -131.49 123.98 53.67 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.047 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 178.828 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 42.4 p -107.2 120.39 41.98 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.683 -0.635 . . . . 0.0 110.252 -179.026 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.461 ' OD1' ' N ' ' A' ' 61' ' ' ASN . 1.2 m-20 -107.62 143.97 35.33 Favored 'General case' 0 N--CA 1.51 2.544 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 179.209 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.434 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -69.51 -28.95 66.48 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 119.976 -1.702 . . . . 0.0 112.331 -177.645 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.456 ' N ' ' OD1' ' A' ' 63' ' ' ASP . 0.6 OUTLIER -67.36 4.19 1.06 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.527 -1.358 . . . . 0.0 109.75 -178.969 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.434 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 96.52 6.16 58.64 Favored Glycine 0 N--CA 1.497 2.706 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 178.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -92.39 110.49 21.89 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.725 -1.456 . . . . 0.0 107.857 179.022 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 23.8 p -135.16 102.92 5.35 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.418 -0.801 . . . . 0.0 109.32 -179.307 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -96.91 128.64 44.07 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.21 -0.931 . . . . 0.0 110.185 -179.144 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.525 ' OG1' ' NZ ' ' A' ' 70' ' ' LYS . 40.0 p -106.36 108.96 20.74 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.532 -0.73 . . . . 0.0 109.489 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.532 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 5.6 m -88.43 33.14 0.75 Allowed 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 179.005 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.525 ' NZ ' ' OG1' ' A' ' 68' ' ' THR . 21.0 pttm -66.14 60.99 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.286 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.499 ' N ' ' O ' ' A' ' 69' ' ' THR . 86.9 mt-10 -96.13 141.93 28.92 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 120.968 -1.083 . . . . 0.0 110.079 -179.37 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 72' ' ' VAL . 5.9 m -129.16 122.39 56.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 179.115 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.436 ' O ' ' O ' ' A' ' 53' ' ' LYS . 20.6 t -128.96 115.44 36.58 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.996 0 CA-C-O 122.323 1.058 . . . . 0.0 109.47 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.431 ' NZ ' ' O ' ' A' ' 79' ' ' SER . 66.4 tttm -64.46 154.12 36.76 Favored 'General case' 0 C--N 1.287 -2.129 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.433 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 68.6 m -60.57 112.32 1.94 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.228 -0.92 . . . . 0.0 109.392 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -88.69 36.18 0.79 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.194 -0.941 . . . . 0.0 109.37 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -157.38 -38.12 0.07 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.272 -0.893 . . . . 0.0 109.628 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -84.6 3.49 86.51 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' SER . . . . . 0.476 ' C ' ' H ' ' A' ' 81' ' ' CYS . 8.5 m 53.96 -127.22 2.36 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.337 -1.096 . . . . 0.0 109.362 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.517 ' O ' ' N ' ' A' ' 82' ' ' GLY . 28.5 t70 -75.53 25.97 0.11 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.079 -1.013 . . . . 0.0 109.484 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.481 ' C ' ' H ' ' A' ' 83' ' ' ASP . 3.6 t 64.5 -63.58 0.16 Allowed 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.587 -0.696 . . . . 0.0 109.76 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' A' ' 80' ' ' ASP . . . -71.8 36.77 0.61 Allowed Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.655 -1.378 . . . . 0.0 109.655 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.481 ' H ' ' C ' ' A' ' 81' ' ' CYS . 19.0 p30 -61.04 158.64 13.12 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.126 -1.22 . . . . 0.0 109.47 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.72 -41.67 91.37 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.279 -0.888 . . . . 0.0 109.446 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 26.6 t0 53.61 90.12 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.348 -0.845 . . . . 0.0 109.411 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.46 ' CD2' ' N ' ' A' ' 87' ' ' ASP . 70.4 t80 -169.91 -101.69 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.295 -0.878 . . . . 0.0 109.444 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.46 ' N ' ' CD2' ' A' ' 86' ' ' PHE . 24.8 t70 -171.38 15.76 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.208 -0.933 . . . . 0.0 109.481 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 76.2 t90 -81.64 -43.22 18.89 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.266 -0.896 . . . . 0.0 109.375 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.469 ' CG ' ' N ' ' A' ' 90' ' ' HIS . 58.1 t-80 -65.72 168.32 7.93 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.302 -0.874 . . . . 0.0 109.501 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.469 ' N ' ' CG ' ' A' ' 89' ' ' HIS . 81.9 t60 52.3 86.13 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.163 -0.96 . . . . 0.0 109.45 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 11.4 m -143.36 60.53 1.4 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.3 -0.875 . . . . 0.0 109.365 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 49.72 67.24 4.63 Favored Pre-proline 0 N--CA 1.489 1.502 0 O-C-N 121.299 -0.875 . . . . 0.0 109.844 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.58 -43.51 26.73 Favored 'Trans proline' 0 C--N 1.317 -1.123 0 C-N-CA 121.314 1.343 . . . . 0.0 109.54 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.401 ' O ' ' O ' ' A' ' 95' ' ' ARG . 61.8 m -156.24 29.42 0.35 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.284 -0.885 . . . . 0.0 109.399 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.401 ' O ' ' O ' ' A' ' 94' ' ' SER . 39.3 ttp180 51.59 96.58 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.248 -0.908 . . . . 0.0 109.457 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 61.39 -150.96 43.73 Favored Glycine 0 N--CA 1.489 2.208 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -169.21 149.6 4.2 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.275 -1.132 . . . . 0.0 109.437 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 8.3 tp 55.08 -125.12 2.18 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.221 -0.924 . . . . 0.0 109.234 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -62.8 154.27 30.35 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.13 -0.981 . . . . 0.0 109.518 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -68.55 165.2 19.63 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.247 -0.908 . . . . 0.0 109.392 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -69.94 -55.54 9.39 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.18 -0.95 . . . . 0.0 109.494 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -68.9 123.98 22.46 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.25 -0.906 . . . . 0.0 109.516 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 37.2 m-70 -65.79 -31.2 72.03 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.266 -0.896 . . . . 0.0 109.413 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 52.92 73.84 0.33 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.319 -0.863 . . . . 0.0 109.458 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -72.96 166.33 23.26 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.233 -0.917 . . . . 0.0 109.429 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 24.3 ttpp -167.39 120.76 0.96 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.297 -0.877 . . . . 0.0 109.501 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -68.95 146.79 52.47 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.165 -0.959 . . . . 0.0 109.394 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.412 ' OD1' ' N ' ' A' ' 108' ' ' ASP . 12.4 p-10 -167.92 105.65 0.5 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.256 -0.902 . . . . 0.0 109.473 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -68.19 -48.65 64.66 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.25 -0.906 . . . . 0.0 109.454 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' PHE . . . . . 0.524 ' O ' ' CD2' ' A' ' 110' ' ' PHE . 48.1 p90 -77.41 121.99 24.56 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.279 -0.888 . . . . 0.0 109.459 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 12.3 m -164.13 63.91 0.15 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.245 -0.909 . . . . 0.0 109.31 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.514 ' O ' ' N ' ' A' ' 114' ' ' SER . 26.6 mtm-85 -150.46 71.3 1.05 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.288 -0.883 . . . . 0.0 109.376 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 69.2 m 51.9 -89.24 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.247 -0.908 . . . . 0.0 109.512 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.514 ' N ' ' O ' ' A' ' 112' ' ' ARG . 44.8 t -157.57 -166.19 1.96 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.288 -0.883 . . . . 0.0 109.385 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' HIS . . . . . 0.412 ' N ' ' OG ' ' A' ' 114' ' ' SER . 40.9 p-80 -166.8 51.04 0.07 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.276 -0.89 . . . . 0.0 109.463 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 51.49 63.88 2.07 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.233 -0.917 . . . . 0.0 109.447 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -77.05 -40.89 44.68 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.237 -0.914 . . . . 0.0 109.538 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -71.55 57.8 0.28 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.253 -0.904 . . . . 0.0 109.653 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -143.78 111.06 0.61 Allowed Glycine 0 N--CA 1.495 2.624 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -171.61 -36.92 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.319 -1.107 . . . . 0.0 109.476 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.426 ' OG1' ' N ' ' A' ' 122' ' ' GLY . 72.7 p -74.53 -87.27 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.227 -0.921 . . . . 0.0 109.515 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' GLY . . . . . 0.426 ' N ' ' OG1' ' A' ' 121' ' ' THR . . . 58.72 -133.99 52.56 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.621 HD23 ' N ' ' A' ' 123' ' ' LEU . 1.4 pt? -55.16 142.8 29.67 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.169 -1.194 . . . . 0.0 109.502 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.544 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -81.06 162.36 59.73 Favored Pre-proline 0 N--CA 1.493 1.68 0 O-C-N 121.183 -0.948 . . . . 0.0 108.721 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.544 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 2.1 Cg_endo -56.56 -174.33 0.04 OUTLIER 'Trans proline' 0 C--N 1.319 -1.001 0 C-N-CA 121.284 1.323 . . . . 0.0 109.798 179.59 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -171.32 -32.48 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.219 -0.926 . . . . 0.0 109.372 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -61.73 -105.93 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.232 -0.917 . . . . 0.0 109.435 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . 53.68 73.98 0.34 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.197 -0.939 . . . . 0.0 109.446 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.499 ' C ' ' H ' ' A' ' 131' ' ' GLY . . . 52.73 92.59 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.352 -0.842 . . . . 0.0 109.489 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.531 ' N ' HD23 ' A' ' 130' ' ' LEU . 0.7 OUTLIER -62.29 2.94 0.21 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.328 -0.857 . . . . 0.0 109.804 -179.871 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 131' ' ' GLY . . . . . 0.499 ' H ' ' C ' ' A' ' 129' ' ' ALA . . . -171.03 170.65 43.41 Favored Glycine 0 N--CA 1.489 2.196 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -169.98 80.87 0.11 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.329 -1.1 . . . . 0.0 109.43 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 52.9 p 50.69 90.76 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.252 -0.905 . . . . 0.0 109.507 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -69.56 74.09 0.44 Allowed Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 43.0 t -62.69 91.33 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.252 -1.146 . . . . 0.0 109.48 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 49.9 m -66.8 -55.48 14.7 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.237 -0.915 . . . . 0.0 109.495 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 24.4 p 52.07 -163.37 0.08 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.272 -0.893 . . . . 0.0 109.555 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 89.3 p -65.41 -62.16 1.69 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.26 -0.9 . . . . 0.0 109.448 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.456 ' CB ' ' NZ ' ' A' ' 139' ' ' LYS . 6.4 ttpm? -60.3 139.79 57.43 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.29 -0.881 . . . . 0.0 109.511 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 3.1 t -171.81 173.05 4.65 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.217 -0.927 . . . . 0.0 109.542 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 43.8 t -64.54 -173.17 0.09 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.273 -0.892 . . . . 0.0 109.455 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 74.6 p -64.03 -169.27 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.293 -0.88 . . . . 0.0 109.446 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 12.7 t-80 52.23 96.8 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.18 -0.95 . . . . 0.0 109.516 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 89.9 p -169.59 29.86 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.217 -0.927 . . . . 0.0 109.42 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 54.1 mttp 52.98 19.92 1.51 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.215 -0.928 . . . . 0.0 109.418 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 52.28 -169.64 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.213 -0.929 . . . . 0.0 109.466 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' PHE . . . . . 0.404 ' C ' ' H ' ' A' ' 149' ' ' SER . 65.8 m-85 -69.51 -173.52 0.58 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.27 -0.894 . . . . 0.0 109.43 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 148' ' ' VAL . . . . . 0.492 ' O ' ' N ' ' A' ' 150' ' ' SER . 29.1 m -71.29 8.32 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.26 -0.9 . . . . 0.0 109.529 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 149' ' ' SER . . . . . 0.404 ' H ' ' C ' ' A' ' 147' ' ' PHE . 40.3 t 50.84 -92.27 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.258 -0.901 . . . . 0.0 109.493 -179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 150' ' ' SER . . . . . 0.492 ' N ' ' O ' ' A' ' 148' ' ' VAL . 93.3 p -163.63 105.39 0.95 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.315 -0.866 . . . . 0.0 109.431 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 151' ' ' SER . . . . . 0.536 ' C ' ' HG1' ' A' ' 152' ' ' THR . 79.2 p -171.09 -49.81 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.222 -0.924 . . . . 0.0 109.39 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 152' ' ' THR . . . . . 0.536 ' HG1' ' C ' ' A' ' 151' ' ' SER . 50.7 p 48.52 -90.89 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.345 -0.847 . . . . 0.0 109.812 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 153' ' ' THR . . . . . 0.522 ' N ' ' O ' ' A' ' 151' ' ' SER . 0.0 OUTLIER -47.51 91.04 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.229 -0.919 . . . . 0.0 109.923 -179.699 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.521 ' N ' ' O ' ' A' ' 152' ' ' THR . 5.5 t 57.46 113.01 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.339 -0.85 . . . . 0.0 109.907 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -69.85 82.31 0.46 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.229 -0.92 . . . . 0.0 109.323 179.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 34.7 ttm180 -61.82 -64.63 0.88 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.271 -0.893 . . . . 0.0 109.464 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 75.88 149.65 2.64 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 163.55 135.45 1.82 Allowed Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 96.5 p -75.02 132.73 41.55 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.213 -1.169 . . . . 0.0 109.457 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -151.34 148.57 28.31 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.238 -0.914 . . . . 0.0 109.396 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 15.8 tt -165.83 -18.15 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.213 -0.93 . . . . 0.0 109.481 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.439 ' CD ' ' N ' ' A' ' 162' ' ' GLU . 3.4 mp0 51.3 82.97 0.05 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.318 -0.863 . . . . 0.0 109.452 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 163' ' ' SER . . . . . 0.433 ' C ' ' H ' ' A' ' 165' ' ' HIS . 45.5 t -67.99 -168.22 0.1 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.247 -0.908 . . . . 0.0 109.457 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 164' ' ' LYS . . . . . 0.4 ' N ' ' OG ' ' A' ' 163' ' ' SER . 48.9 tttm -73.53 40.35 0.11 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.221 -0.924 . . . . 0.0 109.33 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 165' ' ' HIS . . . . . 0.433 ' H ' ' C ' ' A' ' 163' ' ' SER . 73.4 t60 -171.26 94.57 0.18 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.248 -0.907 . . . . 0.0 109.429 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 61.1 t80 . . . . . 0 N--CA 1.489 1.517 0 CA-C-O 118.022 -0.989 . . . . 0.0 109.471 179.991 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.564 ' N ' ' SD ' ' A' ' 1' ' ' MET . 1.8 mpt? . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 61.78 51.02 60.15 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 33.4 m -164.34 111.08 1.05 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.277 -1.131 . . . . 0.0 109.379 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 -74.25 -160.85 0.11 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.241 -0.912 . . . . 0.0 109.412 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -160.6 92.42 0.96 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.128 -0.982 . . . . 0.0 109.381 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -58.62 -30.73 67.48 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.183 -0.948 . . . . 0.0 109.416 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 tm-20 -168.61 139.62 2.57 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.288 -0.882 . . . . 0.0 109.286 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.402 ' O ' ' OG ' ' A' ' 9' ' ' SER . . . 178.75 -58.85 0.09 OUTLIER Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.402 ' OG ' ' O ' ' A' ' 8' ' ' GLY . 24.2 p 53.13 -165.13 0.08 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.269 -1.136 . . . . 0.0 109.471 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.451 ' C ' ' H ' ' A' ' 12' ' ' SER . 29.1 m -61.97 -32.33 53.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.163 -0.961 . . . . 0.0 109.482 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.0 m -68.6 44.49 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.25 -0.906 . . . . 0.0 109.458 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.451 ' H ' ' C ' ' A' ' 10' ' ' VAL . 99.1 p -63.54 113.4 3.28 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.283 -0.886 . . . . 0.0 109.454 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 174.59 178.47 44.51 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 63.7 p -150.89 62.42 0.92 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.228 -1.16 . . . . 0.0 109.346 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.483 ' O ' ' N ' ' A' ' 17' ' ' GLU . 64.5 mttm -150.84 14.01 0.72 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.2 -0.938 . . . . 0.0 109.367 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 63.3 mt-30 -68.36 50.55 0.07 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.253 -0.904 . . . . 0.0 109.489 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.483 ' N ' ' O ' ' A' ' 15' ' ' LYS . 64.1 mt-10 -61.73 -31.66 71.84 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.204 -0.935 . . . . 0.0 109.467 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -66.87 -178.06 0.7 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.249 -0.907 . . . . 0.0 109.472 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.4 t-160 -169.56 -86.64 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.18 -0.95 . . . . 0.0 109.566 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.411 ' O ' ' O ' ' A' ' 21' ' ' GLY . 93.8 m -71.05 -82.53 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.295 -0.878 . . . . 0.0 109.495 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.411 ' O ' ' O ' ' A' ' 20' ' ' THR . . . 63.09 125.2 0.01 OUTLIER Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.448 ' CB ' ' NZ ' ' A' ' 22' ' ' LYS . 6.8 mtpm? -61.35 -9.69 5.8 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.218 -1.166 . . . . 0.0 109.502 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.503 ' N ' HD22 ' A' ' 23' ' ' LEU . 4.0 mm? -50.87 163.9 0.17 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.252 -0.905 . . . . 0.0 109.319 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 33.8 m -149.77 -146.72 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 O-C-N 121.315 -0.865 . . . . 0.0 109.101 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.8 t -155.24 149.47 25.92 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.138 -0.976 . . . . 0.0 109.412 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 22.4 m 54.05 86.95 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.194 -0.941 . . . . 0.0 109.493 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.419 ' O ' ' O ' ' A' ' 28' ' ' GLY . 3.9 mmmm -65.92 88.18 0.11 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.24 -0.913 . . . . 0.0 109.411 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.419 ' O ' ' O ' ' A' ' 27' ' ' LYS . . . -58.89 -109.61 0.01 OUTLIER Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -169.65 162.77 9.94 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.2 -1.177 . . . . 0.0 109.484 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -63.35 140.14 58.84 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.303 -0.873 . . . . 0.0 109.4 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -152.29 -32.96 0.14 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.292 -0.88 . . . . 0.0 109.253 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 60.6 tp -70.78 -40.4 72.62 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.245 -0.909 . . . . 0.0 109.128 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.576 ' N ' HD12 ' A' ' 33' ' ' LEU . 8.3 mp -70.88 78.74 0.63 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.252 -0.905 . . . . 0.0 109.249 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.415 ' C ' ' H ' ' A' ' 36' ' ' ASN . 17.3 pt -91.58 39.1 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.271 -0.893 . . . . 0.0 109.247 179.873 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -70.99 45.44 0.09 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.248 -0.908 . . . . 0.0 109.489 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.415 ' H ' ' C ' ' A' ' 34' ' ' ILE . 31.0 m120 -73.7 134.57 43.56 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.336 -0.853 . . . . 0.0 109.381 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -71.91 -126.6 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.195 -0.94 . . . . 0.0 109.392 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt -75.19 95.76 3.18 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.056 -1.027 . . . . 0.0 109.533 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.0 m -70.27 155.78 7.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.224 -0.923 . . . . 0.0 109.513 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 41.3 m -66.83 128.9 38.07 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.218 -0.927 . . . . 0.0 109.493 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.408 ' OG ' ' N ' ' A' ' 42' ' ' GLY . 80.8 p -62.73 -84.04 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.229 -0.92 . . . . 0.0 109.457 179.872 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.408 ' N ' ' OG ' ' A' ' 41' ' ' SER . . . 65.71 17.0 64.34 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 25.2 t60 -169.55 53.12 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.247 -1.149 . . . . 0.0 109.436 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 33.6 m -65.54 102.69 0.74 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.236 -0.915 . . . . 0.0 109.428 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 76.1 p -73.78 83.63 1.64 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.262 -0.898 . . . . 0.0 109.48 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.438 HG22 ' H ' ' A' ' 46' ' ' THR . 1.4 t -70.22 59.78 0.18 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.251 -0.905 . . . . 0.0 109.46 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.7 t -60.05 -16.22 29.51 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.291 -0.881 . . . . 0.0 109.435 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 45.4 ttp180 -145.86 142.74 29.1 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.218 -0.926 . . . . 0.0 109.304 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -103.5 144.71 31.05 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.367 -0.833 . . . . 0.0 109.754 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 68.7 m -66.16 -100.08 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.186 -0.946 . . . . 0.0 109.243 179.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 15.3 t -49.63 135.17 19.05 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.1 -1.0 . . . . 0.0 108.826 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.418 ' O ' ' OG ' ' A' ' 52' ' ' SER . 53.0 p 50.43 87.47 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.991 -1.068 . . . . 0.0 108.542 -179.158 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -75.48 104.05 5.87 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.228 -0.92 . . . . 0.0 109.824 -178.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.577 ' C ' HD12 ' A' ' 55' ' ' ILE . 7.1 p -111.43 114.08 46.07 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 O-C-N 121.526 -0.734 . . . . 0.0 109.569 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.602 ' N ' HD12 ' A' ' 55' ' ' ILE . 1.7 mp -107.82 119.93 58.28 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 179.209 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 5.9 m -129.8 113.9 15.26 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.495 -0.753 . . . . 0.0 109.684 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.521 ' N ' ' OG1' ' A' ' 69' ' ' THR . 21.2 mttt -121.99 112.48 18.33 Favored 'General case' 0 N--CA 1.509 2.519 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 178.175 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 44.1 p -118.8 134.76 54.92 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.445 -0.784 . . . . 0.0 109.754 -179.247 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.3 m -132.17 119.69 41.03 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 178.708 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 42.7 p -110.93 136.54 49.79 Favored 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.523 ' OD1' ' N ' ' A' ' 62' ' ' ALA . 16.5 t30 -161.59 153.37 19.17 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 120.641 -1.287 . . . . 0.0 109.84 179.331 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.523 ' N ' ' OD1' ' A' ' 61' ' ' ASN . . . -74.3 -8.95 58.01 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.707 -1.246 . . . . 0.0 110.536 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.412 ' HB2' HD21 ' A' ' 61' ' ' ASN . 29.2 t70 -72.95 -1.87 18.69 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.309 -0.869 . . . . 0.0 109.851 -179.732 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 95.67 9.48 57.51 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 108.891 -1.684 . . . . 0.0 108.891 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 47.7 mtp180 -99.82 89.21 4.01 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.196 -1.179 . . . . 0.0 108.404 179.324 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.8 m -125.28 72.76 1.26 Allowed 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 73.8 mt-10 -100.87 131.82 46.57 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.454 -0.779 . . . . 0.0 111.727 -177.716 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.6 m -108.19 112.39 24.87 Favored 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 178.315 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.521 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 22.4 p -104.25 37.85 2.0 Allowed 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 179.369 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.4 pttm -65.46 61.73 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.676 -0.64 . . . . 0.0 109.463 179.223 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.506 ' N ' ' O ' ' A' ' 69' ' ' THR . 55.9 mt-10 -82.09 147.56 29.03 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.064 -1.022 . . . . 0.0 109.821 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 72' ' ' VAL . 22.9 m -127.81 134.94 64.31 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.584 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 14.7 t -128.69 118.03 46.24 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 CA-C-O 122.217 1.008 . . . . 0.0 109.264 179.521 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 44.9 mtmt -77.77 161.21 27.86 Favored 'General case' 0 C--N 1.29 -2.007 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.512 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.436 ' C ' ' H ' ' A' ' 77' ' ' ASP . 49.8 m -65.69 139.98 58.43 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.237 -0.914 . . . . 0.0 109.365 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -76.06 36.35 0.14 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.164 -0.96 . . . . 0.0 109.435 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.436 ' H ' ' C ' ' A' ' 75' ' ' SER . 8.3 t0 -159.0 -70.57 0.08 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.341 -0.849 . . . . 0.0 109.35 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 105.99 29.55 4.86 Favored Glycine 0 N--CA 1.497 2.765 0 N-CA-C 109.343 -1.503 . . . . 0.0 109.343 -179.878 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 43.5 t -75.52 -16.9 60.23 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.325 -1.103 . . . . 0.0 109.276 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.5 ' O ' ' SG ' ' A' ' 81' ' ' CYS . 11.1 p-10 -166.84 39.19 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.418 -0.801 . . . . 0.0 109.079 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.52 ' O ' ' N ' ' A' ' 83' ' ' ASP . 62.5 m -154.64 159.16 40.63 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.455 -0.778 . . . . 0.0 109.457 179.927 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 45.81 16.06 0.12 Allowed Glycine 0 N--CA 1.493 2.471 0 N-CA-C 109.984 -1.246 . . . . 0.0 109.984 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.52 ' N ' ' O ' ' A' ' 81' ' ' CYS . 25.2 m-20 -157.93 -172.83 4.08 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.139 -1.213 . . . . 0.0 109.568 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -167.92 8.0 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.327 -0.858 . . . . 0.0 109.409 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 63.0 t0 -167.64 113.63 0.72 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.232 -0.917 . . . . 0.0 109.387 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -75.39 -23.38 57.06 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.281 -0.887 . . . . 0.0 109.493 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -60.65 177.99 0.26 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.201 -0.937 . . . . 0.0 109.498 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' TRP . . . . . 0.474 ' O ' ' CG ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -169.09 -168.26 0.82 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.285 -0.884 . . . . 0.0 109.343 179.969 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.474 ' CG ' ' O ' ' A' ' 88' ' ' TRP . 96.9 m-70 -155.97 114.28 3.39 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.209 -0.932 . . . . 0.0 109.392 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.0 m-70 -64.74 -78.2 0.05 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.234 -0.916 . . . . 0.0 109.551 -179.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 71.5 p -149.87 146.63 27.22 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.324 -0.86 . . . . 0.0 109.237 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -71.53 150.67 93.75 Favored Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 121.182 -0.949 . . . . 0.0 109.039 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -56.4 -71.47 0.04 OUTLIER 'Trans proline' 0 C--N 1.322 -0.832 0 C-N-CA 120.967 1.111 . . . . 0.0 109.765 179.53 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 89.4 p -69.0 127.85 34.61 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.267 -0.896 . . . . 0.0 109.478 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 79.2 mtm180 -66.41 -73.56 0.13 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.252 -0.905 . . . . 0.0 109.398 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -177.88 12.62 0.03 OUTLIER Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 33.9 m120 -62.43 140.51 58.57 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.28 -1.13 . . . . 0.0 109.479 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.569 HD22 ' N ' ' A' ' 98' ' ' LEU . 3.5 mm? -70.1 98.05 1.27 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.297 -0.877 . . . . 0.0 109.235 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -63.06 148.88 46.51 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.228 -0.92 . . . . 0.0 109.443 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -61.09 161.81 8.08 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.259 -0.901 . . . . 0.0 109.484 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -67.82 -47.11 69.96 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.277 -0.889 . . . . 0.0 109.386 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -69.16 79.08 0.35 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.235 -0.916 . . . . 0.0 109.508 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 40.6 p-80 -62.73 -22.81 66.81 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.199 -0.938 . . . . 0.0 109.495 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 62.6 ttt180 -55.67 158.13 3.7 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.228 -0.92 . . . . 0.0 109.447 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -53.81 -59.96 3.94 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.173 -0.954 . . . . 0.0 109.444 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.416 ' O ' ' O ' ' A' ' 107' ' ' ASP . 21.9 pttm -168.99 -149.84 0.08 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.223 -0.923 . . . . 0.0 109.464 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.416 ' O ' ' O ' ' A' ' 106' ' ' LYS . 13.4 t70 55.52 170.1 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.267 -0.896 . . . . 0.0 109.497 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -166.85 174.1 8.85 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.276 -0.89 . . . . 0.0 109.51 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -77.37 -47.5 19.7 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.278 -0.889 . . . . 0.0 109.47 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' PHE . . . . . 0.471 ' O ' ' CD2' ' A' ' 110' ' ' PHE . 9.0 p90 -74.53 91.31 2.28 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.293 -0.879 . . . . 0.0 109.464 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 70.2 p -79.52 81.93 5.71 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.238 -0.914 . . . . 0.0 109.468 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.406 ' HG2' ' H ' ' A' ' 114' ' ' SER . 61.4 ttt180 -169.16 -75.15 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.248 -0.907 . . . . 0.0 109.467 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.417 ' O ' ' O ' ' A' ' 114' ' ' SER . 33.5 t 49.92 23.42 1.06 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.308 -0.87 . . . . 0.0 109.447 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.417 ' O ' ' O ' ' A' ' 113' ' ' SER . 4.8 p 62.26 140.07 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.31 -0.869 . . . . 0.0 109.505 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 56.2 m80 -75.71 15.04 0.55 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.311 -0.868 . . . . 0.0 109.48 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.415 ' H ' ' C ' ' A' ' 114' ' ' SER . 37.7 mt-10 52.35 52.75 13.59 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.175 -0.953 . . . . 0.0 109.394 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 51.03 -100.95 0.09 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.225 -0.922 . . . . 0.0 109.44 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.448 ' O ' ' N ' ' A' ' 120' ' ' ARG . 30.1 m-20 53.04 -147.76 0.47 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.141 -0.974 . . . . 0.0 109.453 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -59.16 86.8 0.02 OUTLIER Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.448 ' N ' ' O ' ' A' ' 118' ' ' ASP . 67.5 ttt180 -168.42 126.09 1.09 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.259 -1.142 . . . . 0.0 109.449 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 69.6 p -68.48 139.8 55.69 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.215 -0.928 . . . . 0.0 109.482 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -73.35 -95.44 0.1 OUTLIER Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.577 ' N ' HD12 ' A' ' 123' ' ' LEU . 8.0 mp -65.34 127.22 30.86 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.199 -1.177 . . . . 0.0 109.188 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.551 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -78.91 162.5 64.66 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.328 -0.858 . . . . 0.0 108.84 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.551 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 2.9 Cg_endo -55.64 154.2 26.48 Favored 'Trans proline' 0 C--N 1.318 -1.036 0 C-N-CA 121.315 1.343 . . . . 0.0 109.734 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 67.5 mm-40 -80.71 18.06 1.04 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.293 -0.879 . . . . 0.0 109.582 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -146.15 99.66 3.27 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.18 -0.95 . . . . 0.0 109.441 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -77.78 111.28 13.42 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.312 -0.868 . . . . 0.0 109.459 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -79.67 -68.19 0.69 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.371 -0.831 . . . . 0.0 109.496 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.557 ' N ' HD12 ' A' ' 130' ' ' LEU . 8.5 mp 53.8 -97.16 0.06 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.435 -0.79 . . . . 0.0 109.238 -179.615 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 176.29 10.63 0.02 OUTLIER Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.513 ' OE1' ' N ' ' A' ' 132' ' ' GLU . 0.6 OUTLIER -60.02 -11.36 5.65 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.228 -1.16 . . . . 0.0 109.337 179.935 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 89.4 p -171.56 137.17 1.03 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.246 -0.909 . . . . 0.0 109.526 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 177.97 84.65 0.06 OUTLIER Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.314 -1.514 . . . . 0.0 109.314 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 90.0 p -66.16 -24.15 66.6 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.267 -1.137 . . . . 0.0 109.517 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 74.4 m -166.58 176.07 7.54 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.232 -0.918 . . . . 0.0 109.375 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 84.4 p -168.94 33.21 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.328 -0.857 . . . . 0.0 109.309 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 44.0 t -60.14 -61.35 2.67 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.338 -0.851 . . . . 0.0 109.485 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt 51.09 86.44 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.265 -0.897 . . . . 0.0 109.306 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 82.7 p -81.48 154.46 26.32 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.219 -0.926 . . . . 0.0 109.408 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 78.1 p -167.17 12.8 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.262 -0.899 . . . . 0.0 109.507 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 53.2 p -62.42 -149.48 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.3 -0.875 . . . . 0.0 109.496 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -61.04 96.64 0.05 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.275 -0.89 . . . . 0.0 109.379 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 55.3 m -62.58 -4.7 2.11 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.208 -0.932 . . . . 0.0 109.413 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 47.3 mtmt -60.2 129.92 44.11 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.245 -0.909 . . . . 0.0 109.41 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -151.81 -87.58 0.07 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.208 -0.933 . . . . 0.0 109.368 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 53.21 -150.91 0.34 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.217 -0.927 . . . . 0.0 109.567 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 26.8 t -59.33 -25.13 29.84 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.291 -0.881 . . . . 0.0 109.433 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 24.1 p 53.23 -168.21 0.06 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.257 -0.902 . . . . 0.0 109.395 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 52.3 m -68.07 110.26 3.87 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.237 -0.914 . . . . 0.0 109.488 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 27.7 t -172.0 141.65 1.36 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.23 -0.919 . . . . 0.0 109.494 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 152' ' ' THR . . . . . 0.403 ' O ' ' OG1' ' A' ' 153' ' ' THR . 74.1 p -65.08 127.1 30.22 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.251 -0.906 . . . . 0.0 109.465 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 153' ' ' THR . . . . . 0.501 ' O ' ' N ' ' A' ' 155' ' ' ASN . 55.1 m -166.34 -65.6 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.276 -0.89 . . . . 0.0 109.503 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.478 ' O ' ' N ' ' A' ' 156' ' ' ARG . 2.8 m -60.8 80.25 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.294 -0.879 . . . . 0.0 109.503 -179.864 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 155' ' ' ASN . . . . . 0.501 ' N ' ' O ' ' A' ' 153' ' ' THR . 50.4 t30 -68.43 54.3 0.08 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.222 -0.924 . . . . 0.0 109.236 179.772 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 156' ' ' ARG . . . . . 0.478 ' N ' ' O ' ' A' ' 154' ' ' VAL . 81.8 mtm180 -90.6 145.21 25.04 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.334 -0.854 . . . . 0.0 109.418 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -174.47 -150.21 7.58 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -81.23 106.58 2.6 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 159' ' ' SER . . . . . 0.407 ' H ' ' H ' ' A' ' 160' ' ' ALA . 31.9 t -168.54 -8.47 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.293 -1.122 . . . . 0.0 109.455 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.407 ' H ' ' H ' ' A' ' 159' ' ' SER . . . -173.09 165.86 4.96 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.281 -0.887 . . . . 0.0 109.52 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 17.4 mm 55.72 -116.25 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.319 -0.863 . . . . 0.0 109.408 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -81.45 -167.22 1.39 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 120.908 -1.12 . . . . 0.0 109.435 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 29.7 t -172.9 93.78 0.11 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.262 -0.899 . . . . 0.0 109.491 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -67.8 105.22 1.88 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.266 -0.896 . . . . 0.0 109.475 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 12.0 t-80 -66.3 105.69 1.5 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.25 -0.906 . . . . 0.0 109.501 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 118.02 -0.99 . . . . 0.0 109.477 -179.971 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 mmt . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -75.21 97.64 1.06 Allowed Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.444 -1.463 . . . . 0.0 109.444 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 82.8 p -63.21 -35.12 79.25 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.246 -1.15 . . . . 0.0 109.489 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -73.4 -39.09 65.34 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.289 -0.882 . . . . 0.0 109.46 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -149.42 140.69 23.15 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.236 -0.915 . . . . 0.0 109.426 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.6 tp10 -48.87 -27.49 3.09 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.188 -0.945 . . . . 0.0 109.464 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -168.23 -66.38 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.265 -0.897 . . . . 0.0 109.443 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 67.5 131.83 0.03 OUTLIER Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 78.7 p -168.61 151.44 5.26 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.223 -1.163 . . . . 0.0 109.425 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 30.2 m -67.73 -165.49 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.22 -0.925 . . . . 0.0 109.485 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 72.6 m -168.0 -100.5 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.327 -0.858 . . . . 0.0 109.471 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.8 t -173.0 177.5 2.76 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.311 -0.868 . . . . 0.0 109.467 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.446 ' C ' ' H ' ' A' ' 15' ' ' LYS . . . 178.04 70.16 0.06 OUTLIER Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 81.0 p -74.15 36.72 0.1 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.264 -1.139 . . . . 0.0 109.496 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.446 ' H ' ' C ' ' A' ' 13' ' ' GLY . 1.0 OUTLIER -172.55 61.88 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.265 -0.897 . . . . 0.0 109.431 179.967 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -163.94 51.28 0.14 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.217 -0.927 . . . . 0.0 109.328 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.439 ' O ' ' O ' ' A' ' 18' ' ' PHE . 15.4 pt-20 -77.41 -35.18 54.45 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.232 -0.918 . . . . 0.0 109.427 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.439 ' O ' ' O ' ' A' ' 17' ' ' GLU . 63.4 m-85 51.75 99.59 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.377 -0.827 . . . . 0.0 109.583 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.439 ' CG ' ' O ' ' A' ' 19' ' ' HIS . 85.2 t60 -148.95 48.87 0.99 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.304 -0.873 . . . . 0.0 109.357 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' A' ' 19' ' ' HIS . 74.0 m -165.91 90.0 0.44 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.351 -0.843 . . . . 0.0 109.34 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -175.87 128.88 1.44 Allowed Glycine 0 N--CA 1.489 2.232 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -98.2 82.36 2.92 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.29 -1.123 . . . . 0.0 109.305 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.573 ' N ' HD12 ' A' ' 23' ' ' LEU . 9.0 mp -71.26 145.22 49.71 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.204 -0.935 . . . . 0.0 109.456 -179.795 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.694 HG12 ' H ' ' A' ' 25' ' ' THR . 18.7 t -63.43 178.08 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.337 -0.852 . . . . 0.0 109.141 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.694 ' H ' HG12 ' A' ' 24' ' ' VAL . 71.7 p -138.34 57.17 1.71 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.364 -0.835 . . . . 0.0 109.254 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 33.4 p -62.33 137.78 58.32 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.2 -0.938 . . . . 0.0 109.411 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -79.44 -44.91 20.46 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.17 -0.956 . . . . 0.0 109.385 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 139.32 -117.52 1.38 Allowed Glycine 0 N--CA 1.496 2.681 0 N-CA-C 109.313 -1.515 . . . . 0.0 109.313 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -172.79 154.23 2.89 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.252 -1.146 . . . . 0.0 109.377 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 41.4 mmtm -63.04 -73.75 0.11 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.231 -0.918 . . . . 0.0 109.438 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -169.63 115.16 0.55 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.272 -0.892 . . . . 0.0 109.465 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.584 ' N ' HD12 ' A' ' 32' ' ' LEU . 8.4 mp -77.76 -26.64 50.01 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.21 -0.932 . . . . 0.0 109.321 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 20.7 mt -65.26 120.42 12.72 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.178 -0.951 . . . . 0.0 109.377 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 71.0 mt 52.22 80.19 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.265 -0.897 . . . . 0.0 109.475 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -71.78 171.27 11.94 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.329 -0.857 . . . . 0.0 109.486 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.43 ' O ' ' OE2' ' A' ' 37' ' ' GLU . 10.6 t30 -68.34 75.96 0.25 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.175 -0.953 . . . . 0.0 109.448 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.43 ' OE2' ' O ' ' A' ' 36' ' ' ASN . 66.7 mm-40 -138.67 -156.6 0.7 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.383 -0.823 . . . . 0.0 109.225 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -145.6 -146.3 0.19 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.286 -0.884 . . . . 0.0 109.429 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 33.0 m -91.36 156.23 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.203 -0.936 . . . . 0.0 109.531 -179.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 14.2 m -166.48 61.92 0.1 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.322 -0.861 . . . . 0.0 109.347 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 44.9 m -74.29 -161.86 0.13 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.243 -0.911 . . . . 0.0 109.596 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -176.8 151.08 10.85 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.5 m80 -77.25 59.34 1.77 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.214 -1.169 . . . . 0.0 109.471 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.5 t -68.3 -9.34 47.02 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.243 -0.911 . . . . 0.0 109.42 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 40.5 m -62.78 91.78 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.282 -0.886 . . . . 0.0 109.488 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 26.3 m 51.22 79.22 0.1 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.237 -0.915 . . . . 0.0 109.375 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 59.8 p -64.23 129.8 41.37 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.169 -0.957 . . . . 0.0 109.492 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 5.5 ptp180 -145.78 149.61 34.68 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.242 -0.911 . . . . 0.0 109.299 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -93.88 135.09 35.56 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.241 -0.912 . . . . 0.0 109.818 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.4 m -64.54 176.75 1.03 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.215 -0.928 . . . . 0.0 109.507 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.425 ' O ' ' N ' ' A' ' 53' ' ' LYS . 64.6 m 46.84 -122.77 1.31 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.206 -0.934 . . . . 0.0 108.997 -179.724 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 43.5 t -51.87 99.81 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 178.772 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.425 ' N ' ' O ' ' A' ' 51' ' ' CYS . 93.7 mttt -77.87 101.43 6.79 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.11 -0.994 . . . . 0.0 110.318 -178.612 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.3 t -106.72 114.13 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.029 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.498 HG23 ' O ' ' A' ' 55' ' ' ILE . 9.4 tp -127.99 126.98 67.41 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.481 -0.762 . . . . 0.0 108.998 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.474 ' O ' ' CG2' ' A' ' 56' ' ' THR . 0.8 OUTLIER -128.88 117.91 21.81 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.515 -0.741 . . . . 0.0 109.341 179.839 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.513 ' H ' ' HB ' ' A' ' 69' ' ' THR . 26.5 ttmt -127.08 114.53 17.88 Favored 'General case' 0 N--CA 1.521 3.102 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 178.568 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.5 m -115.66 131.42 56.94 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.624 -0.673 . . . . 0.0 109.86 -179.595 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' ' 59' ' ' VAL . 2.9 m -132.12 119.86 41.78 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.141 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.813 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 43.8 p -110.17 134.0 52.65 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -179.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -137.36 172.83 12.4 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.311 -0.868 . . . . 0.0 109.752 179.601 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.27 -40.33 95.75 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 120.807 -1.183 . . . . 0.0 112.566 -177.291 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.486 ' N ' ' OD1' ' A' ' 63' ' ' ASP . 2.0 m-20 -69.01 4.37 1.58 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.378 -1.451 . . . . 0.0 110.04 -178.437 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.527 ' O ' ' N ' ' A' ' 66' ' ' THR . . . 91.82 8.92 63.13 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 110.041 -1.224 . . . . 0.0 110.041 179.308 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.441 ' O ' ' O ' ' A' ' 59' ' ' VAL . 23.6 ttm180 -63.94 79.5 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.43 0 O-C-N 120.717 -1.461 . . . . 0.0 108.193 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.527 ' N ' ' O ' ' A' ' 64' ' ' GLY . 73.3 p -111.56 72.58 0.78 Allowed 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 -179.716 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -94.27 130.66 40.45 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.369 -0.832 . . . . 0.0 109.936 -178.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.41 ' C ' ' H ' ' A' ' 70' ' ' LYS . 4.0 m -108.55 109.53 20.79 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.49 -0.756 . . . . 0.0 109.656 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.528 ' O ' ' N ' ' A' ' 71' ' ' GLU . 3.8 m -82.29 39.63 0.6 Allowed 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.087 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.41 ' H ' ' C ' ' A' ' 68' ' ' THR . 13.3 ptpt -65.71 55.27 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.073 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.528 ' N ' ' O ' ' A' ' 69' ' ' THR . 54.2 mt-10 -89.28 131.97 35.12 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.091 -1.005 . . . . 0.0 109.983 -179.441 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.4 p -128.3 136.81 59.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 17.5 t -127.95 117.29 45.61 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 CA-C-O 122.012 0.911 . . . . 0.0 109.283 179.646 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -82.73 -31.55 28.4 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 6.9 m -81.8 -148.28 0.07 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.078 -1.014 . . . . 0.0 109.328 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.507 ' C ' ' H ' ' A' ' 78' ' ' GLY . 53.9 tt0 57.76 75.95 0.35 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.225 -0.922 . . . . 0.0 109.606 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.6 t70 64.61 -6.49 0.3 Allowed 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.33 -0.856 . . . . 0.0 109.562 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.507 ' H ' ' C ' ' A' ' 76' ' ' GLU . . . -86.25 -48.51 4.55 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 179.65 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 79.6 p -50.55 -35.12 28.25 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.242 -1.151 . . . . 0.0 109.074 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -94.37 27.49 2.92 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.405 -0.81 . . . . 0.0 109.451 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 35.0 t -157.99 -57.27 0.07 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.246 -0.908 . . . . 0.0 109.186 179.654 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.481 ' N ' ' O ' ' A' ' 78' ' ' GLY . . . -68.01 -34.4 81.64 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.477 ' CG ' ' H ' ' A' ' 84' ' ' ALA . 37.0 t0 -64.97 -141.3 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.303 -1.116 . . . . 0.0 109.442 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.477 ' H ' ' CG ' ' A' ' 83' ' ' ASP . . . -172.61 82.71 0.05 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.184 -0.947 . . . . 0.0 109.471 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.424 ' O ' ' OD2' ' A' ' 85' ' ' ASP . 6.4 p-10 40.7 84.03 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.74 -0.6 . . . . 0.0 110.217 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -165.17 95.45 0.67 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.26 -0.9 . . . . 0.0 109.486 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -168.33 95.76 0.39 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.18 -0.95 . . . . 0.0 109.476 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 56.9 t90 -169.2 91.17 0.23 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.297 -0.877 . . . . 0.0 109.474 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.9 -170.4 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.215 -0.928 . . . . 0.0 109.439 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 69.0 m-70 -72.76 149.03 44.03 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.268 -0.895 . . . . 0.0 109.35 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.508 ' OG1' ' N ' ' A' ' 92' ' ' PHE . 1.2 t -64.07 -169.8 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.191 -0.943 . . . . 0.0 109.441 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.508 ' N ' ' OG1' ' A' ' 91' ' ' THR . 0.1 OUTLIER -159.37 68.64 3.19 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.281 -0.887 . . . . 0.0 109.242 179.932 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -62.78 146.97 95.23 Favored 'Trans proline' 0 C--N 1.318 -1.062 0 C-N-CA 121.336 1.358 . . . . 0.0 109.71 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.451 ' C ' ' H ' ' A' ' 96' ' ' GLY . 38.0 m -78.95 163.76 24.97 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.223 -0.923 . . . . 0.0 109.43 -179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 28.8 mmt180 -67.78 6.08 0.74 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.231 -0.918 . . . . 0.0 109.383 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.451 ' H ' ' C ' ' A' ' 94' ' ' SER . . . 66.32 16.97 65.64 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 15.1 p-10 -64.08 142.64 58.34 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.234 -1.157 . . . . 0.0 109.447 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.404 ' C ' HD13 ' A' ' 98' ' ' LEU . 0.3 OUTLIER 59.57 101.19 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.212 -0.93 . . . . 0.0 109.071 179.937 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -55.66 141.09 39.2 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.34 -0.85 . . . . 0.0 109.529 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -161.37 -73.72 0.06 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.233 -0.917 . . . . 0.0 109.47 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -68.35 -56.8 7.27 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.195 -0.941 . . . . 0.0 109.399 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -97.12 97.86 9.55 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.4 -0.813 . . . . 0.0 109.302 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -54.37 -22.46 12.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.247 -0.908 . . . . 0.0 109.699 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 55.96 62.57 2.33 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.146 -0.971 . . . . 0.0 109.465 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -163.92 5.19 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.314 -0.866 . . . . 0.0 109.339 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 44.8 tttm 57.82 -127.09 1.64 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.276 -0.89 . . . . 0.0 109.258 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.48 ' CG ' ' H ' ' A' ' 108' ' ' ASP . 24.7 t0 -76.48 -173.45 2.52 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.07 -1.019 . . . . 0.0 109.446 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.48 ' H ' ' CG ' ' A' ' 107' ' ' ASP . 7.5 m-20 -157.46 -24.17 0.09 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.271 -0.893 . . . . 0.0 109.275 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.551 ' O ' ' CG ' ' A' ' 110' ' ' PHE . 91.4 m-85 -79.61 -5.39 54.91 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.366 -0.834 . . . . 0.0 109.528 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' PHE . . . . . 0.551 ' CG ' ' O ' ' A' ' 109' ' ' PHE . 51.6 p90 42.09 -167.33 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.857 0 CA-C-O 121.455 0.645 . . . . 0.0 110.439 -179.777 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 39.8 p -154.03 -61.79 0.13 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.381 -0.825 . . . . 0.0 109.045 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 30.7 ptt180 -67.16 167.59 11.83 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.339 -0.851 . . . . 0.0 109.412 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 46.0 m -154.84 -69.43 0.13 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.229 -0.919 . . . . 0.0 109.472 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 47.4 t -66.3 96.27 0.34 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.216 -0.928 . . . . 0.0 109.525 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 59.9 m80 -67.08 -27.75 67.62 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.24 -0.913 . . . . 0.0 109.461 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -67.84 85.45 0.22 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.319 -0.863 . . . . 0.0 109.551 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -67.18 -69.95 0.28 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.243 -0.911 . . . . 0.0 109.476 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -62.54 115.68 4.47 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.211 -0.93 . . . . 0.0 109.441 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.545 ' O ' ' N ' ' A' ' 121' ' ' THR . . . -171.29 -65.19 0.04 OUTLIER Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 58.0 mtt180 64.43 -42.38 0.28 Allowed 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.834 -0.804 . . . . 0.0 110.059 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.545 ' N ' ' O ' ' A' ' 119' ' ' GLY . 6.7 t -67.11 -155.8 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.993 -1.067 . . . . 0.0 109.489 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' GLY . . . . . 0.465 ' N ' ' OG1' ' A' ' 121' ' ' THR . . . -172.0 -165.43 29.14 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 14.3 mt -68.85 135.17 50.7 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.157 -1.202 . . . . 0.0 109.37 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.536 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -73.8 162.51 73.8 Favored Pre-proline 0 N--CA 1.49 1.56 0 O-C-N 121.236 -0.915 . . . . 0.0 108.838 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.536 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 2.1 Cg_endo -56.53 131.27 44.65 Favored 'Trans proline' 0 C--N 1.319 -0.989 0 C-N-CA 121.293 1.329 . . . . 0.0 109.709 179.677 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -75.4 8.12 3.03 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.205 -0.934 . . . . 0.0 109.324 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -151.49 70.69 0.97 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.294 -0.878 . . . . 0.0 109.37 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -78.72 -10.55 59.8 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.279 -0.888 . . . . 0.0 109.516 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 54.05 76.93 0.21 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.305 -0.872 . . . . 0.0 109.423 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 15.7 mt -74.79 111.24 9.79 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.311 -0.868 . . . . 0.0 109.458 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -146.63 -49.67 0.03 OUTLIER Glycine 0 N--CA 1.494 2.54 0 N-CA-C 109.464 -1.454 . . . . 0.0 109.464 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -68.08 -76.22 0.09 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.272 -1.134 . . . . 0.0 109.465 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 80.7 p -80.37 108.9 14.36 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.22 -0.925 . . . . 0.0 109.499 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -173.11 -161.39 23.37 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 94.5 p -67.55 118.65 11.14 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.229 -1.159 . . . . 0.0 109.53 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 40.5 t -70.28 -12.79 61.83 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.173 -0.954 . . . . 0.0 109.497 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 69.6 m 51.24 -100.73 0.09 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.283 -0.886 . . . . 0.0 109.462 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 40.3 t 50.82 -99.16 0.07 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.204 -0.935 . . . . 0.0 109.436 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -169.7 158.5 7.61 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.175 -0.953 . . . . 0.0 109.395 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 37.6 m -162.99 118.06 1.74 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.258 -0.901 . . . . 0.0 109.366 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 28.7 t -173.06 -39.67 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.259 -0.901 . . . . 0.0 109.384 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 5.1 m 52.04 47.46 24.71 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.26 -0.9 . . . . 0.0 109.416 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 29.3 p-80 -79.1 -177.21 5.5 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.275 -0.89 . . . . 0.0 109.444 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 30.3 t -169.91 -97.09 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.204 -0.935 . . . . 0.0 109.472 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 38.0 mmtm 55.28 40.91 31.69 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.261 -0.899 . . . . 0.0 109.439 -179.857 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' GLN . . . . . 0.405 ' HG3' ' H ' ' A' ' 149' ' ' SER . 4.5 pt20 -58.79 140.09 55.48 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.294 -0.879 . . . . 0.0 109.478 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -77.86 -20.68 52.6 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.188 -0.945 . . . . 0.0 109.458 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 37.7 t -67.84 -41.08 84.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 O-C-N 121.292 -0.88 . . . . 0.0 109.466 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 149' ' ' SER . . . . . 0.433 ' O ' ' O ' ' A' ' 150' ' ' SER . 12.8 t 52.49 55.04 9.67 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.284 -0.885 . . . . 0.0 109.501 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 150' ' ' SER . . . . . 0.433 ' O ' ' O ' ' A' ' 149' ' ' SER . 2.0 m 61.04 144.08 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.327 -0.858 . . . . 0.0 109.557 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 151' ' ' SER . . . . . 0.423 ' O ' ' O ' ' A' ' 152' ' ' THR . 14.1 t -175.21 -65.35 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.224 -0.923 . . . . 0.0 109.509 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 152' ' ' THR . . . . . 0.423 ' O ' ' O ' ' A' ' 151' ' ' SER . 7.5 p 52.01 178.22 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.264 -0.897 . . . . 0.0 109.437 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 66.7 p -73.5 170.81 14.37 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.234 -0.916 . . . . 0.0 109.441 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 5.6 m -150.86 64.08 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 121.27 -0.894 . . . . 0.0 109.311 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 5.7 p-10 -157.06 123.31 4.89 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.293 -0.879 . . . . 0.0 109.388 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 86.2 mtm180 -99.61 -174.61 2.76 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.343 -0.848 . . . . 0.0 109.318 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -49.6 -75.29 0.21 Allowed Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -75.83 143.93 30.65 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 66.1 m -164.66 15.8 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.319 -1.106 . . . . 0.0 109.472 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -171.66 -167.6 0.52 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.3 -0.875 . . . . 0.0 109.449 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 161' ' ' ILE . . . . . 0.5 HG23 ' O ' ' A' ' 161' ' ' ILE . 9.7 tt -167.14 92.89 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.212 -0.93 . . . . 0.0 109.486 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 49.1 -146.21 0.36 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.105 -0.997 . . . . 0.0 109.504 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 68.2 m -165.17 42.55 0.08 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.206 -0.934 . . . . 0.0 109.475 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -169.07 67.76 0.06 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.219 -0.926 . . . . 0.0 109.418 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 165' ' ' HIS . . . . . 0.417 ' CD2' ' H ' ' A' ' 165' ' ' HIS . 13.1 p80 -63.42 -46.17 87.58 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.289 -0.882 . . . . 0.0 109.495 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 166' ' ' PHE . . . . . 0.4 ' N ' ' CG ' ' A' ' 165' ' ' HIS . 59.9 t80 . . . . . 0 N--CA 1.49 1.55 0 CA-C-O 118.022 -0.99 . . . . 0.0 109.453 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.58 HH11 ' CG ' ' A' ' 49' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.494 1.774 0 CA-C-O 121.224 0.535 . . . . 0.0 109.585 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.438 ' O ' ' O ' ' A' ' 49' ' ' ARG . 95.9 p -59.82 -150.69 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.341 -0.85 . . . . 0.0 109.621 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.57 ' SG ' ' N ' ' A' ' 52' ' ' SER . 10.3 t 50.84 -100.69 0.09 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.076 -1.015 . . . . 0.0 109.15 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.57 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 16.3 t -71.81 -165.35 0.16 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.223 -0.923 . . . . 0.0 108.967 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.516 ' N ' ' OG ' ' A' ' 52' ' ' SER . 19.4 tptm -120.87 106.17 11.39 Favored 'General case' 0 N--CA 1.498 1.969 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 9.9 t -125.99 117.82 49.99 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.522 -0.736 . . . . 0.0 109.541 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.478 HG23 ' O ' ' A' ' 55' ' ' ILE . 12.1 tt -122.77 119.64 58.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.488 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 71.1 p -131.61 113.46 13.64 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.536 -0.728 . . . . 0.0 109.157 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.551 ' N ' ' OG1' ' A' ' 69' ' ' THR . 11.9 mtpt -121.85 112.73 18.71 Favored 'General case' 0 N--CA 1.513 2.697 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 178.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 81.8 p -119.07 128.7 54.58 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.575 -0.703 . . . . 0.0 109.613 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.415 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.7 m -131.63 126.1 57.12 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 178.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.57 133.98 52.81 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.721 -0.612 . . . . 0.0 109.635 -179.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -123.42 162.45 22.78 Favored 'General case' 0 N--CA 1.518 2.944 0 O-C-N 121.186 -0.946 . . . . 0.0 109.229 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.46 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -67.22 -41.12 86.27 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.622 -1.299 . . . . 0.0 112.635 -177.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.508 ' OD1' ' N ' ' A' ' 63' ' ' ASP . 18.8 p-10 -68.17 8.55 0.42 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.351 -1.468 . . . . 0.0 110.201 -177.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.46 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 85.55 9.25 79.14 Favored Glycine 0 N--CA 1.493 2.446 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 179.218 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -83.49 100.65 10.89 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 120.912 -1.346 . . . . 0.0 107.435 178.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.4 p -131.68 113.29 13.4 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.469 -0.77 . . . . 0.0 110.068 -178.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -94.64 120.53 35.02 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.437 -0.79 . . . . 0.0 109.79 -179.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.4 p -101.36 110.58 22.61 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.396 -0.815 . . . . 0.0 109.248 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.551 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 28.0 p -111.21 29.4 7.83 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 179.02 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.4 ptmt -65.44 67.48 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 69' ' ' THR . 72.0 mm-40 -101.63 156.83 17.25 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.335 -0.853 . . . . 0.0 109.989 -179.249 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.434 ' O ' HG13 ' A' ' 72' ' ' VAL . 7.5 p -128.35 129.78 69.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 179.251 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.444 ' O ' ' O ' ' A' ' 53' ' ' LYS . 96.8 t -113.75 132.18 63.45 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 CA-C-O 122.279 1.037 . . . . 0.0 109.352 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.5 mmmt . . . . . 0 C--N 1.291 -1.966 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 179.594 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.429 ' O ' ' O ' ' A' ' 50' ' ' SER . 20.9 mmm180 . . . . . 0 N--CA 1.503 2.202 0 CA-C-O 121.314 0.578 . . . . 0.0 109.469 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.429 ' O ' ' O ' ' A' ' 49' ' ' ARG . 29.3 m -58.57 -156.81 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.278 -0.889 . . . . 0.0 109.945 -179.796 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.582 ' SG ' ' N ' ' A' ' 52' ' ' SER . 46.0 t 48.86 -119.41 1.19 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.295 -0.878 . . . . 0.0 109.346 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.582 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 42.0 m -60.64 128.09 34.91 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.058 -1.026 . . . . 0.0 108.843 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.442 ' O ' ' O ' ' A' ' 73' ' ' VAL . 0.0 OUTLIER -74.46 102.4 4.45 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.842 -1.161 . . . . 0.0 109.195 -179.419 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.574 HG13 ' O ' ' A' ' 54' ' ' VAL . 10.3 p -126.01 116.02 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 179.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.448 HG23 ' O ' ' A' ' 55' ' ' ILE . 17.9 tt -127.71 129.34 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 51.0 p -130.05 114.56 15.94 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.395 -0.816 . . . . 0.0 109.311 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.574 ' N ' ' OG1' ' A' ' 69' ' ' THR . 7.8 mtmt -121.4 113.5 19.97 Favored 'General case' 0 N--CA 1.514 2.771 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 178.692 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 65.9 p -116.38 136.29 53.13 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.479 -0.763 . . . . 0.0 109.886 -179.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.426 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.7 m -131.72 124.05 53.13 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 178.538 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -108.97 133.45 52.95 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.763 -0.586 . . . . 0.0 110.196 -179.161 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.479 ' OD1' ' N ' ' A' ' 62' ' ' ALA . 26.3 t-20 -125.46 158.78 33.57 Favored 'General case' 0 N--CA 1.516 2.827 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.479 ' N ' ' OD1' ' A' ' 61' ' ' ASN . . . -71.66 -31.52 66.92 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 120.365 -1.459 . . . . 0.0 112.445 -177.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -69.88 8.57 0.68 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.499 -1.376 . . . . 0.0 109.638 -178.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.442 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 85.36 5.27 85.3 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.722 -1.351 . . . . 0.0 109.722 179.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 64.0 ttt180 -83.43 103.02 12.46 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.77 -1.43 . . . . 0.0 107.929 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 12.2 p -132.66 108.54 9.11 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.473 -0.767 . . . . 0.0 109.703 -178.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -94.92 130.52 41.5 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.226 -0.922 . . . . 0.0 109.933 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.5 p -108.96 107.52 17.93 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.479 -0.763 . . . . 0.0 109.407 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.574 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 30.8 p -97.78 33.01 2.18 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 178.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 74.2 mttt -66.71 67.63 0.06 Allowed 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 179.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.48 ' N ' ' O ' ' A' ' 69' ' ' THR . 74.3 mt-10 -98.0 149.85 22.0 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.169 -0.957 . . . . 0.0 110.142 -179.05 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.6 t -129.04 117.16 43.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.442 ' O ' ' O ' ' A' ' 53' ' ' LYS . 59.4 t -114.79 126.85 72.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 CA-C-O 122.105 0.955 . . . . 0.0 109.349 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 50.8 mttp . . . . . 0 C--N 1.289 -2.041 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 179.5 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.529 HH11 ' CG ' ' A' ' 49' ' ' ARG . 0.9 OUTLIER . . . . . 0 N--CA 1.499 2.018 0 CA-C-O 121.2 0.524 . . . . 0.0 109.621 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 36.8 t -62.39 -105.01 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.266 -0.896 . . . . 0.0 109.234 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 5.6 t -49.75 146.11 4.68 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.145 -0.972 . . . . 0.0 108.818 179.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 40.3 t 50.54 87.49 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.007 -1.058 . . . . 0.0 108.342 -179.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -75.84 104.84 6.56 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.307 -0.87 . . . . 0.0 110.292 -178.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.599 HG13 ' O ' ' A' ' 54' ' ' VAL . 11.7 p -115.61 113.6 43.84 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.528 HG23 ' O ' ' A' ' 55' ' ' ILE . 10.1 tp -128.52 125.44 63.69 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 65.4 p -128.89 111.41 13.03 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.359 -0.838 . . . . 0.0 109.278 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.522 ' H ' ' HB ' ' A' ' 69' ' ' THR . 0.1 OUTLIER -124.55 113.59 18.28 Favored 'General case' 0 N--CA 1.51 2.561 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 178.767 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.0 p -110.95 130.22 55.65 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.467 -0.771 . . . . 0.0 109.67 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.497 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.8 m -132.55 120.3 41.77 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.14 0 O-C-N 121.481 -0.762 . . . . 0.0 109.207 178.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 33.9 p -109.11 133.86 52.46 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 37.6 t-20 -128.37 162.33 27.36 Favored 'General case' 0 N--CA 1.514 2.769 0 O-C-N 121.46 -0.775 . . . . 0.0 109.317 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.414 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -71.91 -32.38 67.32 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 120.559 -1.338 . . . . 0.0 112.558 -177.641 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -69.21 5.59 1.21 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.372 -1.455 . . . . 0.0 109.953 -178.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.414 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 90.79 4.76 69.33 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 110.08 -1.208 . . . . 0.0 110.08 179.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 11.2 mpt_? -80.67 94.24 6.3 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 120.636 -1.508 . . . . 0.0 107.86 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 31.0 p -120.36 89.66 3.17 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -94.73 122.21 37.11 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.268 -0.895 . . . . 0.0 110.051 -178.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.408 ' C ' ' H ' ' A' ' 70' ' ' LYS . 40.8 p -101.19 109.18 21.01 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.329 -0.857 . . . . 0.0 109.581 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.524 ' O ' ' N ' ' A' ' 71' ' ' GLU . 5.2 m -87.4 31.19 0.75 Allowed 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 178.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.408 ' H ' ' C ' ' A' ' 68' ' ' THR . 16.5 ptmt -64.84 59.01 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.524 ' N ' ' O ' ' A' ' 69' ' ' THR . 13.7 mm-40 -96.3 136.78 36.33 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.053 -1.029 . . . . 0.0 109.481 -179.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.486 ' O ' HG23 ' A' ' 72' ' ' VAL . 10.4 m -128.15 129.8 69.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 179.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 15.1 t -129.08 114.32 31.89 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 CA-C-O 122.057 0.932 . . . . 0.0 108.946 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.292 -1.928 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.604 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.475 ' O ' ' O ' ' A' ' 52' ' ' SER . 22.6 mmt180 . . . . . 0 N--CA 1.499 2.013 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.497 ' C ' ' H ' ' A' ' 52' ' ' SER . 29.5 t -78.71 -36.84 42.83 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.063 -1.023 . . . . 0.0 110.22 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 25.9 p -56.02 -4.02 0.11 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.029 -1.044 . . . . 0.0 109.744 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.524 ' OG ' ' N ' ' A' ' 53' ' ' LYS . 0.9 OUTLIER -166.26 -175.17 3.17 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 -179.78 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.524 ' N ' ' OG ' ' A' ' 52' ' ' SER . 44.6 tptt -103.89 101.67 11.46 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 120.95 -1.094 . . . . 0.0 108.049 179.176 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 21.7 t -127.63 114.73 37.03 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.875 0 O-C-N 121.479 -0.763 . . . . 0.0 109.975 -179.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.491 ' CG2' ' NZ ' ' A' ' 57' ' ' LYS . 35.9 mm -117.84 113.64 42.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 179.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 81.7 p -130.34 112.97 13.79 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.223 -0.923 . . . . 0.0 109.937 -179.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.57 ' N ' ' OG1' ' A' ' 69' ' ' THR . 10.9 mmtp -123.86 114.19 19.52 Favored 'General case' 0 N--CA 1.515 2.777 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 178.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 53.3 m -119.5 124.43 46.44 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.609 -0.682 . . . . 0.0 109.613 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.42 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.8 m -131.48 124.88 55.47 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.187 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.011 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.513 ' O ' HG23 ' A' ' 60' ' ' THR . 8.0 t -109.23 122.93 48.38 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.757 -0.589 . . . . 0.0 110.323 -179.465 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -110.56 144.94 38.66 Favored 'General case' 0 N--CA 1.513 2.685 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.464 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -62.82 -34.7 77.86 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 120.084 -1.635 . . . . 0.0 112.944 -177.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -66.24 5.63 0.52 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.355 -1.466 . . . . 0.0 110.045 -178.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.464 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 90.83 5.49 68.41 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 110.423 -1.071 . . . . 0.0 110.423 178.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 41.2 ttm180 -90.54 111.98 23.47 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.644 -1.504 . . . . 0.0 107.834 178.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.8 p -138.47 116.95 12.04 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.255 -0.903 . . . . 0.0 109.81 -179.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -94.35 119.51 33.21 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.281 -0.887 . . . . 0.0 109.77 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.0 p -103.46 109.0 20.49 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.431 -0.793 . . . . 0.0 109.395 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.57 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 4.6 p -111.62 26.72 10.35 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 107.383 -1.339 . . . . 0.0 107.383 178.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 36.4 pttt -65.36 65.9 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' A' ' 69' ' ' THR . 46.5 mt-10 -102.34 156.69 17.42 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.373 -0.83 . . . . 0.0 110.26 -179.121 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.3 p -127.56 136.32 60.8 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.449 ' O ' ' CB ' ' A' ' 74' ' ' LYS . 20.1 t -129.44 117.53 42.98 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.101 0 CA-C-O 121.972 0.891 . . . . 0.0 109.921 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.449 ' CB ' ' O ' ' A' ' 73' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.497 1.884 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.427 ' O ' ' O ' ' A' ' 50' ' ' SER . 32.9 ttp180 . . . . . 0 N--CA 1.496 1.849 0 CA-C-O 121.43 0.634 . . . . 0.0 110.286 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.427 ' O ' ' O ' ' A' ' 49' ' ' ARG . 11.9 m 53.45 171.36 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.338 -0.851 . . . . 0.0 110.206 179.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.448 ' SG ' ' N ' ' A' ' 52' ' ' SER . 6.2 p -58.88 -62.05 2.17 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.387 -0.821 . . . . 0.0 109.165 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.448 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 9.0 t -49.27 146.05 4.02 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.077 -1.015 . . . . 0.0 108.764 179.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -84.1 102.02 12.24 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 120.999 -1.063 . . . . 0.0 109.689 -179.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.603 HG13 ' O ' ' A' ' 54' ' ' VAL . 13.6 p -125.82 117.12 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 CA-C-O 121.576 0.703 . . . . 0.0 109.107 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 7.3 tp -128.36 138.4 54.75 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 49.0 m -128.07 113.31 15.62 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.35 -0.844 . . . . 0.0 109.518 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.54 ' H ' ' HB ' ' A' ' 69' ' ' THR . 5.5 mtmm -125.14 116.26 21.76 Favored 'General case' 0 N--CA 1.511 2.61 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 178.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.4 t -116.81 141.29 48.4 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.395 -0.816 . . . . 0.0 109.92 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.493 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.8 m -132.31 120.8 44.29 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.16 0 O-C-N 121.554 -0.716 . . . . 0.0 109.311 179.067 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 32.0 p -110.16 133.36 53.3 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.836 -0.54 . . . . 0.0 109.841 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.429 ' OD1' ' N ' ' A' ' 62' ' ' ALA . 16.2 t-20 -137.55 172.18 13.36 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.367 -0.833 . . . . 0.0 109.734 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.429 ' N ' ' OD1' ' A' ' 61' ' ' ASN . . . -63.32 -39.96 96.0 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.85 -1.156 . . . . 0.0 112.621 -177.357 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 35.9 m-20 -68.8 6.04 0.97 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.445 -1.409 . . . . 0.0 109.929 -178.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.519 ' O ' ' N ' ' A' ' 66' ' ' THR . . . 89.22 8.69 68.28 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.865 -1.294 . . . . 0.0 109.865 179.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.418 ' O ' ' O ' ' A' ' 59' ' ' VAL . 12.8 tpt180 -64.09 79.94 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.35 0 O-C-N 120.728 -1.454 . . . . 0.0 108.139 179.306 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.519 ' N ' ' O ' ' A' ' 64' ' ' GLY . 72.9 p -112.2 72.32 0.77 Allowed 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 -179.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -94.79 128.33 41.43 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.341 -0.85 . . . . 0.0 109.775 -179.013 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.525 ' C ' ' H ' ' A' ' 70' ' ' LYS . 31.3 p -100.01 109.8 22.12 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.323 -0.861 . . . . 0.0 109.675 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.54 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 5.3 m -78.7 36.39 0.26 Allowed 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 178.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.525 ' H ' ' C ' ' A' ' 68' ' ' THR . 40.7 pttt -65.07 62.65 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 179.098 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.531 ' N ' ' O ' ' A' ' 69' ' ' THR . 45.8 mt-10 -85.36 139.91 31.19 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.097 -1.002 . . . . 0.0 110.07 -179.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.549 ' O ' HG23 ' A' ' 72' ' ' VAL . 16.2 m -128.41 124.14 61.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 21.6 t -126.04 117.41 48.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 CA-C-O 122.16 0.981 . . . . 0.0 109.077 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 96.1 mttt . . . . . 0 C--N 1.29 -2.001 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.545 179.943 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 . . . . . 0 N--CA 1.496 1.842 0 CA-C-O 121.232 0.539 . . . . 0.0 109.654 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.2 m 67.86 169.78 0.27 Allowed 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.472 -0.767 . . . . 0.0 110.194 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.444 ' O ' ' O ' ' A' ' 52' ' ' SER . 1.6 m -56.91 -65.15 0.66 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.267 -0.895 . . . . 0.0 109.431 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.553 ' OG ' ' N ' ' A' ' 53' ' ' LYS . 12.7 t -58.64 -157.37 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.553 ' N ' ' OG ' ' A' ' 52' ' ' SER . 89.2 tttt -122.42 100.47 6.96 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.145 -0.972 . . . . 0.0 108.612 179.02 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.588 HG13 ' O ' ' A' ' 54' ' ' VAL . 11.3 p -126.65 120.37 55.92 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.709 -0.619 . . . . 0.0 109.58 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 2.3 pt -126.4 134.15 67.06 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.53 -0.731 . . . . 0.0 109.037 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 46.8 p -132.42 114.51 14.43 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.404 -0.81 . . . . 0.0 109.384 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.569 ' H ' ' HB ' ' A' ' 69' ' ' THR . 22.1 mttt -121.47 113.06 19.3 Favored 'General case' 0 N--CA 1.513 2.686 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 29.7 p -119.76 138.29 53.42 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.638 -0.664 . . . . 0.0 109.934 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.403 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.9 m -131.47 125.69 56.93 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.135 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 48.7 p -107.77 110.39 22.19 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.7 -0.625 . . . . 0.0 110.373 -179.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.44 ' N ' ' ND2' ' A' ' 61' ' ' ASN . 1.0 OUTLIER -100.24 144.08 29.68 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.354 -0.841 . . . . 0.0 108.769 179.395 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.445 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -67.03 -32.64 73.99 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 120.047 -1.658 . . . . 0.0 112.908 -177.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -65.74 4.28 0.63 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.291 -1.505 . . . . 0.0 110.006 -178.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.445 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 95.64 6.47 59.56 Favored Glycine 0 N--CA 1.496 2.693 0 N-CA-C 110.778 -0.929 . . . . 0.0 110.778 178.405 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 60.1 ttt180 -92.94 112.31 24.23 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.677 -1.484 . . . . 0.0 107.794 178.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.5 p -138.73 113.89 9.44 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.227 -0.921 . . . . 0.0 109.769 -178.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -99.83 130.23 46.0 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.319 -0.863 . . . . 0.0 109.993 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -107.07 108.93 20.66 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.586 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.569 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 4.5 m -96.31 28.7 3.14 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 107.531 -1.285 . . . . 0.0 107.531 179.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.1 pttp -64.81 67.74 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.515 ' N ' ' O ' ' A' ' 69' ' ' THR . 50.8 mt-10 -104.26 157.09 17.37 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.312 -0.868 . . . . 0.0 110.046 -179.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.468 ' O ' HG13 ' A' ' 72' ' ' VAL . 7.4 p -128.16 125.42 64.34 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.437 ' O ' ' O ' ' A' ' 53' ' ' LYS . 79.0 t -107.19 135.44 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 CA-C-O 121.922 0.868 . . . . 0.0 109.434 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 65.1 tttt . . . . . 0 N--CA 1.505 2.301 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.399 179.918 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 . . . . . 0 N--CA 1.493 1.715 0 CA-C-O 121.339 0.59 . . . . 0.0 109.831 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.3 m 57.97 174.22 0.06 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.364 -0.835 . . . . 0.0 109.969 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 39.1 t -59.53 -75.4 0.06 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.347 -0.845 . . . . 0.0 109.511 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 3.0 t -47.17 141.12 4.66 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.204 -0.935 . . . . 0.0 109.191 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -73.92 103.51 4.46 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 120.998 -1.064 . . . . 0.0 109.599 -179.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.596 HG13 ' O ' ' A' ' 54' ' ' VAL . 10.7 p -126.57 118.08 49.99 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.776 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.545 HG23 ' O ' ' A' ' 55' ' ' ILE . 6.6 tt -126.99 122.45 60.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.531 -0.731 . . . . 0.0 109.125 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 17.9 m -129.21 111.86 13.33 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.437 -0.789 . . . . 0.0 109.671 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.526 ' H ' ' HB ' ' A' ' 69' ' ' THR . 31.1 mmtt -126.03 113.35 17.0 Favored 'General case' 0 N--CA 1.515 2.775 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 178.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 96.6 m -110.3 125.03 52.72 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.533 -0.729 . . . . 0.0 109.489 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.4 m -132.49 119.98 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.3 m -109.52 133.68 52.8 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.713 -0.617 . . . . 0.0 109.842 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -125.24 159.01 32.65 Favored 'General case' 0 N--CA 1.516 2.861 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.88 -33.96 68.78 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 120.538 -1.351 . . . . 0.0 112.477 -177.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.508 ' OD2' ' NH2' ' A' ' 65' ' ' ARG . 11.6 p30 -70.69 2.34 4.25 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.445 -1.409 . . . . 0.0 110.411 -178.417 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 98.32 1.07 58.09 Favored Glycine 0 N--CA 1.494 2.525 0 N-CA-C 109.629 -1.388 . . . . 0.0 109.629 179.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.508 ' NH2' ' OD2' ' A' ' 63' ' ' ASP . 1.3 mpp_? -76.8 85.55 3.4 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 178.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 93.4 m -122.18 93.35 3.96 Favored 'General case' 0 N--CA 1.492 1.665 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 -178.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -100.0 129.78 46.1 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.427 -0.796 . . . . 0.0 109.909 -179.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 40.1 p -106.04 109.76 21.81 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.413 -0.804 . . . . 0.0 109.609 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.526 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 3.5 m -88.95 30.5 0.93 Allowed 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 178.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.404 ' NZ ' ' CB ' ' A' ' 70' ' ' LYS . 0.3 OUTLIER -66.75 58.12 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 109.02 -0.734 . . . . 0.0 109.02 179.623 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.501 ' N ' ' O ' ' A' ' 69' ' ' THR . 79.8 mt-10 -101.07 141.45 33.94 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.221 -0.925 . . . . 0.0 109.833 -179.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.404 HG13 ' O ' ' A' ' 72' ' ' VAL . 7.7 p -128.17 131.53 69.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 15.7 t -129.87 116.05 36.13 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.942 0 CA-C-O 122.146 0.974 . . . . 0.0 109.418 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.288 -2.067 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.42 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.435 ' O ' ' O ' ' A' ' 50' ' ' SER . 44.6 ttm180 . . . . . 0 N--CA 1.494 1.729 0 CA-C-O 121.261 0.553 . . . . 0.0 109.599 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.435 ' O ' ' O ' ' A' ' 49' ' ' ARG . 73.3 m -45.98 -94.48 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.337 -0.852 . . . . 0.0 109.876 -179.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 1.9 t -58.28 162.51 3.55 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.247 -0.908 . . . . 0.0 109.315 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 4.5 p 61.82 152.4 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.25 -0.906 . . . . 0.0 109.492 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -95.71 112.33 24.07 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.323 -0.861 . . . . 0.0 109.08 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 96.6 t -126.94 116.4 44.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.489 -0.757 . . . . 0.0 109.358 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.496 ' O ' HD12 ' A' ' 55' ' ' ILE . 2.4 pp -127.81 121.64 56.98 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 67.9 p -130.74 112.61 13.23 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.355 -0.84 . . . . 0.0 109.625 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.5 ' H ' ' HB ' ' A' ' 69' ' ' THR . 0.7 OUTLIER -123.38 111.51 16.45 Favored 'General case' 0 N--CA 1.51 2.549 0 N-CA-C 108.72 -0.845 . . . . 0.0 108.72 178.791 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 70.4 p -120.63 126.13 49.49 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.604 -0.685 . . . . 0.0 109.198 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.538 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.8 m -131.71 118.68 39.49 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.214 0 O-C-N 121.399 -0.813 . . . . 0.0 109.476 179.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 69.3 p -113.48 135.72 53.58 Favored 'General case' 0 N--CA 1.499 1.979 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.647 ' ND2' ' H ' ' A' ' 62' ' ' ALA . 4.5 t-20 -164.52 165.05 21.61 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.651 -1.281 . . . . 0.0 110.25 179.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.647 ' H ' ' ND2' ' A' ' 61' ' ' ASN . . . -74.81 -11.42 60.14 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 120.97 -1.081 . . . . 0.0 111.189 -179.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -74.71 8.95 2.05 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.122 -0.986 . . . . 0.0 109.591 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.42 10.08 84.0 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 108.9 -1.68 . . . . 0.0 108.9 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -91.7 97.2 10.87 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.059 -1.259 . . . . 0.0 108.705 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 48.4 p -129.79 66.12 1.48 Allowed 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 107.659 -1.238 . . . . 0.0 107.659 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -94.15 122.04 36.27 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.688 0.756 . . . . 0.0 111.195 -177.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.2 p -101.29 111.55 23.8 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 178.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.515 ' O ' ' N ' ' A' ' 71' ' ' GLU . 4.3 m -112.97 25.62 11.24 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 179.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 26.9 pttt -66.2 68.76 0.05 Allowed 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 179.179 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.515 ' N ' ' O ' ' A' ' 69' ' ' THR . 43.8 mm-40 -105.41 149.92 25.71 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.423 -0.798 . . . . 0.0 109.696 -179.455 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 24.1 m -127.43 142.99 42.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 16.5 t -128.62 119.84 51.07 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 CA-C-O 121.945 0.879 . . . . 0.0 109.012 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 62.6 tttp . . . . . 0 C--N 1.291 -1.974 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.523 -179.996 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.1 mmm180 . . . . . 0 N--CA 1.494 1.768 0 CA-C-O 121.282 0.563 . . . . 0.0 109.709 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.445 ' O ' ' O ' ' A' ' 51' ' ' CYS . 41.7 t -67.02 -67.82 0.42 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.222 -0.924 . . . . 0.0 109.668 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.445 ' O ' ' O ' ' A' ' 50' ' ' SER . 41.7 t -47.73 -93.39 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.157 -0.964 . . . . 0.0 109.235 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 48.7 m -55.47 149.79 12.9 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 22.9 tptp -95.56 100.4 12.14 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 120.959 -1.088 . . . . 0.0 108.438 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 41.2 t -128.45 116.2 40.83 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.647 -0.658 . . . . 0.0 109.562 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.519 HG23 ' O ' ' A' ' 55' ' ' ILE . 17.0 tt -127.89 124.92 63.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 179.545 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.6 m -128.19 111.65 13.67 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.365 -0.835 . . . . 0.0 109.488 -179.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.525 ' H ' ' HB ' ' A' ' 69' ' ' THR . 10.0 mtmt -124.3 114.42 19.54 Favored 'General case' 0 N--CA 1.512 2.652 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 178.203 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.9 p -118.96 126.63 52.2 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.433 -0.792 . . . . 0.0 109.752 -179.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.6 m -132.35 122.93 49.12 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.13 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 178.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.539 ' O ' HG23 ' A' ' 60' ' ' THR . 7.9 t -107.57 120.17 41.46 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.561 -0.712 . . . . 0.0 109.98 -179.43 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.462 ' ND2' ' O ' ' A' ' 65' ' ' ARG . 2.5 m-20 -111.82 145.45 39.41 Favored 'General case' 0 N--CA 1.51 2.553 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.418 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -69.96 -30.26 67.58 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 120.07 -1.644 . . . . 0.0 112.737 -177.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 11.5 p30 -67.07 3.99 1.0 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.249 -1.532 . . . . 0.0 109.863 -178.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.418 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 96.83 5.6 58.51 Favored Glycine 0 N--CA 1.496 2.654 0 N-CA-C 110.664 -0.974 . . . . 0.0 110.664 178.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.462 ' O ' ' ND2' ' A' ' 61' ' ' ASN . 11.7 mpt_? -91.68 104.82 17.24 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.568 -1.548 . . . . 0.0 108.043 178.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 28.7 p -130.1 104.53 7.38 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.536 -0.728 . . . . 0.0 109.128 -179.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -94.58 127.61 40.63 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.154 -0.966 . . . . 0.0 109.979 -179.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.409 HG22 ' H ' ' A' ' 70' ' ' LYS . 73.3 m -108.68 108.37 19.2 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.546 -0.721 . . . . 0.0 109.286 179.571 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.525 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 5.8 m -102.08 27.14 6.86 Favored 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 178.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.409 ' H ' HG22 ' A' ' 68' ' ' THR . 86.7 tttt -70.09 69.04 0.33 Allowed 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -106.26 143.98 33.61 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.552 -0.718 . . . . 0.0 109.275 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 43.1 t -128.11 129.19 69.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 179.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 17.2 t -130.12 116.93 38.76 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 CA-C-O 122.072 0.939 . . . . 0.0 108.95 179.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 58.1 mttp . . . . . 0 C--N 1.287 -2.109 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.614 -179.901 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.574 HH11 ' CG ' ' A' ' 49' ' ' ARG . 0.4 OUTLIER . . . . . 0 N--CA 1.5 2.055 0 CA-C-O 121.316 0.579 . . . . 0.0 109.995 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.446 ' O ' ' O ' ' A' ' 51' ' ' CYS . 31.0 m -70.45 -55.67 8.46 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.261 -0.899 . . . . 0.0 110.217 -179.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.446 ' O ' ' O ' ' A' ' 50' ' ' SER . 45.8 t -56.69 -107.88 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.214 -0.929 . . . . 0.0 109.346 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.3 t -51.06 165.89 0.11 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.867 -1.146 . . . . 0.0 108.469 179.476 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 16.4 mmmt -107.53 99.68 9.16 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.268 -0.895 . . . . 0.0 109.524 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.611 HG13 ' O ' ' A' ' 54' ' ' VAL . 9.6 p -129.28 115.79 37.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 179.301 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.9 mm -127.11 118.43 50.16 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.0 m -129.4 112.41 13.79 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.424 -0.797 . . . . 0.0 109.068 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.54 ' N ' ' OG1' ' A' ' 69' ' ' THR . 17.3 mttp -123.1 113.39 18.93 Favored 'General case' 0 N--CA 1.514 2.759 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 178.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 58.1 m -114.84 127.05 55.49 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.469 -0.769 . . . . 0.0 109.521 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.432 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.8 m -131.56 123.84 53.17 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.144 0 O-C-N 121.486 -0.759 . . . . 0.0 109.051 179.081 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 73.2 p -108.37 120.61 42.9 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.703 -0.623 . . . . 0.0 110.006 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.545 ' N ' ' OD1' ' A' ' 61' ' ' ASN . 0.7 OUTLIER -108.53 144.16 36.56 Favored 'General case' 0 N--CA 1.512 2.675 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.692 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.426 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -66.66 -31.08 71.52 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 119.949 -1.719 . . . . 0.0 112.474 -177.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.433 ' OD1' ' N ' ' A' ' 63' ' ' ASP . 16.1 p-10 -66.96 3.58 1.06 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.295 -1.503 . . . . 0.0 109.798 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.426 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 94.61 5.34 61.61 Favored Glycine 0 N--CA 1.497 2.719 0 N-CA-C 110.586 -1.006 . . . . 0.0 110.586 178.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.429 ' O ' ' OD1' ' A' ' 61' ' ' ASN . 63.0 ttt180 -92.3 109.5 20.88 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.608 -1.525 . . . . 0.0 108.086 178.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 17.6 p -134.19 112.5 11.15 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.31 -0.869 . . . . 0.0 109.48 -179.307 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -94.35 130.9 40.48 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.326 -0.859 . . . . 0.0 109.827 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.494 ' O ' ' CG2' ' A' ' 68' ' ' THR . 1.1 t -111.52 110.33 20.7 Favored 'General case' 0 N--CA 1.5 2.052 0 CA-C-O 122.013 0.911 . . . . 0.0 109.525 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.54 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 68.4 p -110.68 28.65 8.47 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 179.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.47 ' HB2' ' HZ3' ' A' ' 70' ' ' LYS . 18.4 mtmm -65.68 63.28 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.583 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.527 ' N ' ' O ' ' A' ' 69' ' ' THR . 56.5 mt-10 -102.23 140.83 35.99 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.447 -0.783 . . . . 0.0 109.502 -179.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.407 ' O ' HG23 ' A' ' 72' ' ' VAL . 17.9 m -127.78 136.29 60.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 179.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 13.2 t -129.79 116.51 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 CA-C-O 121.863 0.839 . . . . 0.0 109.077 179.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 96.1 mttt . . . . . 0 C--N 1.287 -2.115 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 -179.977 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 . . . . . 0 N--CA 1.502 2.153 0 CA-C-O 121.196 0.522 . . . . 0.0 109.721 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.444 ' O ' ' O ' ' A' ' 51' ' ' CYS . 50.7 m -63.55 -52.66 60.15 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.215 -0.928 . . . . 0.0 109.862 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.444 ' O ' ' O ' ' A' ' 50' ' ' SER . 36.8 t -48.01 -93.85 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.147 -0.971 . . . . 0.0 109.187 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 11.3 t -63.09 138.29 58.51 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.053 -1.029 . . . . 0.0 108.369 179.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -73.06 104.81 4.27 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 120.918 -1.114 . . . . 0.0 109.543 -179.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 21.1 t -125.12 116.19 46.28 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 41.5 mm -126.64 121.6 58.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 22.8 m -128.17 110.59 12.58 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.445 -0.784 . . . . 0.0 109.193 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.528 ' H ' ' HB ' ' A' ' 69' ' ' THR . 7.3 mtmt -124.9 113.91 18.48 Favored 'General case' 0 N--CA 1.511 2.624 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 178.435 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 59.0 p -114.31 132.43 56.18 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.551 -0.718 . . . . 0.0 109.776 -179.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.445 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.8 m -131.58 122.79 50.98 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.156 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 65.2 p -107.41 122.96 47.66 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.731 -0.605 . . . . 0.0 110.015 -179.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.444 ' ND2' ' O ' ' A' ' 65' ' ' ARG . 3.4 m-20 -113.2 145.16 41.46 Favored 'General case' 0 N--CA 1.511 2.61 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 179.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.59 -28.33 64.78 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 119.956 -1.715 . . . . 0.0 112.319 -177.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -67.33 2.38 1.7 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.536 -1.353 . . . . 0.0 109.827 -178.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.25 7.27 58.4 Favored Glycine 0 N--CA 1.496 2.681 0 N-CA-C 110.519 -1.032 . . . . 0.0 110.519 178.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.444 ' O ' ' ND2' ' A' ' 61' ' ' ASN . 16.0 mmm180 -95.98 109.46 21.84 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.876 -1.367 . . . . 0.0 108.344 179.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.7 p -134.67 109.24 8.49 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.347 -0.846 . . . . 0.0 109.336 -179.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -96.8 132.02 42.94 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.28 -0.887 . . . . 0.0 110.221 -179.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.522 HG22 ' H ' ' A' ' 70' ' ' LYS . 81.1 m -108.82 107.25 17.6 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.468 -0.77 . . . . 0.0 109.495 179.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.528 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 6.3 m -94.31 32.29 1.57 Allowed 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 178.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.522 ' H ' HG22 ' A' ' 68' ' ' THR . 55.0 tttm -73.54 68.83 1.19 Allowed 'General case' 0 N--CA 1.504 2.249 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.276 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -107.5 147.44 30.5 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.529 -0.732 . . . . 0.0 109.598 -179.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 38.6 t -128.08 125.99 65.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 20.5 t -128.19 116.06 40.81 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 CA-C-O 122.238 1.018 . . . . 0.0 109.351 179.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 1.1 ptpp? . . . . . 0 C--N 1.287 -2.115 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.593 -179.86 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.568 HH11 ' CG ' ' A' ' 49' ' ' ARG . 3.6 mtt-85 . . . . . 0 N--CA 1.495 1.8 0 CA-C-O 121.336 0.589 . . . . 0.0 109.806 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.4 m 54.42 175.42 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.286 -0.884 . . . . 0.0 110.151 179.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 32.3 t -62.35 -73.27 0.11 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.375 -0.828 . . . . 0.0 109.398 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 76.6 p -47.59 144.66 3.04 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.207 -0.933 . . . . 0.0 108.912 179.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.415 ' O ' ' O ' ' A' ' 73' ' ' VAL . 24.9 mtpp -75.19 102.65 5.06 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 120.895 -1.128 . . . . 0.0 109.794 -178.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.578 HG13 ' O ' ' A' ' 54' ' ' VAL . 11.4 p -124.67 120.51 59.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.429 HG23 ' O ' ' A' ' 55' ' ' ILE . 15.8 tt -126.29 130.52 71.98 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 24.4 m -128.57 117.89 22.04 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.546 -0.721 . . . . 0.0 109.483 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.544 ' H ' ' HB ' ' A' ' 69' ' ' THR . 26.4 ttpt -126.52 114.33 17.98 Favored 'General case' 0 N--CA 1.519 3.015 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 177.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 54.7 m -119.13 137.51 53.54 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.547 -0.721 . . . . 0.0 109.902 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.49 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.8 m -132.25 120.79 44.4 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.78 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 33.9 p -109.66 133.5 53.04 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.739 -0.6 . . . . 0.0 109.555 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 18.2 t30 -134.65 169.59 17.08 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 121.352 -0.843 . . . . 0.0 109.424 179.463 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.13 -42.78 99.15 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.811 -1.18 . . . . 0.0 112.552 -177.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -68.8 2.65 2.41 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.393 -1.442 . . . . 0.0 110.457 -177.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.537 ' O ' ' N ' ' A' ' 66' ' ' THR . . . 95.01 10.89 57.08 Favored Glycine 0 N--CA 1.494 2.511 0 N-CA-C 110.059 -1.217 . . . . 0.0 110.059 179.123 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.582 HH11 ' CG ' ' A' ' 65' ' ' ARG . 0.1 OUTLIER -64.34 78.64 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.42 0 O-C-N 120.785 -1.421 . . . . 0.0 107.926 179.133 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.537 ' N ' ' O ' ' A' ' 64' ' ' GLY . 71.0 p -109.68 75.85 0.96 Allowed 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 -179.209 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -93.3 115.89 28.46 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.439 -0.788 . . . . 0.0 109.097 -179.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.7 m -97.74 109.99 22.64 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.186 -0.946 . . . . 0.0 109.703 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.544 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 3.6 m -85.27 35.09 0.58 Allowed 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 178.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 40.4 pttt -64.45 61.53 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.536 ' N ' ' O ' ' A' ' 69' ' ' THR . 13.2 mm-40 -88.09 150.21 23.5 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.061 -1.025 . . . . 0.0 109.547 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 15.8 t -129.0 116.24 39.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.415 ' O ' ' O ' ' A' ' 53' ' ' LYS . 98.7 t -109.71 129.82 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 CA-C-O 122.142 0.973 . . . . 0.0 109.151 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 21.9 pttp . . . . . 0 C--N 1.29 -2.018 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.527 179.974 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 . . . . . 0 N--CA 1.494 1.728 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.425 ' O ' ' O ' ' A' ' 51' ' ' CYS . 87.8 p -66.72 163.0 20.07 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.244 -0.91 . . . . 0.0 109.308 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.425 ' O ' ' O ' ' A' ' 50' ' ' SER . 4.3 t 62.3 139.17 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.324 -0.86 . . . . 0.0 109.395 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.435 ' OG ' ' N ' ' A' ' 53' ' ' LYS . 10.1 t 51.61 178.25 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.283 -0.886 . . . . 0.0 109.425 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.435 ' N ' ' OG ' ' A' ' 52' ' ' SER . 56.7 mttp -113.86 111.64 22.06 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.527 -0.733 . . . . 0.0 109.536 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 91.7 t -126.68 117.17 47.34 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.452 -0.78 . . . . 0.0 109.565 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 29.1 mm -111.3 116.04 51.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.945 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 179.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.6 m -129.27 113.49 15.07 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.423 -0.798 . . . . 0.0 109.593 -179.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.516 ' N ' ' OG1' ' A' ' 69' ' ' THR . 1.5 mtmm -122.73 111.64 16.96 Favored 'General case' 0 N--CA 1.511 2.587 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 178.294 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 63.4 m -119.36 135.37 54.75 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.477 -0.765 . . . . 0.0 109.446 -179.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.523 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.9 m -131.81 118.93 39.99 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.212 0 O-C-N 121.544 -0.722 . . . . 0.0 109.571 179.123 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 81.2 p -112.8 136.46 52.39 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 179.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.521 ' OD1' ' N ' ' A' ' 62' ' ' ALA . 7.0 t30 -163.91 163.88 23.49 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 120.586 -1.322 . . . . 0.0 110.095 179.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.521 ' N ' ' OD1' ' A' ' 61' ' ' ASN . . . -74.68 -10.45 59.54 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.013 -1.055 . . . . 0.0 110.898 -179.346 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.408 ' CB ' ' ND2' ' A' ' 61' ' ' ASN . 26.7 t70 -75.25 6.25 4.61 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.187 -0.946 . . . . 0.0 109.752 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.19 10.89 79.54 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 108.91 -1.676 . . . . 0.0 108.91 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -92.61 97.56 10.88 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.936 -1.332 . . . . 0.0 108.779 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 54.1 p -127.41 68.77 1.29 Allowed 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 179.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -94.24 129.46 40.86 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.523 -0.736 . . . . 0.0 111.053 -178.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -111.28 111.76 23.05 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 178.712 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.516 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 22.4 p -109.91 37.22 2.73 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 179.167 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 45.4 pttt -65.72 61.39 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.906 0 C-N-CA 120.252 -0.579 . . . . 0.0 109.46 179.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.514 ' N ' ' O ' ' A' ' 69' ' ' THR . 50.0 mt-10 -84.92 146.78 27.08 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.169 -0.957 . . . . 0.0 109.609 -179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 22.4 m -127.44 143.23 41.31 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 12.3 t -128.55 119.17 49.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.027 0 CA-C-O 122.029 0.918 . . . . 0.0 109.064 179.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 21.0 pttp . . . . . 0 C--N 1.291 -1.954 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.542 -179.869 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.428 ' O ' ' O ' ' A' ' 50' ' ' SER . 95.5 mtt180 . . . . . 0 N--CA 1.495 1.787 0 CA-C-O 121.233 0.54 . . . . 0.0 109.614 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.428 ' O ' ' O ' ' A' ' 49' ' ' ARG . 47.1 t -59.07 -156.65 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.234 -0.916 . . . . 0.0 109.494 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.429 ' O ' ' O ' ' A' ' 52' ' ' SER . 4.8 t 50.74 -118.24 1.2 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.101 -0.999 . . . . 0.0 108.716 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.491 ' OG ' ' N ' ' A' ' 53' ' ' LYS . 26.6 t -56.97 -167.11 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.502 0 O-C-N 120.712 -1.242 . . . . 0.0 108.966 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.491 ' N ' ' OG ' ' A' ' 52' ' ' SER . 50.5 mttp -126.4 103.65 7.75 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.326 -0.858 . . . . 0.0 109.45 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 51.0 t -127.66 116.15 42.28 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.569 -0.707 . . . . 0.0 109.192 179.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.473 HG23 ' O ' ' A' ' 55' ' ' ILE . 14.8 tt -128.66 125.25 63.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.564 -0.71 . . . . 0.0 109.415 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 81.0 p -127.85 113.33 15.78 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.402 -0.811 . . . . 0.0 109.323 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.505 ' H ' ' HB ' ' A' ' 69' ' ' THR . 41.7 tttm -127.59 113.64 16.36 Favored 'General case' 0 N--CA 1.519 3.022 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.314 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 91.5 m -108.94 125.22 51.79 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.496 -0.752 . . . . 0.0 109.436 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.5 m -132.56 119.92 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.178 0 O-C-N 121.45 -0.781 . . . . 0.0 109.071 178.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 60.8 m -109.65 134.44 51.96 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.753 -0.592 . . . . 0.0 109.655 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -127.19 162.29 26.51 Favored 'General case' 0 N--CA 1.516 2.85 0 O-C-N 121.385 -0.822 . . . . 0.0 109.347 179.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.44 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -71.59 -33.37 68.99 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.538 -1.351 . . . . 0.0 112.6 -177.531 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -69.48 7.26 0.85 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.453 -1.405 . . . . 0.0 109.813 -178.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.44 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 87.84 5.02 78.29 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.412 HH11 ' CG ' ' A' ' 65' ' ' ARG . 1.9 ttt-85 -81.15 96.55 7.24 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 120.705 -1.468 . . . . 0.0 107.865 178.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.6 p -122.08 94.89 4.45 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.607 -0.683 . . . . 0.0 109.196 -179.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -94.66 119.64 33.62 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.228 -0.92 . . . . 0.0 109.864 -179.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.487 ' OG1' ' NZ ' ' A' ' 70' ' ' LYS . 40.7 p -102.36 108.53 19.91 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.377 -0.827 . . . . 0.0 109.631 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.545 ' O ' ' N ' ' A' ' 71' ' ' GLU . 3.2 m -87.87 31.38 0.78 Allowed 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 178.693 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.487 ' NZ ' ' OG1' ' A' ' 68' ' ' THR . 22.0 pttm -65.13 56.7 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 179.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.545 ' N ' ' O ' ' A' ' 69' ' ' THR . 75.0 mt-10 -93.8 135.94 34.59 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.962 -1.086 . . . . 0.0 109.943 -179.621 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 47.8 t -128.03 129.17 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 179.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.422 ' O ' ' OG ' ' A' ' 52' ' ' SER . 16.6 t -128.61 116.2 40.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 CA-C-O 121.946 0.879 . . . . 0.0 109.236 179.677 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 45.9 mtmt . . . . . 0 C--N 1.289 -2.052 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 179.946 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 53.6 mtp180 . . . . . 0 N--CA 1.493 1.698 0 CA-C-O 121.374 0.607 . . . . 0.0 110.059 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.9 m 58.22 169.99 0.05 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.383 -0.823 . . . . 0.0 110.149 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.44 ' SG ' ' N ' ' A' ' 52' ' ' SER . 31.2 p -66.83 -38.08 85.74 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.436 -0.79 . . . . 0.0 109.397 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.527 ' OG ' ' N ' ' A' ' 53' ' ' LYS . 15.0 t -58.09 -161.36 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.371 -0.831 . . . . 0.0 108.984 179.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.527 ' N ' ' OG ' ' A' ' 52' ' ' SER . 36.1 ttpt -121.83 102.01 7.93 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.263 -0.898 . . . . 0.0 109.252 179.393 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 74.5 t -129.33 117.81 44.14 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.6 ' O ' HD12 ' A' ' 55' ' ' ILE . 1.0 OUTLIER -127.28 132.0 69.99 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 O-C-N 121.431 -0.793 . . . . 0.0 109.077 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 69.4 p -129.22 114.9 16.85 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.381 -0.824 . . . . 0.0 109.185 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.584 ' H ' ' HB ' ' A' ' 69' ' ' THR . 9.1 ttmm -127.19 113.99 17.08 Favored 'General case' 0 N--CA 1.52 3.056 0 N-CA-C 109.3 -0.629 . . . . 0.0 109.3 178.671 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 33.7 p -119.76 132.06 55.53 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.494 -0.754 . . . . 0.0 109.429 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.5 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.8 m -132.54 120.25 41.63 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.177 0 O-C-N 121.383 -0.823 . . . . 0.0 109.534 179.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 35.9 p -109.77 133.01 53.62 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.781 -0.574 . . . . 0.0 109.523 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -136.3 170.23 16.37 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.263 -0.898 . . . . 0.0 109.674 179.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.42 -40.78 98.1 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.88 -1.138 . . . . 0.0 112.766 -177.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.425 ' OD1' ' N ' ' A' ' 63' ' ' ASP . 18.6 p-10 -68.54 5.24 1.09 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.38 -1.45 . . . . 0.0 110.065 -178.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.528 ' O ' ' N ' ' A' ' 66' ' ' THR . . . 90.51 8.9 65.38 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.978 -1.249 . . . . 0.0 109.978 179.098 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 36.4 ttp180 -65.21 78.77 0.05 Allowed 'General case' 0 N--CA 1.486 1.343 0 O-C-N 120.689 -1.477 . . . . 0.0 107.915 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.528 ' N ' ' O ' ' A' ' 64' ' ' GLY . 70.3 p -110.03 77.65 1.07 Allowed 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 -179.356 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.0 tm-20 -92.78 119.81 32.52 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.418 -0.801 . . . . 0.0 109.214 -179.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 12.7 p -99.31 109.71 22.31 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.353 -0.842 . . . . 0.0 109.677 -179.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.584 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 4.2 m -97.02 25.41 5.41 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 107.173 -1.418 . . . . 0.0 107.173 178.561 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -65.76 70.13 0.05 Allowed 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 179.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.504 ' N ' ' O ' ' A' ' 69' ' ' THR . 81.2 mt-10 -110.13 155.04 22.46 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.538 -0.726 . . . . 0.0 110.043 -179.052 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.418 ' O ' HG23 ' A' ' 72' ' ' VAL . 21.9 m -127.78 134.85 64.54 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 179.251 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 16.4 t -128.91 116.32 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 CA-C-O 121.996 0.903 . . . . 0.0 109.382 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.4 ptmm? . . . . . 0 C--N 1.289 -2.023 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 179.852 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.467 ' N ' ' CD ' ' A' ' 49' ' ' ARG . 11.1 mpt_? . . . . . 0 N--CA 1.493 1.686 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.413 ' O ' ' O ' ' A' ' 51' ' ' CYS . 98.6 p -58.24 -62.48 1.8 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.292 -0.88 . . . . 0.0 109.663 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.415 ' SG ' ' N ' ' A' ' 52' ' ' SER . 36.8 t -50.81 -97.14 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.213 -0.929 . . . . 0.0 109.703 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.415 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 30.8 t -51.1 150.12 3.36 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.294 -0.879 . . . . 0.0 109.721 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -85.2 105.01 15.59 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.28 -0.888 . . . . 0.0 109.106 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 99.4 t -126.55 119.68 54.3 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.517 -0.739 . . . . 0.0 110.021 -179.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.453 HG23 ' O ' ' A' ' 55' ' ' ILE . 19.3 tt -127.13 128.74 70.73 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 179.204 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 48.7 p -130.42 120.71 24.64 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.247 -0.908 . . . . 0.0 110.357 -179.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.481 ' H ' ' HB ' ' A' ' 69' ' ' THR . 9.6 mttp -121.04 111.34 17.34 Favored 'General case' 0 N--CA 1.509 2.506 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 177.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 52.0 p -119.26 139.43 51.9 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.377 -0.827 . . . . 0.0 109.498 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.8 m -132.48 121.12 44.74 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 O-C-N 121.542 -0.724 . . . . 0.0 109.184 178.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -109.49 135.55 50.32 Favored 'General case' 0 N--CA 1.497 1.909 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 179.607 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.869 HD22 ' H ' ' A' ' 63' ' ' ASP . 0.2 OUTLIER -153.11 153.49 32.92 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 120.661 -1.274 . . . . 0.0 109.536 -179.814 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.733 ' N ' HD22 ' A' ' 61' ' ' ASN . . . -74.36 -11.9 60.38 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 120.498 -1.376 . . . . 0.0 112.091 -178.556 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.869 ' H ' HD22 ' A' ' 61' ' ' ASN . 11.7 p30 -74.32 2.19 9.87 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.043 -1.036 . . . . 0.0 109.743 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.78 11.16 62.24 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 36.9 ttm180 -96.08 99.09 10.88 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.011 -1.288 . . . . 0.0 109.123 179.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 68.4 p -125.8 83.4 2.16 Favored 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -94.99 129.76 41.92 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.348 -0.845 . . . . 0.0 111.065 -178.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.1 p -108.45 112.43 24.83 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 179.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.522 ' O ' ' N ' ' A' ' 71' ' ' GLU . 3.6 m -106.47 31.06 5.47 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 179.106 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.9 mttm -64.13 70.79 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 119.808 -0.757 . . . . 0.0 109.388 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.522 ' N ' ' O ' ' A' ' 69' ' ' THR . 51.7 mt-10 -89.55 140.18 29.8 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.242 -0.911 . . . . 0.0 109.274 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.409 ' O ' HG23 ' A' ' 72' ' ' VAL . 23.6 m -127.39 136.31 60.94 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 17.2 t -128.2 117.38 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.976 0 CA-C-O 122.186 0.993 . . . . 0.0 109.122 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 94.1 mttt . . . . . 0 C--N 1.291 -1.949 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.561 -179.963 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 11.3 tpp180 . . . . . 0 N--CA 1.497 1.885 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 89.3 p -60.28 -166.33 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.162 -0.961 . . . . 0.0 109.171 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 4.4 t 48.87 -125.67 1.99 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.104 -0.997 . . . . 0.0 109.048 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 25.0 t -50.18 132.08 23.75 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.802 -1.186 . . . . 0.0 109.059 179.517 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.443 ' O ' ' O ' ' A' ' 73' ' ' VAL . 59.3 tttm -76.9 105.3 7.88 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.86 -1.15 . . . . 0.0 109.558 -179.489 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 47.5 t -123.88 116.08 46.98 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 O-C-N 121.484 -0.76 . . . . 0.0 109.454 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 43.7 mm -122.91 115.97 47.39 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 75.4 p -128.6 111.6 13.39 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.328 -0.858 . . . . 0.0 109.243 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.498 ' N ' ' OG1' ' A' ' 69' ' ' THR . 7.3 mtmt -124.67 113.46 18.03 Favored 'General case' 0 N--CA 1.515 2.775 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 58.9 p -119.4 131.84 55.73 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.549 -0.719 . . . . 0.0 109.117 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.406 ' CG2' ' OE1' ' A' ' 67' ' ' GLU . 2.8 m -133.47 126.79 52.58 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.2 0 O-C-N 121.476 -0.765 . . . . 0.0 109.605 179.421 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.404 HG23 ' O ' ' A' ' 60' ' ' THR . 8.6 t -108.13 134.16 51.39 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.429 -0.795 . . . . 0.0 109.34 179.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -125.89 162.02 26.13 Favored 'General case' 0 N--CA 1.516 2.875 0 O-C-N 121.503 -0.748 . . . . 0.0 109.304 179.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.05 -36.4 66.88 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.648 -1.283 . . . . 0.0 111.895 -178.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -72.83 7.05 2.17 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.571 -1.33 . . . . 0.0 109.874 -179.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.19 7.49 83.1 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.334 -1.506 . . . . 0.0 109.334 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 18.0 tpt180 -82.8 109.32 16.84 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 120.949 -1.324 . . . . 0.0 107.818 178.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.9 p -140.42 151.42 44.9 Favored 'General case' 0 C--N 1.306 -1.301 0 O-C-N 121.217 -0.927 . . . . 0.0 108.678 -178.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.406 ' OE1' ' CG2' ' A' ' 59' ' ' VAL . 24.4 mp0 -131.43 117.43 18.84 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 179.428 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.8 p -100.89 105.97 17.28 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.189 -0.944 . . . . 0.0 110.16 -179.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.504 ' O ' ' N ' ' A' ' 71' ' ' GLU . 78.3 p -109.82 30.51 6.62 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 178.626 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.0 ptpt -66.74 66.0 0.06 Allowed 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 179.663 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.504 ' N ' ' O ' ' A' ' 69' ' ' THR . 63.2 mm-40 -108.17 151.59 25.71 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.425 -0.797 . . . . 0.0 110.147 -179.152 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.413 ' O ' HG23 ' A' ' 72' ' ' VAL . 12.7 m -127.97 135.11 63.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 179.368 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.443 ' O ' ' O ' ' A' ' 53' ' ' LYS . 16.4 t -129.34 115.64 36.22 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 CA-C-O 122.235 1.017 . . . . 0.0 109.625 179.662 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 45.5 mttp . . . . . 0 C--N 1.289 -2.027 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.428 179.806 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.4 mmt180 . . . . . 0 N--CA 1.5 2.059 0 CA-C-O 121.337 0.589 . . . . 0.0 109.839 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.464 ' O ' ' O ' ' A' ' 51' ' ' CYS . 18.7 m -71.53 -61.22 1.86 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.2 -0.937 . . . . 0.0 110.52 -179.444 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.587 ' SG ' ' N ' ' A' ' 52' ' ' SER . 32.5 t -56.23 -108.74 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.194 -0.942 . . . . 0.0 109.526 -179.542 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.587 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 62.0 m -52.57 113.91 1.21 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 120.944 -1.097 . . . . 0.0 108.2 179.35 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.436 ' O ' ' O ' ' A' ' 73' ' ' VAL . 18.0 tptm -74.2 100.83 3.79 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.75 -1.219 . . . . 0.0 109.553 -178.602 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.62 HG13 ' O ' ' A' ' 54' ' ' VAL . 8.3 p -128.55 116.12 40.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 179.421 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.599 ' O ' HD12 ' A' ' 55' ' ' ILE . 1.0 OUTLIER -127.97 130.87 69.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 179.841 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 16.6 m -128.56 111.96 13.8 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.378 -0.826 . . . . 0.0 108.896 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.532 ' H ' ' HB ' ' A' ' 69' ' ' THR . 14.9 mttm -124.19 113.37 18.22 Favored 'General case' 0 N--CA 1.511 2.583 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 178.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 71.6 p -113.04 134.73 54.39 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.49 -0.756 . . . . 0.0 109.742 -179.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.422 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.8 m -131.49 123.98 53.67 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.047 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 178.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 42.4 p -107.2 120.39 41.98 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.683 -0.635 . . . . 0.0 110.252 -179.026 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.461 ' OD1' ' N ' ' A' ' 61' ' ' ASN . 1.2 m-20 -107.62 143.97 35.33 Favored 'General case' 0 N--CA 1.51 2.544 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 179.209 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.434 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -69.51 -28.95 66.48 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 119.976 -1.702 . . . . 0.0 112.331 -177.645 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.456 ' OD1' ' N ' ' A' ' 63' ' ' ASP . 0.6 OUTLIER -67.36 4.19 1.06 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.527 -1.358 . . . . 0.0 109.75 -178.969 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.434 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 96.52 6.16 58.64 Favored Glycine 0 N--CA 1.497 2.706 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 178.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -92.39 110.49 21.89 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.725 -1.456 . . . . 0.0 107.857 179.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 23.8 p -135.16 102.92 5.35 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.418 -0.801 . . . . 0.0 109.32 -179.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -96.91 128.64 44.07 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.21 -0.931 . . . . 0.0 110.185 -179.144 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.525 ' OG1' ' NZ ' ' A' ' 70' ' ' LYS . 40.0 p -106.36 108.96 20.74 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.532 -0.73 . . . . 0.0 109.489 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.532 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 5.6 m -88.43 33.14 0.75 Allowed 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 179.005 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.525 ' NZ ' ' OG1' ' A' ' 68' ' ' THR . 21.0 pttm -66.14 60.99 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.286 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.499 ' N ' ' O ' ' A' ' 69' ' ' THR . 86.9 mt-10 -96.13 141.93 28.92 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 120.968 -1.083 . . . . 0.0 110.079 -179.37 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.561 ' O ' HG23 ' A' ' 72' ' ' VAL . 5.9 m -129.16 122.39 56.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 179.115 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.436 ' O ' ' O ' ' A' ' 53' ' ' LYS . 20.6 t -128.96 115.44 36.58 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.996 0 CA-C-O 122.323 1.058 . . . . 0.0 109.47 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 66.4 tttm . . . . . 0 C--N 1.287 -2.129 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.433 179.996 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 . . . . . 0 N--CA 1.499 2.024 0 CA-C-O 121.281 0.562 . . . . 0.0 109.754 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 68.7 m -66.16 -100.08 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.186 -0.946 . . . . 0.0 109.243 179.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 15.3 t -49.63 135.17 19.05 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.1 -1.0 . . . . 0.0 108.826 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.418 ' O ' ' OG ' ' A' ' 52' ' ' SER . 53.0 p 50.43 87.47 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.991 -1.068 . . . . 0.0 108.542 -179.158 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -75.48 104.05 5.87 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.228 -0.92 . . . . 0.0 109.824 -178.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.577 ' C ' HD12 ' A' ' 55' ' ' ILE . 7.1 p -111.43 114.08 46.07 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 O-C-N 121.526 -0.734 . . . . 0.0 109.569 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.602 ' N ' HD12 ' A' ' 55' ' ' ILE . 1.7 mp -107.82 119.93 58.28 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 179.209 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 5.9 m -129.8 113.9 15.26 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.495 -0.753 . . . . 0.0 109.684 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.521 ' N ' ' OG1' ' A' ' 69' ' ' THR . 21.2 mttt -121.99 112.48 18.33 Favored 'General case' 0 N--CA 1.509 2.519 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 178.175 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 44.1 p -118.8 134.76 54.92 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.445 -0.784 . . . . 0.0 109.754 -179.247 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.3 m -132.17 119.69 41.03 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 178.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 42.7 p -110.93 136.54 49.79 Favored 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.523 ' OD1' ' N ' ' A' ' 62' ' ' ALA . 16.5 t30 -161.59 153.37 19.17 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 120.641 -1.287 . . . . 0.0 109.84 179.331 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.523 ' N ' ' OD1' ' A' ' 61' ' ' ASN . . . -74.3 -8.95 58.01 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.707 -1.246 . . . . 0.0 110.536 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.412 ' HB2' HD21 ' A' ' 61' ' ' ASN . 29.2 t70 -72.95 -1.87 18.69 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.309 -0.869 . . . . 0.0 109.851 -179.732 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 95.67 9.48 57.51 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 108.891 -1.684 . . . . 0.0 108.891 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 47.7 mtp180 -99.82 89.21 4.01 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.196 -1.179 . . . . 0.0 108.404 179.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.8 m -125.28 72.76 1.26 Allowed 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 73.8 mt-10 -100.87 131.82 46.57 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.454 -0.779 . . . . 0.0 111.727 -177.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.6 m -108.19 112.39 24.87 Favored 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 178.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.521 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 22.4 p -104.25 37.85 2.0 Allowed 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 179.369 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.4 pttm -65.46 61.73 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.676 -0.64 . . . . 0.0 109.463 179.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.506 ' N ' ' O ' ' A' ' 69' ' ' THR . 55.9 mt-10 -82.09 147.56 29.03 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.064 -1.022 . . . . 0.0 109.821 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.426 ' O ' HG23 ' A' ' 72' ' ' VAL . 22.9 m -127.81 134.94 64.31 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.584 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 14.7 t -128.69 118.03 46.24 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 CA-C-O 122.217 1.008 . . . . 0.0 109.264 179.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 44.9 mtmt . . . . . 0 C--N 1.29 -2.007 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.512 -179.955 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 . . . . . 0 N--CA 1.497 1.879 0 CA-C-O 121.281 0.562 . . . . 0.0 109.818 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.4 m -64.54 176.75 1.03 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.215 -0.928 . . . . 0.0 109.507 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.425 ' O ' ' N ' ' A' ' 53' ' ' LYS . 64.6 m 46.84 -122.77 1.31 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.206 -0.934 . . . . 0.0 108.997 -179.724 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 43.5 t -51.87 99.81 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 178.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.425 ' N ' ' O ' ' A' ' 51' ' ' CYS . 93.7 mttt -77.87 101.43 6.79 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.11 -0.994 . . . . 0.0 110.318 -178.612 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.3 t -106.72 114.13 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.498 HG23 ' O ' ' A' ' 55' ' ' ILE . 9.4 tp -127.99 126.98 67.41 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.481 -0.762 . . . . 0.0 108.998 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.474 ' O ' ' CG2' ' A' ' 56' ' ' THR . 0.8 OUTLIER -128.88 117.91 21.81 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.515 -0.741 . . . . 0.0 109.341 179.839 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.513 ' H ' ' HB ' ' A' ' 69' ' ' THR . 26.5 ttmt -127.08 114.53 17.88 Favored 'General case' 0 N--CA 1.521 3.102 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 178.568 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.5 m -115.66 131.42 56.94 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.624 -0.673 . . . . 0.0 109.86 -179.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.494 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.9 m -132.12 119.86 41.78 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.141 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 43.8 p -110.17 134.0 52.65 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -179.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -137.36 172.83 12.4 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.311 -0.868 . . . . 0.0 109.752 179.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.27 -40.33 95.75 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 120.807 -1.183 . . . . 0.0 112.566 -177.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.486 ' OD1' ' N ' ' A' ' 63' ' ' ASP . 2.0 m-20 -69.01 4.37 1.58 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.378 -1.451 . . . . 0.0 110.04 -178.437 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.527 ' O ' ' N ' ' A' ' 66' ' ' THR . . . 91.82 8.92 63.13 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 110.041 -1.224 . . . . 0.0 110.041 179.308 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.441 ' O ' ' O ' ' A' ' 59' ' ' VAL . 23.6 ttm180 -63.94 79.5 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.43 0 O-C-N 120.717 -1.461 . . . . 0.0 108.193 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.527 ' N ' ' O ' ' A' ' 64' ' ' GLY . 73.3 p -111.56 72.58 0.78 Allowed 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 -179.716 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -94.27 130.66 40.45 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.369 -0.832 . . . . 0.0 109.936 -178.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.41 ' C ' ' H ' ' A' ' 70' ' ' LYS . 4.0 m -108.55 109.53 20.79 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.49 -0.756 . . . . 0.0 109.656 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.528 ' O ' ' N ' ' A' ' 71' ' ' GLU . 3.8 m -82.29 39.63 0.6 Allowed 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.087 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.41 ' H ' ' C ' ' A' ' 68' ' ' THR . 13.3 ptpt -65.71 55.27 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.073 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.528 ' N ' ' O ' ' A' ' 69' ' ' THR . 54.2 mt-10 -89.28 131.97 35.12 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.091 -1.005 . . . . 0.0 109.983 -179.441 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.4 p -128.3 136.81 59.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 17.5 t -127.95 117.29 45.61 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 CA-C-O 122.012 0.911 . . . . 0.0 109.283 179.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt . . . . . 0 C--N 1.292 -1.916 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 -179.884 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 mmt . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 121.304 0.574 . . . . 0.0 109.49 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 65.69 118.17 0.01 OUTLIER Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.481 -1.448 . . . . 0.0 109.481 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.448 ' O ' ' N ' ' A' ' 5' ' ' ARG . 62.0 p -76.16 -36.51 58.7 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.285 -1.126 . . . . 0.0 109.424 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 50.93 -94.49 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.2 -0.937 . . . . 0.0 109.595 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.586 ' CG ' HH11 ' A' ' 5' ' ' ARG . 3.7 mtt-85 -149.69 19.62 0.91 Allowed 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.3 -0.875 . . . . 0.0 109.364 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.428 ' OE2' ' N ' ' A' ' 7' ' ' GLU . 3.4 tm-20 -61.55 132.7 54.18 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.316 -0.865 . . . . 0.0 109.248 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.428 ' N ' ' OE2' ' A' ' 6' ' ' GLU . 36.4 mt-10 -152.87 -25.34 0.16 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.253 -0.905 . . . . 0.0 109.382 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -178.85 -58.0 0.07 OUTLIER Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.505 ' O ' ' N ' ' A' ' 11' ' ' SER . 47.2 t -169.81 57.03 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.291 -1.123 . . . . 0.0 109.506 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.408 HG22 ' H ' ' A' ' 10' ' ' VAL . 4.3 m -65.17 69.47 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.271 -0.893 . . . . 0.0 109.525 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.505 ' N ' ' O ' ' A' ' 9' ' ' SER . 90.2 p -159.25 -161.37 0.93 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.352 -0.842 . . . . 0.0 109.414 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.5 m -159.53 154.94 25.54 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.216 -0.927 . . . . 0.0 109.515 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 64.75 148.81 0.05 OUTLIER Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 73.4 p -53.94 -21.74 8.64 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.216 -1.167 . . . . 0.0 109.381 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 19.1 tptp -167.82 124.08 1.08 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.26 -0.9 . . . . 0.0 109.382 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -59.6 112.51 1.82 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.254 -0.904 . . . . 0.0 109.444 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.519 ' O ' ' CG ' ' A' ' 18' ' ' PHE . 84.3 mt-10 -70.69 -38.93 73.76 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.325 -0.859 . . . . 0.0 109.477 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.519 ' CG ' ' O ' ' A' ' 17' ' ' GLU . 90.0 m-85 -157.27 47.88 0.42 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.283 -0.886 . . . . 0.0 109.426 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 13.7 m170 53.82 177.69 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.212 -0.93 . . . . 0.0 109.451 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.6 t -54.53 161.53 1.42 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.238 -0.914 . . . . 0.0 109.403 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -174.15 27.62 0.08 OUTLIER Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 18.2 tptm -163.26 127.81 2.96 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.245 -1.15 . . . . 0.0 109.453 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 18.4 mt -86.68 -62.82 1.42 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.248 -0.908 . . . . 0.0 109.581 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.2 t -109.81 119.07 58.25 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.483 -0.76 . . . . 0.0 109.449 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 78.1 p -84.24 -24.32 30.04 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.222 -0.924 . . . . 0.0 109.491 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.447 ' OG1' ' N ' ' A' ' 27' ' ' LYS . 63.4 p -63.32 -100.13 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.236 -0.915 . . . . 0.0 109.521 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.447 ' N ' ' OG1' ' A' ' 26' ' ' THR . 15.7 ptpt -55.64 168.57 0.4 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.295 -0.878 . . . . 0.0 109.515 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 160.96 1.92 0.06 OUTLIER Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.446 -1.461 . . . . 0.0 109.446 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.468 ' N ' ' OD1' ' A' ' 29' ' ' ASP . 25.9 p-10 -63.06 131.16 47.66 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.216 -1.167 . . . . 0.0 109.379 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -153.11 6.8 0.38 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.2 -0.937 . . . . 0.0 109.293 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -172.85 4.38 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.333 -0.854 . . . . 0.0 109.417 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.504 HD23 ' O ' ' A' ' 32' ' ' LEU . 0.8 OUTLIER -69.25 -14.14 62.79 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.261 -0.9 . . . . 0.0 108.951 -179.921 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 14.6 mt -68.58 6.63 0.78 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.172 -0.955 . . . . 0.0 109.442 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.447 ' H ' ' C ' ' A' ' 32' ' ' LEU . 17.1 tt -48.39 153.5 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.193 -0.942 . . . . 0.0 109.563 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.97 120.37 11.25 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.256 -0.903 . . . . 0.0 109.475 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -78.59 -52.2 8.81 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.274 -0.891 . . . . 0.0 109.515 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.632 ' CD ' ' H ' ' A' ' 37' ' ' GLU . 1.5 pm0 -62.02 -27.46 68.89 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.281 -0.887 . . . . 0.0 109.542 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.409 ' O ' ' O ' ' A' ' 37' ' ' GLU . 68.1 mttm 53.23 174.28 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.307 -0.87 . . . . 0.0 109.514 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.427 HG22 ' H ' ' A' ' 39' ' ' VAL . 2.9 m -74.45 79.12 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.259 -0.9 . . . . 0.0 109.555 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 4.5 m -160.77 -126.52 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.222 -0.924 . . . . 0.0 109.315 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 37.3 t -56.07 128.07 33.63 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.178 -0.951 . . . . 0.0 109.47 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.512 ' O ' ' CG ' ' A' ' 43' ' ' HIS . . . -179.35 94.15 0.09 OUTLIER Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.512 ' CG ' ' O ' ' A' ' 42' ' ' GLY . 78.2 m80 -157.76 167.27 30.51 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.357 -1.084 . . . . 0.0 109.376 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 67.5 p -84.29 154.48 22.93 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.109 -0.994 . . . . 0.0 109.438 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 79.2 p -147.34 -45.43 0.17 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.188 -0.945 . . . . 0.0 109.397 -179.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.8 p -65.8 -34.18 77.58 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.337 -0.852 . . . . 0.0 109.429 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 31.9 m -72.49 -57.52 4.1 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.307 -0.871 . . . . 0.0 109.445 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 32.5 ptt180 -145.84 143.46 29.65 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.248 -0.907 . . . . 0.0 109.364 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.58 ' CG ' HH11 ' A' ' 49' ' ' ARG . 0.3 OUTLIER -94.08 127.48 39.91 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.288 -0.882 . . . . 0.0 109.585 180.0 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.438 ' O ' ' O ' ' A' ' 49' ' ' ARG . 95.9 p -59.82 -150.69 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.341 -0.85 . . . . 0.0 109.621 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.57 ' SG ' ' N ' ' A' ' 52' ' ' SER . 10.3 t 50.84 -100.69 0.09 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.076 -1.015 . . . . 0.0 109.15 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.57 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 16.3 t -71.81 -165.35 0.16 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.223 -0.923 . . . . 0.0 108.967 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.516 ' N ' ' OG ' ' A' ' 52' ' ' SER . 19.4 tptm -120.87 106.17 11.39 Favored 'General case' 0 N--CA 1.498 1.969 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 9.9 t -125.99 117.82 49.99 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.522 -0.736 . . . . 0.0 109.541 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.478 HG23 ' O ' ' A' ' 55' ' ' ILE . 12.1 tt -122.77 119.64 58.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.488 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 71.1 p -131.61 113.46 13.64 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.536 -0.728 . . . . 0.0 109.157 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.551 ' N ' ' OG1' ' A' ' 69' ' ' THR . 11.9 mtpt -121.85 112.73 18.71 Favored 'General case' 0 N--CA 1.513 2.697 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 178.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 81.8 p -119.07 128.7 54.58 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.575 -0.703 . . . . 0.0 109.613 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.415 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.7 m -131.63 126.1 57.12 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 178.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.57 133.98 52.81 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.721 -0.612 . . . . 0.0 109.635 -179.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -123.42 162.45 22.78 Favored 'General case' 0 N--CA 1.518 2.944 0 O-C-N 121.186 -0.946 . . . . 0.0 109.229 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.46 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -67.22 -41.12 86.27 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.622 -1.299 . . . . 0.0 112.635 -177.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.508 ' N ' ' OD1' ' A' ' 63' ' ' ASP . 18.8 p-10 -68.17 8.55 0.42 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.351 -1.468 . . . . 0.0 110.201 -177.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.46 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 85.55 9.25 79.14 Favored Glycine 0 N--CA 1.493 2.446 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 179.218 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -83.49 100.65 10.89 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 120.912 -1.346 . . . . 0.0 107.435 178.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.4 p -131.68 113.29 13.4 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.469 -0.77 . . . . 0.0 110.068 -178.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -94.64 120.53 35.02 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.437 -0.79 . . . . 0.0 109.79 -179.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.4 p -101.36 110.58 22.61 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.396 -0.815 . . . . 0.0 109.248 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.551 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 28.0 p -111.21 29.4 7.83 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 179.02 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.4 ptmt -65.44 67.48 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 179.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 69' ' ' THR . 72.0 mm-40 -101.63 156.83 17.25 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.335 -0.853 . . . . 0.0 109.989 -179.249 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.434 ' O ' HG13 ' A' ' 72' ' ' VAL . 7.5 p -128.35 129.78 69.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 179.251 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.444 ' O ' ' O ' ' A' ' 53' ' ' LYS . 96.8 t -113.75 132.18 63.45 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 CA-C-O 122.279 1.037 . . . . 0.0 109.352 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.5 mmmt -56.4 -175.47 0.01 OUTLIER 'General case' 0 C--N 1.291 -1.966 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 85.6 p -52.94 163.68 0.47 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.128 -0.982 . . . . 0.0 109.533 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -86.4 -45.51 11.11 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.263 -0.898 . . . . 0.0 109.11 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 54.4 m-20 -156.63 22.41 0.34 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.295 -0.878 . . . . 0.0 109.162 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 63.72 45.03 95.43 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.422 -1.471 . . . . 0.0 109.422 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 49.0 m -67.37 -46.23 73.95 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.318 -1.107 . . . . 0.0 109.512 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 42.5 m-20 -157.87 36.84 0.26 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.233 -0.917 . . . . 0.0 109.399 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.454 ' C ' ' H ' ' A' ' 83' ' ' ASP . 98.5 m -150.16 -71.1 0.18 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.247 -0.908 . . . . 0.0 109.388 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.05 39.43 0.81 Allowed Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.521 -1.431 . . . . 0.0 109.521 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.454 ' H ' ' C ' ' A' ' 81' ' ' CYS . 29.5 m-20 -69.33 177.19 2.93 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.289 -1.124 . . . . 0.0 109.425 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . 53.38 70.83 0.55 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.225 -0.922 . . . . 0.0 109.481 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.527 ' O ' ' N ' ' A' ' 87' ' ' ASP . 25.4 t0 -168.18 -57.17 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.208 -0.932 . . . . 0.0 109.533 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 52.0 -88.58 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.248 -0.908 . . . . 0.0 109.508 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.527 ' N ' ' O ' ' A' ' 85' ' ' ASP . 8.7 p-10 -154.09 145.23 22.83 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.206 -0.934 . . . . 0.0 109.41 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 37.7 p90 -69.0 143.68 54.3 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.329 -0.857 . . . . 0.0 109.487 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -168.95 -33.69 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.246 -0.908 . . . . 0.0 109.347 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.433 ' ND1' ' N ' ' A' ' 90' ' ' HIS . 2.1 m-70 53.03 179.35 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.334 -0.854 . . . . 0.0 109.59 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 35.5 m -161.83 138.48 8.2 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.348 -0.845 . . . . 0.0 109.205 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -69.0 149.6 97.8 Favored Pre-proline 0 N--CA 1.489 1.483 0 O-C-N 121.11 -0.994 . . . . 0.0 108.96 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -58.03 -70.23 0.04 OUTLIER 'Trans proline' 0 C--N 1.324 -0.758 0 C-N-CA 120.941 1.094 . . . . 0.0 109.762 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 14.7 t -171.54 101.82 0.19 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.292 -0.88 . . . . 0.0 109.429 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 65.1 mtm180 -65.54 176.76 1.36 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.184 -0.948 . . . . 0.0 109.559 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -69.65 -123.03 0.04 OUTLIER Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.534 ' ND2' ' H ' ' A' ' 98' ' ' LEU . 5.4 p-10 -173.6 -63.57 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.273 -1.134 . . . . 0.0 109.431 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.534 ' H ' ' ND2' ' A' ' 97' ' ' ASN . 3.9 tp 58.58 -150.79 0.43 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.278 -0.889 . . . . 0.0 109.192 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -84.93 -179.55 7.1 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.141 -0.974 . . . . 0.0 109.361 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -68.15 145.24 54.54 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.164 -0.96 . . . . 0.0 109.47 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -71.5 -31.02 66.63 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.336 -0.853 . . . . 0.0 109.434 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 82.9 t80 -167.28 -19.74 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.234 -0.916 . . . . 0.0 109.457 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.409 ' O ' ' ND1' ' A' ' 103' ' ' HIS . 5.5 t-80 -57.79 -34.69 69.87 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.276 -0.89 . . . . 0.0 109.445 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.531 HH21 ' CG ' ' A' ' 108' ' ' ASP . 15.5 tpt180 54.85 66.24 1.29 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.312 -0.867 . . . . 0.0 109.432 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.407 ' O ' ' O ' ' A' ' 104' ' ' ARG . 19.4 t70 -51.23 -95.77 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.331 -0.856 . . . . 0.0 109.437 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 65.6 tttm -73.86 117.18 15.34 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.264 -0.897 . . . . 0.0 109.398 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.489 ' CG ' ' H ' ' A' ' 108' ' ' ASP . 29.7 t70 -72.21 -171.24 0.72 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.294 -0.879 . . . . 0.0 109.352 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.531 ' CG ' HH21 ' A' ' 104' ' ' ARG . 30.7 p-10 -158.93 156.9 30.35 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.244 -0.91 . . . . 0.0 109.335 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -69.58 -37.28 76.89 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.208 -0.932 . . . . 0.0 109.518 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 53.8 m-85 -64.71 94.1 0.12 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.217 -0.927 . . . . 0.0 109.535 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 68.4 p -75.41 -160.04 0.11 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.28 -0.887 . . . . 0.0 109.467 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.591 ' CG ' HH11 ' A' ' 112' ' ' ARG . 3.9 mtt-85 -73.22 132.76 43.57 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.242 -0.911 . . . . 0.0 109.484 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 49.9 m -75.32 69.31 2.12 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.33 -0.856 . . . . 0.0 109.545 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 44.2 t -73.77 116.24 14.14 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.29 -0.881 . . . . 0.0 109.525 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -72.44 46.66 0.15 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.189 -0.944 . . . . 0.0 109.483 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -65.62 -148.96 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.275 -0.891 . . . . 0.0 109.338 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -151.11 70.51 0.98 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.205 -0.935 . . . . 0.0 109.257 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -73.14 4.98 3.79 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.336 -0.852 . . . . 0.0 109.448 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -62.25 157.34 36.55 Favored Glycine 0 N--CA 1.489 2.228 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.3 ptp180 -168.86 -18.13 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.289 -1.124 . . . . 0.0 109.655 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 56.3 m -73.4 150.04 42.03 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.127 -0.983 . . . . 0.0 109.337 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -163.93 64.56 0.24 Allowed Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.898 -1.281 . . . . 0.0 109.898 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.55 ' N ' HD12 ' A' ' 123' ' ' LEU . 10.5 mp -52.24 136.46 30.43 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.213 -1.169 . . . . 0.0 108.946 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.51 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -89.15 161.91 39.08 Favored Pre-proline 0 N--CA 1.494 1.753 0 O-C-N 121.335 -0.853 . . . . 0.0 108.958 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.51 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 1.4 Cg_endo -58.15 -50.72 9.25 Favored 'Trans proline' 0 C--N 1.32 -0.947 0 C-N-CA 121.238 1.292 . . . . 0.0 109.561 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 61.9 tt0 -165.51 134.13 3.22 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.302 -0.874 . . . . 0.0 109.358 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -59.83 97.99 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.248 -0.907 . . . . 0.0 109.522 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -78.97 84.47 4.98 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.234 -0.916 . . . . 0.0 109.467 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -167.39 -88.18 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.202 -0.936 . . . . 0.0 109.509 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.556 ' N ' HD12 ' A' ' 130' ' ' LEU . 8.9 mp -60.72 -70.62 0.17 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.34 -0.85 . . . . 0.0 109.286 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . 0.425 ' C ' ' H ' ' A' ' 133' ' ' SER . . . 68.84 24.04 75.68 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.466 -1.454 . . . . 0.0 109.466 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -65.22 0.91 1.18 Allowed 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.272 -1.134 . . . . 0.0 109.432 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . 0.425 ' H ' ' C ' ' A' ' 131' ' ' GLY . 95.3 p -62.68 -145.86 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.282 -0.886 . . . . 0.0 109.445 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 72.49 -101.44 1.07 Allowed Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 30.3 t -169.55 46.16 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.203 -1.175 . . . . 0.0 109.504 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.403 ' O ' ' OG ' ' A' ' 137' ' ' SER . 25.1 p 52.21 60.71 3.63 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.249 -0.907 . . . . 0.0 109.47 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . 0.403 ' OG ' ' O ' ' A' ' 136' ' ' SER . 69.6 m -166.88 138.83 3.43 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.223 -0.923 . . . . 0.0 109.387 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 67.5 m -166.39 -20.12 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.255 -0.903 . . . . 0.0 109.475 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -65.09 -25.5 67.82 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.22 -0.925 . . . . 0.0 109.465 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . 0.443 ' O ' HG23 ' A' ' 140' ' ' THR . 7.2 t -64.13 127.38 31.2 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.254 -0.904 . . . . 0.0 109.52 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 11.6 p -175.34 -94.1 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.17 -0.957 . . . . 0.0 109.431 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 47.7 m -74.75 -15.35 60.77 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.291 -0.881 . . . . 0.0 109.376 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 26.8 m80 52.89 58.99 4.78 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.294 -0.879 . . . . 0.0 109.5 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . 0.462 ' C ' ' H ' ' A' ' 146' ' ' GLN . 88.2 p -69.36 167.94 15.44 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.234 -0.916 . . . . 0.0 109.512 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 9.9 ptmm? -75.18 31.15 0.1 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.345 -0.847 . . . . 0.0 109.442 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . 0.462 ' H ' ' C ' ' A' ' 144' ' ' SER . 9.5 tp-100 -62.78 -39.5 94.4 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.155 -0.965 . . . . 0.0 109.457 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -64.04 124.13 20.81 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.233 -0.917 . . . . 0.0 109.41 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 34.2 t -72.12 141.93 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.3 -0.875 . . . . 0.0 109.452 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 42.5 t -167.66 96.56 0.46 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.177 -0.952 . . . . 0.0 109.42 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 82.9 p -171.37 -15.14 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.272 -0.892 . . . . 0.0 109.495 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 40.9 t -76.26 104.96 7.04 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.263 -0.898 . . . . 0.0 109.49 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -169.7 -37.24 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.23 -0.919 . . . . 0.0 109.53 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . 0.401 ' C ' ' H ' ' A' ' 155' ' ' ASN . 60.3 p -50.72 -35.17 30.03 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.239 -0.913 . . . . 0.0 109.489 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 26.9 m -66.54 1.12 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.258 -0.901 . . . . 0.0 109.418 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . 0.401 ' H ' ' C ' ' A' ' 153' ' ' THR . 41.1 p-10 -62.02 -164.51 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.253 -0.904 . . . . 0.0 109.442 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 16.2 tpt180 -57.14 146.73 26.89 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.248 -0.907 . . . . 0.0 109.454 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -60.26 148.87 43.15 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -71.87 -5.36 61.15 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . 0.401 ' OG ' ' N ' ' A' ' 160' ' ' ALA . 77.5 p -169.41 -85.35 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.264 -1.139 . . . . 0.0 109.454 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.401 ' N ' ' OG ' ' A' ' 159' ' ' SER . . . -169.42 154.19 5.59 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.271 -0.893 . . . . 0.0 109.471 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 16.4 tt -69.58 144.22 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.19 -0.944 . . . . 0.0 109.488 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 50.1 tt0 -168.6 90.4 0.26 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.204 -0.935 . . . . 0.0 109.484 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 45.5 t -66.08 103.79 1.03 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.278 -0.889 . . . . 0.0 109.47 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm -67.82 -76.82 0.08 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.298 -0.876 . . . . 0.0 109.299 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -68.1 -164.1 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.223 -0.923 . . . . 0.0 109.496 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' PHE . . . . . 0.442 ' CD1' ' O ' ' A' ' 166' ' ' PHE . 61.9 t80 . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 118.029 -0.986 . . . . 0.0 109.529 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.1 mmt . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -176.69 -121.84 0.69 Allowed Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.513 ' OG1' ' CE2' ' A' ' 4' ' ' PHE . 69.6 p -67.44 -168.14 0.08 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.304 -1.115 . . . . 0.0 109.501 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.513 ' CE2' ' OG1' ' A' ' 3' ' ' THR . 33.8 m-85 56.76 -144.42 0.66 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.34 -0.85 . . . . 0.0 109.453 -179.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -164.33 75.95 0.32 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.278 -0.889 . . . . 0.0 109.552 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 46.3 mm-40 -72.72 -24.73 61.03 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.256 -0.902 . . . . 0.0 109.366 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -71.43 94.69 1.28 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.233 -0.917 . . . . 0.0 109.532 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -68.62 -152.53 0.45 Allowed Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.8 m -59.95 120.83 10.39 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.306 -1.114 . . . . 0.0 109.478 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 95.1 t -67.89 -88.92 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.266 -0.896 . . . . 0.0 109.511 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 89.5 p -171.31 -154.83 0.1 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.246 -0.909 . . . . 0.0 109.421 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 28.4 t -171.98 -102.7 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.217 -0.927 . . . . 0.0 109.445 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 56.7 82.37 0.06 OUTLIER Glycine 0 N--CA 1.489 2.232 0 N-CA-C 109.629 -1.388 . . . . 0.0 109.629 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 16.7 p 48.54 -170.14 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.324 -1.103 . . . . 0.0 109.589 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 54.1 pttt -171.34 -29.24 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.315 -0.865 . . . . 0.0 109.444 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 57.78 8.66 0.73 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.328 -0.857 . . . . 0.0 109.226 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -59.58 -28.01 66.76 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.215 -0.928 . . . . 0.0 109.525 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -132.38 178.25 6.96 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.391 -0.818 . . . . 0.0 109.275 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -164.74 -62.77 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.307 -0.871 . . . . 0.0 109.41 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 80.5 p -70.1 -37.55 75.4 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.298 -0.876 . . . . 0.0 109.518 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -62.71 162.02 30.91 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -69.91 -164.24 0.07 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.172 -1.193 . . . . 0.0 109.237 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.59 HD23 ' N ' ' A' ' 23' ' ' LEU . 0.6 OUTLIER -168.18 -165.96 0.66 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.217 -0.927 . . . . 0.0 109.557 179.973 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 30.5 t -54.42 -61.47 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.267 -0.895 . . . . 0.0 109.452 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 51.1 p -72.59 -144.39 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.239 -0.913 . . . . 0.0 109.511 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.8 t -170.67 40.74 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.196 -0.94 . . . . 0.0 109.427 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -71.17 -25.25 62.46 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.305 -0.872 . . . . 0.0 109.433 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 71.22 168.25 8.52 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.464 -1.454 . . . . 0.0 109.464 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -65.68 -89.21 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.278 -1.13 . . . . 0.0 109.446 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.48 ' C ' ' H ' ' A' ' 32' ' ' LEU . 15.8 pttp -170.54 77.0 0.08 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.201 -0.937 . . . . 0.0 109.501 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 58.83 3.03 0.28 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.236 -0.915 . . . . 0.0 109.323 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.48 ' H ' ' C ' ' A' ' 30' ' ' LYS . 8.0 tp -69.4 -18.7 63.79 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.228 -0.92 . . . . 0.0 109.404 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 11.0 tp -56.33 110.61 0.79 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.256 -0.902 . . . . 0.0 109.489 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.446 ' C ' ' H ' ' A' ' 36' ' ' ASN . 4.0 pt -81.37 -105.37 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.122 -0.987 . . . . 0.0 109.299 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.8 t70 57.4 5.7 0.32 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.228 -0.92 . . . . 0.0 109.505 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.491 ' ND2' ' O ' ' A' ' 36' ' ' ASN . 1.4 p-10 -80.23 120.86 24.89 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.246 -0.909 . . . . 0.0 109.393 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.428 ' O ' ' OE1' ' A' ' 37' ' ' GLU . 3.0 pp20? -73.99 18.18 0.15 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.256 -0.903 . . . . 0.0 109.683 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.479 ' O ' ' ND2' ' A' ' 36' ' ' ASN . 33.2 ttmt -144.61 147.2 32.82 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.286 -0.884 . . . . 0.0 109.572 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.427 HG13 ' N ' ' A' ' 40' ' ' THR . 8.8 p -161.5 -37.22 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 O-C-N 121.296 -0.878 . . . . 0.0 109.474 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.427 ' N ' HG13 ' A' ' 39' ' ' VAL . 1.6 t -70.6 173.56 6.95 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.171 -0.955 . . . . 0.0 109.453 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.8 t -170.81 -172.82 1.23 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.2 -0.937 . . . . 0.0 109.509 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -176.25 178.34 47.66 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 18.5 p80 -170.28 -162.05 0.28 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.26 -1.141 . . . . 0.0 109.448 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 69.8 p -149.87 115.83 5.65 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.212 -0.93 . . . . 0.0 109.276 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 32.8 m -59.74 -67.37 0.39 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.281 -0.887 . . . . 0.0 109.338 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.484 ' H ' HG22 ' A' ' 46' ' ' THR . 0.0 OUTLIER -64.12 104.09 0.69 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.274 -0.891 . . . . 0.0 109.508 -179.984 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 60.3 p -67.02 71.82 0.09 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.284 -0.885 . . . . 0.0 109.574 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.451 ' N ' ' O ' ' A' ' 46' ' ' THR . 55.1 mtp180 -144.54 142.29 30.11 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.159 -0.963 . . . . 0.0 109.242 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.429 ' O ' ' O ' ' A' ' 50' ' ' SER . 20.9 mmm180 -120.29 134.39 55.27 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.663 -0.648 . . . . 0.0 109.469 179.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.429 ' O ' ' O ' ' A' ' 49' ' ' ARG . 29.3 m -58.57 -156.81 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.278 -0.889 . . . . 0.0 109.945 -179.796 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.582 ' SG ' ' N ' ' A' ' 52' ' ' SER . 46.0 t 48.86 -119.41 1.19 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.295 -0.878 . . . . 0.0 109.346 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.582 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 42.0 m -60.64 128.09 34.91 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.058 -1.026 . . . . 0.0 108.843 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.442 ' O ' ' O ' ' A' ' 73' ' ' VAL . 0.0 OUTLIER -74.46 102.4 4.45 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.842 -1.161 . . . . 0.0 109.195 -179.419 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.574 HG13 ' O ' ' A' ' 54' ' ' VAL . 10.3 p -126.01 116.02 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 179.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.448 HG23 ' O ' ' A' ' 55' ' ' ILE . 17.9 tt -127.71 129.34 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 51.0 p -130.05 114.56 15.94 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.395 -0.816 . . . . 0.0 109.311 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.574 ' N ' ' OG1' ' A' ' 69' ' ' THR . 7.8 mtmt -121.4 113.5 19.97 Favored 'General case' 0 N--CA 1.514 2.771 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 178.692 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 65.9 p -116.38 136.29 53.13 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.479 -0.763 . . . . 0.0 109.886 -179.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 59' ' ' VAL . 2.7 m -131.72 124.05 53.13 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 178.538 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -108.97 133.45 52.95 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.763 -0.586 . . . . 0.0 110.196 -179.161 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.479 ' OD1' ' N ' ' A' ' 62' ' ' ALA . 26.3 t-20 -125.46 158.78 33.57 Favored 'General case' 0 N--CA 1.516 2.827 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.479 ' N ' ' OD1' ' A' ' 61' ' ' ASN . . . -71.66 -31.52 66.92 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 120.365 -1.459 . . . . 0.0 112.445 -177.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -69.88 8.57 0.68 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.499 -1.376 . . . . 0.0 109.638 -178.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.442 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 85.36 5.27 85.3 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.722 -1.351 . . . . 0.0 109.722 179.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 64.0 ttt180 -83.43 103.02 12.46 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.77 -1.43 . . . . 0.0 107.929 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 12.2 p -132.66 108.54 9.11 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.473 -0.767 . . . . 0.0 109.703 -178.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -94.92 130.52 41.5 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.226 -0.922 . . . . 0.0 109.933 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.5 p -108.96 107.52 17.93 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.479 -0.763 . . . . 0.0 109.407 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.574 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 30.8 p -97.78 33.01 2.18 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 178.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 74.2 mttt -66.71 67.63 0.06 Allowed 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 179.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.48 ' N ' ' O ' ' A' ' 69' ' ' THR . 74.3 mt-10 -98.0 149.85 22.0 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.169 -0.957 . . . . 0.0 110.142 -179.05 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.6 t -129.04 117.16 43.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.442 ' O ' ' O ' ' A' ' 53' ' ' LYS . 59.4 t -114.79 126.85 72.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 CA-C-O 122.105 0.955 . . . . 0.0 109.349 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 50.8 mttp -54.02 -95.89 0.0 OUTLIER 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 179.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.435 ' H ' ' HB2' ' A' ' 84' ' ' ALA . 38.3 p -153.5 69.72 0.82 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.177 -0.952 . . . . 0.0 109.206 179.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -66.5 -28.13 68.32 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.254 -0.904 . . . . 0.0 108.87 179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -140.46 12.74 2.35 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.35 -169.99 22.66 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 48.1 t -86.48 46.46 1.35 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.375 -1.074 . . . . 0.0 108.419 179.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 56.52 34.7 24.8 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 -179.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 2.8 t -78.06 14.59 1.1 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.281 -0.887 . . . . 0.0 109.329 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -169.78 -9.71 0.03 OUTLIER Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.407 -1.477 . . . . 0.0 109.407 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 53.17 75.87 0.23 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.284 -1.127 . . . . 0.0 109.553 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.435 ' HB2' ' H ' ' A' ' 75' ' ' SER . . . -74.67 175.91 7.46 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.268 -0.895 . . . . 0.0 109.521 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.445 ' N ' ' OD1' ' A' ' 85' ' ' ASP . 19.9 p-10 -172.21 120.39 0.43 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.191 -0.943 . . . . 0.0 109.52 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -61.13 -63.78 1.17 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.281 -0.887 . . . . 0.0 109.442 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 52.37 22.35 2.03 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.317 -0.864 . . . . 0.0 109.562 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -107.97 -71.27 0.76 Allowed 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.474 -0.766 . . . . 0.0 109.33 179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 29.2 t-80 -171.0 77.87 0.07 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.229 -0.92 . . . . 0.0 109.467 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 57.2 t-80 -170.07 -30.23 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.241 -0.912 . . . . 0.0 109.465 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 63.5 p -67.58 117.77 9.97 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.257 -0.902 . . . . 0.0 109.433 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -169.25 68.01 0.65 Allowed Pre-proline 0 N--CA 1.49 1.565 0 O-C-N 121.258 -0.901 . . . . 0.0 109.628 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.99 151.6 80.41 Favored 'Trans proline' 0 C--N 1.318 -1.047 0 C-N-CA 121.403 1.402 . . . . 0.0 109.803 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.479 ' O ' ' N ' ' A' ' 96' ' ' GLY . 41.2 t -170.82 41.94 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.343 -0.848 . . . . 0.0 109.407 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 -68.18 62.32 0.09 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.23 -0.919 . . . . 0.0 109.485 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.479 ' N ' ' O ' ' A' ' 94' ' ' SER . . . 178.41 153.15 11.0 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -168.25 -59.46 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.338 -1.095 . . . . 0.0 109.429 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 16.0 mt -68.99 -64.87 0.79 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.236 -0.915 . . . . 0.0 109.511 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -72.51 -162.42 0.1 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.297 -0.877 . . . . 0.0 109.403 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 53.01 14.91 0.51 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.223 -0.923 . . . . 0.0 109.425 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.411 ' C ' ' H ' ' A' ' 103' ' ' HIS . 79.4 t80 -64.5 -36.44 84.2 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.235 -0.915 . . . . 0.0 109.494 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 27.4 p90 -69.2 4.28 1.73 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.271 -0.893 . . . . 0.0 109.415 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.411 ' H ' ' C ' ' A' ' 101' ' ' PHE . 4.6 t60 -67.27 -43.43 81.84 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.202 -0.937 . . . . 0.0 109.464 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.524 ' NH1' ' O ' ' A' ' 106' ' ' LYS . 0.3 OUTLIER -167.92 93.46 0.38 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.269 -0.895 . . . . 0.0 108.928 179.992 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.466 ' CG ' ' H ' ' A' ' 106' ' ' LYS . 3.1 p-10 -81.72 -70.36 0.55 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.186 -0.946 . . . . 0.0 109.738 -179.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.524 ' O ' ' NH1' ' A' ' 104' ' ' ARG . 93.1 mttt -148.18 -51.88 0.18 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.125 -0.984 . . . . 0.0 109.47 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.428 ' O ' ' O ' ' A' ' 108' ' ' ASP . 6.6 p-10 -169.8 71.5 0.07 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.208 -0.933 . . . . 0.0 109.583 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.428 ' O ' ' O ' ' A' ' 107' ' ' ASP . 62.2 t0 52.59 99.11 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.254 -0.904 . . . . 0.0 109.568 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.493 ' O ' ' CD2' ' A' ' 109' ' ' PHE . 67.2 t80 -59.94 -6.16 1.22 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.295 -0.878 . . . . 0.0 109.404 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . 0.523 ' O ' ' CD2' ' A' ' 110' ' ' PHE . 52.4 t80 -72.67 16.42 0.15 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.293 -0.88 . . . . 0.0 109.439 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . 0.478 ' H ' ' C ' ' A' ' 109' ' ' PHE . 67.3 p -149.93 89.12 1.58 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.22 -0.925 . . . . 0.0 109.352 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 51.0 mtp180 -51.74 137.14 26.23 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.264 -0.897 . . . . 0.0 109.507 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 29.2 t -171.33 18.8 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.359 -0.838 . . . . 0.0 109.482 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 95.5 p -60.23 141.49 55.96 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.256 -0.902 . . . . 0.0 109.476 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 59.6 t-80 -72.22 129.22 37.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.285 -0.884 . . . . 0.0 109.428 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -167.53 145.6 4.68 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.303 -0.873 . . . . 0.0 109.515 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -74.41 83.79 1.96 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.254 -0.904 . . . . 0.0 109.475 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 52.12 -147.84 0.43 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.253 -0.904 . . . . 0.0 109.493 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -166.61 -76.2 0.03 OUTLIER Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 31.7 ptt180 -171.76 5.43 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.208 -1.172 . . . . 0.0 109.428 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 43.3 m -71.68 -10.8 60.32 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.123 -0.986 . . . . 0.0 109.427 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -62.27 -120.64 0.01 OUTLIER Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 16.0 mt -64.71 128.93 37.84 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.345 -1.091 . . . . 0.0 109.365 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.512 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -76.64 161.56 73.79 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.227 -0.921 . . . . 0.0 108.764 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.512 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 1.6 Cg_endo -57.8 -69.76 0.04 OUTLIER 'Trans proline' 0 C--N 1.319 -0.985 0 C-N-CA 121.331 1.354 . . . . 0.0 109.926 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.615 ' H ' ' CD ' ' A' ' 126' ' ' GLU . 1.1 pm0 -58.03 85.26 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.273 -0.892 . . . . 0.0 109.699 -179.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . 0.482 ' N ' ' O ' ' A' ' 125' ' ' PRO . 95.7 m-85 -53.89 -81.61 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.225 -0.922 . . . . 0.0 109.328 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -165.72 -149.28 0.11 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.213 -0.929 . . . . 0.0 109.368 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -164.9 115.41 1.14 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.265 -0.897 . . . . 0.0 109.43 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.59 ' N ' HD12 ' A' ' 130' ' ' LEU . 7.9 mp -72.92 -55.94 5.88 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.196 -0.94 . . . . 0.0 109.388 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 76.86 -82.34 1.1 Allowed Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -170.53 139.94 1.7 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.316 -1.108 . . . . 0.0 109.451 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 50.5 m -77.94 -44.56 26.5 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.217 -0.927 . . . . 0.0 109.491 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 75.3 43.44 25.37 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 94.3 p -72.84 149.51 43.49 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.25 -1.147 . . . . 0.0 109.48 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 38.6 t -74.51 79.89 1.95 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.201 -0.937 . . . . 0.0 109.449 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 41.1 p -172.33 -119.68 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.26 -0.9 . . . . 0.0 109.416 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 22.2 p 53.72 -161.72 0.12 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.139 -0.976 . . . . 0.0 109.512 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.44 ' CB ' ' NZ ' ' A' ' 139' ' ' LYS . 2.7 ttmp? -64.88 146.55 54.76 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.3 -0.875 . . . . 0.0 109.53 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . 0.463 ' OG1' ' N ' ' A' ' 141' ' ' SER . 1.6 t -162.36 -175.18 4.4 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.24 -0.912 . . . . 0.0 109.517 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . 0.463 ' N ' ' OG1' ' A' ' 140' ' ' THR . 12.4 t 53.11 -142.14 0.81 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.278 -0.889 . . . . 0.0 109.478 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . 0.456 ' C ' ' H ' ' A' ' 144' ' ' SER . 24.3 m 53.75 88.6 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.285 -0.884 . . . . 0.0 109.436 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 64.9 m-70 -76.01 24.73 0.13 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.202 -0.936 . . . . 0.0 109.433 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . 0.456 ' H ' ' C ' ' A' ' 142' ' ' THR . 41.4 t -167.26 94.4 0.45 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.244 -0.91 . . . . 0.0 109.493 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 56.1 pttt -70.9 159.75 34.08 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.295 -0.878 . . . . 0.0 109.437 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 52.39 -132.12 2.0 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.247 -0.908 . . . . 0.0 109.456 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -160.56 119.41 2.63 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.264 -0.898 . . . . 0.0 109.418 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 28.8 m -149.07 -151.53 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.273 -0.892 . . . . 0.0 109.328 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 10.3 m 53.83 32.69 15.47 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.139 -0.976 . . . . 0.0 109.476 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 48.8 m -59.59 116.77 4.24 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.27 -0.894 . . . . 0.0 109.51 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 70.5 m -164.59 98.64 0.79 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.309 -0.869 . . . . 0.0 109.391 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 73.9 p -150.29 82.94 1.37 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.331 -0.856 . . . . 0.0 109.358 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 75.7 p -150.63 40.03 0.74 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.231 -0.918 . . . . 0.0 109.295 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 28.2 m -59.57 144.18 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.226 -0.921 . . . . 0.0 109.598 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 52.0 t-20 -66.83 125.43 25.87 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.263 -0.898 . . . . 0.0 109.425 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 89.8 mtm180 -64.21 -65.25 0.7 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.323 -0.86 . . . . 0.0 109.398 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 63.67 109.49 0.01 OUTLIER Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -66.37 -145.5 0.06 OUTLIER Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 11.9 m 53.18 26.71 5.24 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.248 -1.148 . . . . 0.0 109.367 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -63.47 -68.11 0.37 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.367 -0.833 . . . . 0.0 109.467 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 75.9 mt -64.75 -75.96 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.285 -0.884 . . . . 0.0 109.541 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 47.5 tt0 -68.27 142.88 55.46 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.3 -0.875 . . . . 0.0 109.46 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 31.2 t -171.21 66.8 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.329 -0.857 . . . . 0.0 109.424 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.428 ' O ' ' O ' ' A' ' 165' ' ' HIS . 63.4 mttm 52.54 -117.77 1.22 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.205 -0.934 . . . . 0.0 109.365 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . 0.428 ' O ' ' O ' ' A' ' 164' ' ' LYS . 0.8 OUTLIER 54.89 103.11 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.157 -0.964 . . . . 0.0 109.547 -179.958 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 52.2 p90 . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 117.923 -1.037 . . . . 0.0 109.483 179.959 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 73.19 129.57 0.13 Allowed Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.519 ' O ' ' CD2' ' A' ' 4' ' ' PHE . 0.1 OUTLIER -79.03 132.16 36.53 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.199 -1.177 . . . . 0.0 109.413 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.519 ' CD2' ' O ' ' A' ' 3' ' ' THR . 65.8 m-85 -160.34 35.37 0.17 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.258 -0.901 . . . . 0.0 109.488 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 80.3 mtm180 -60.44 -11.67 7.46 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.311 -0.868 . . . . 0.0 109.471 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.497 ' CD ' ' N ' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -168.92 169.23 9.84 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.256 -0.902 . . . . 0.0 109.512 179.938 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -170.36 145.18 2.64 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.301 -0.874 . . . . 0.0 109.533 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.4 ' C ' ' N ' ' A' ' 10' ' ' VAL . . . 173.45 -79.26 0.08 OUTLIER Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.5 m 53.92 12.27 0.42 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.207 -1.172 . . . . 0.0 109.463 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.4 ' N ' ' C ' ' A' ' 8' ' ' GLY . 23.9 t -62.28 -11.37 6.27 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.227 -0.921 . . . . 0.0 109.403 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 29.4 t -158.76 -80.17 0.06 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.271 -0.893 . . . . 0.0 109.362 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.3 t -62.69 130.58 45.6 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.209 -0.932 . . . . 0.0 109.486 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -173.06 -11.7 0.02 OUTLIER Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.423 ' O ' ' O ' ' A' ' 15' ' ' LYS . 41.1 p -152.88 87.68 1.3 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.28 -1.13 . . . . 0.0 109.278 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.423 ' O ' ' O ' ' A' ' 14' ' ' THR . 31.1 ttmt 59.39 154.69 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.415 -0.803 . . . . 0.0 109.482 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -72.61 116.12 12.7 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.224 -0.922 . . . . 0.0 109.611 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 50.7 tt0 -62.6 -27.18 69.02 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.278 -0.889 . . . . 0.0 109.405 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 40.5 p90 -163.46 176.17 10.04 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.407 -0.808 . . . . 0.0 109.218 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.455 ' C ' ' HG1' ' A' ' 20' ' ' THR . 2.1 t60 -168.32 -59.36 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.108 -0.995 . . . . 0.0 109.695 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.522 ' OG1' ' N ' ' A' ' 21' ' ' GLY . 45.4 p 48.58 -103.27 0.1 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.165 -0.959 . . . . 0.0 109.482 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.522 ' N ' ' OG1' ' A' ' 20' ' ' THR . . . -151.56 32.07 0.92 Allowed Glycine 0 N--CA 1.494 2.541 0 N-CA-C 109.496 -1.441 . . . . 0.0 109.496 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 18.8 mmmt -82.59 97.1 8.3 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.203 -1.175 . . . . 0.0 109.407 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.575 ' N ' HD12 ' A' ' 23' ' ' LEU . 10.0 mp -79.43 85.01 5.26 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.249 -0.907 . . . . 0.0 109.199 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 8.3 p -64.79 145.58 13.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.169 -0.957 . . . . 0.0 109.571 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.8 t -50.36 158.78 0.55 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.285 -0.884 . . . . 0.0 109.52 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.5 t -172.59 3.72 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.372 -0.83 . . . . 0.0 109.472 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 57.0 mttp 52.75 -174.84 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.217 -0.927 . . . . 0.0 109.526 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 174.49 -68.27 0.1 OUTLIER Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -171.01 81.29 0.08 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.26 -1.141 . . . . 0.0 109.493 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.4 tttm -69.93 73.98 0.44 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.306 -0.871 . . . . 0.0 109.505 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.461 ' C ' ' H ' ' A' ' 33' ' ' LEU . 31.8 tt0 -65.61 165.2 12.81 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.249 -0.907 . . . . 0.0 109.33 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.4 ' O ' ' O ' ' A' ' 33' ' ' LEU . 18.1 mt -56.24 -6.52 0.27 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.215 -0.928 . . . . 0.0 109.314 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.461 ' H ' ' C ' ' A' ' 31' ' ' GLU . 50.4 tp 50.58 94.02 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.329 -0.857 . . . . 0.0 109.305 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.413 HG22 ' N ' ' A' ' 35' ' ' ASP . 79.0 mt -67.82 155.93 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.239 -0.913 . . . . 0.0 109.413 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.413 ' N ' HG22 ' A' ' 34' ' ' ILE . 17.0 t0 -167.71 -101.22 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.237 -0.915 . . . . 0.0 109.418 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 -157.18 -6.73 0.09 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.323 -0.86 . . . . 0.0 109.412 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 55.53 -127.38 2.14 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.198 -0.939 . . . . 0.0 109.344 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.9 mmtm -53.75 -84.92 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.203 -0.936 . . . . 0.0 109.406 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.49 ' O ' HG13 ' A' ' 39' ' ' VAL . 3.6 p -167.81 88.84 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.207 -0.933 . . . . 0.0 109.583 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.503 ' OG1' ' N ' ' A' ' 41' ' ' SER . 6.0 t 35.02 -153.35 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.122 0 CA-C-O 121.219 0.533 . . . . 0.0 110.954 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.503 ' N ' ' OG1' ' A' ' 40' ' ' THR . 32.5 m -166.28 -139.05 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.324 -0.86 . . . . 0.0 109.529 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 168.99 -136.64 4.15 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.417 -1.473 . . . . 0.0 109.417 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.607 ' CG ' ' H ' ' A' ' 44' ' ' THR . 0.0 OUTLIER -59.5 -103.28 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.184 -1.186 . . . . 0.0 109.368 179.947 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.607 ' H ' ' CG ' ' A' ' 43' ' ' HIS . 3.9 p 58.74 117.81 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.451 -0.781 . . . . 0.0 109.862 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.45 ' C ' ' H ' ' A' ' 47' ' ' THR . 12.1 p 52.56 72.39 0.41 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.171 -0.955 . . . . 0.0 109.475 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 81.4 p -76.07 33.34 0.12 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.201 -0.937 . . . . 0.0 109.466 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.45 ' H ' ' C ' ' A' ' 45' ' ' THR . 3.0 m 59.31 10.66 1.84 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.241 -0.912 . . . . 0.0 109.366 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 42.9 ttp180 -146.05 148.18 32.41 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.206 -0.934 . . . . 0.0 109.142 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.529 ' CG ' HH11 ' A' ' 49' ' ' ARG . 0.9 OUTLIER -97.19 139.18 33.55 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.145 -0.972 . . . . 0.0 109.621 179.888 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 36.8 t -62.39 -105.01 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.266 -0.896 . . . . 0.0 109.234 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.49 ' SG ' ' O ' ' A' ' 81' ' ' CYS . 5.6 t -49.75 146.11 4.68 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.145 -0.972 . . . . 0.0 108.818 179.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 40.3 t 50.54 87.49 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.007 -1.058 . . . . 0.0 108.342 -179.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -75.84 104.84 6.56 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.307 -0.87 . . . . 0.0 110.292 -178.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.599 HG13 ' O ' ' A' ' 54' ' ' VAL . 11.7 p -115.61 113.6 43.84 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.528 HG23 ' O ' ' A' ' 55' ' ' ILE . 10.1 tp -128.52 125.44 63.69 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 65.4 p -128.89 111.41 13.03 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.359 -0.838 . . . . 0.0 109.278 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.522 ' H ' ' HB ' ' A' ' 69' ' ' THR . 0.1 OUTLIER -124.55 113.59 18.28 Favored 'General case' 0 N--CA 1.51 2.561 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 178.767 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.0 p -110.95 130.22 55.65 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.467 -0.771 . . . . 0.0 109.67 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 59' ' ' VAL . 2.8 m -132.55 120.3 41.77 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.14 0 O-C-N 121.481 -0.762 . . . . 0.0 109.207 178.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 33.9 p -109.11 133.86 52.46 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 37.6 t-20 -128.37 162.33 27.36 Favored 'General case' 0 N--CA 1.514 2.769 0 O-C-N 121.46 -0.775 . . . . 0.0 109.317 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.414 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -71.91 -32.38 67.32 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 120.559 -1.338 . . . . 0.0 112.558 -177.641 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -69.21 5.59 1.21 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.372 -1.455 . . . . 0.0 109.953 -178.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.414 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 90.79 4.76 69.33 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 110.08 -1.208 . . . . 0.0 110.08 179.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 11.2 mpt_? -80.67 94.24 6.3 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 120.636 -1.508 . . . . 0.0 107.86 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 31.0 p -120.36 89.66 3.17 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -94.73 122.21 37.11 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.268 -0.895 . . . . 0.0 110.051 -178.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.408 ' C ' ' H ' ' A' ' 70' ' ' LYS . 40.8 p -101.19 109.18 21.01 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.329 -0.857 . . . . 0.0 109.581 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.524 ' O ' ' N ' ' A' ' 71' ' ' GLU . 5.2 m -87.4 31.19 0.75 Allowed 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 178.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.408 ' H ' ' C ' ' A' ' 68' ' ' THR . 16.5 ptmt -64.84 59.01 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.524 ' N ' ' O ' ' A' ' 69' ' ' THR . 13.7 mm-40 -96.3 136.78 36.33 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.053 -1.029 . . . . 0.0 109.481 -179.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' ' 72' ' ' VAL . 10.4 m -128.15 129.8 69.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 179.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 15.1 t -129.08 114.32 31.89 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 CA-C-O 122.057 0.932 . . . . 0.0 108.946 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -97.38 -16.04 20.42 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.604 -179.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.406 ' C ' ' N ' ' A' ' 77' ' ' ASP . 50.8 m -158.92 -127.33 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.146 -0.971 . . . . 0.0 109.533 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.454 ' N ' ' CD ' ' A' ' 76' ' ' GLU . 19.4 mp0 51.56 15.67 0.37 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.285 -0.884 . . . . 0.0 109.325 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.406 ' N ' ' C ' ' A' ' 75' ' ' SER . 25.5 t70 -166.4 27.54 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.241 -0.912 . . . . 0.0 109.386 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.482 ' C ' ' H ' ' A' ' 80' ' ' ASP . . . -153.38 -52.15 0.01 OUTLIER Glycine 0 N--CA 1.493 2.458 0 N-CA-C 109.453 -1.459 . . . . 0.0 109.453 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 13.9 m 50.34 11.19 0.07 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.309 -1.113 . . . . 0.0 109.272 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.482 ' H ' ' C ' ' A' ' 78' ' ' GLY . 3.5 p30 -169.78 32.96 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.308 -0.87 . . . . 0.0 109.464 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.49 ' O ' ' SG ' ' A' ' 51' ' ' CYS . 8.5 t -113.35 29.6 7.86 Favored 'General case' 0 N--CA 1.499 1.99 0 N-CA-C 108.976 -0.749 . . . . 0.0 108.976 179.542 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.445 ' C ' ' H ' ' A' ' 84' ' ' ALA . . . -177.67 -32.36 0.05 OUTLIER Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -68.81 42.76 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.221 -1.164 . . . . 0.0 109.407 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.445 ' H ' ' C ' ' A' ' 82' ' ' GLY . . . -68.16 -177.77 0.92 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.287 -0.883 . . . . 0.0 109.506 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 46.0 t0 53.43 58.59 5.06 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.224 -0.922 . . . . 0.0 109.451 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -170.84 -25.42 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.269 -0.895 . . . . 0.0 109.472 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -79.0 24.53 0.31 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.198 -0.939 . . . . 0.0 109.5 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 43.8 m95 -75.98 9.19 2.57 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.263 -0.898 . . . . 0.0 109.501 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.524 ' O ' ' CD2' ' A' ' 90' ' ' HIS . 0.7 OUTLIER -76.41 117.91 18.55 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.25 -0.906 . . . . 0.0 109.504 -179.887 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.524 ' CD2' ' O ' ' A' ' 89' ' ' HIS . 42.2 m80 -158.13 -48.32 0.06 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.298 -0.876 . . . . 0.0 109.337 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 4.5 p 57.5 25.76 11.86 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.319 -0.863 . . . . 0.0 109.773 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 57.3 t80 52.71 75.35 0.65 Allowed Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 121.191 -0.943 . . . . 0.0 109.674 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -63.48 -172.03 0.14 Allowed 'Trans proline' 0 C--N 1.317 -1.114 0 C-N-CA 121.449 1.433 . . . . 0.0 109.741 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.438 ' O ' ' N ' ' A' ' 96' ' ' GLY . 30.4 t -164.45 -176.4 4.35 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.207 -0.933 . . . . 0.0 109.531 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.563 ' H ' ' NE ' ' A' ' 95' ' ' ARG . 0.1 OUTLIER -65.98 76.95 0.09 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.158 -0.964 . . . . 0.0 109.164 179.952 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 94' ' ' SER . . . 166.89 55.61 0.03 OUTLIER Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -67.89 -56.26 9.75 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.268 -1.136 . . . . 0.0 109.457 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.406 ' O ' ' O ' ' A' ' 99' ' ' ASP . 16.4 mt -69.22 176.57 3.21 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.18 -0.95 . . . . 0.0 109.446 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.406 ' O ' ' O ' ' A' ' 98' ' ' LEU . 20.7 m-20 54.73 101.08 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.258 -0.901 . . . . 0.0 109.449 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.43 ' N ' ' OD1' ' A' ' 100' ' ' ASP . 23.4 p-10 -161.8 -12.13 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.272 -0.892 . . . . 0.0 109.566 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -68.14 -20.65 64.92 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.21 -0.931 . . . . 0.0 109.479 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 66.3 t80 46.3 64.84 1.35 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.281 -0.887 . . . . 0.0 109.63 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.504 ' O ' ' N ' ' A' ' 105' ' ' ASP . 21.6 p80 -76.25 -23.08 54.48 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.303 -0.873 . . . . 0.0 109.501 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 75.9 mtm180 -68.04 62.38 0.08 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.263 -0.898 . . . . 0.0 109.37 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.504 ' N ' ' O ' ' A' ' 103' ' ' HIS . 19.1 p-10 -79.17 10.05 3.94 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.249 -0.907 . . . . 0.0 109.35 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -72.06 52.03 0.24 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.324 -0.86 . . . . 0.0 109.358 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -69.75 163.56 25.47 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.26 -0.9 . . . . 0.0 109.443 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -169.31 73.88 0.09 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.264 -0.898 . . . . 0.0 109.519 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -72.69 -49.61 30.3 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.211 -0.931 . . . . 0.0 109.415 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -70.82 114.48 8.94 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.292 -0.88 . . . . 0.0 109.452 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 74.9 p -67.38 -25.72 66.11 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.276 -0.89 . . . . 0.0 109.42 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 54.5 mtp180 -68.35 147.95 51.4 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.231 -0.918 . . . . 0.0 109.472 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 91.5 p -72.79 -5.9 41.11 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.244 -0.91 . . . . 0.0 109.51 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 50.4 m 51.63 -106.84 0.28 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.285 -0.885 . . . . 0.0 109.517 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -170.97 103.06 0.22 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.246 -0.909 . . . . 0.0 109.48 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.453 ' CD ' ' N ' ' A' ' 116' ' ' GLU . 2.0 mp0 -76.47 83.17 3.18 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.316 -0.865 . . . . 0.0 109.538 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -74.68 128.67 36.12 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.25 -0.906 . . . . 0.0 109.496 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.444 ' N ' ' OD1' ' A' ' 118' ' ' ASP . 20.3 p-10 -170.45 163.09 8.47 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.262 -0.899 . . . . 0.0 109.514 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -72.32 84.07 0.53 Allowed Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.582 ' CG ' HH11 ' A' ' 120' ' ' ARG . 0.3 OUTLIER -169.19 89.37 0.2 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.199 -1.177 . . . . 0.0 109.434 179.929 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 52.4 p -66.61 129.16 38.95 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.301 -0.874 . . . . 0.0 109.537 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -68.19 -127.4 0.03 OUTLIER Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.443 -1.463 . . . . 0.0 109.443 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.591 ' N ' HD12 ' A' ' 123' ' ' LEU . 8.5 mp -64.08 126.53 27.99 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.181 -1.188 . . . . 0.0 109.09 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.529 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -67.31 162.05 58.93 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.108 -0.995 . . . . 0.0 108.924 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.529 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 1.3 Cg_endo -58.11 -15.26 22.24 Favored 'Trans proline' 0 C--N 1.32 -0.962 0 C-N-CA 121.404 1.403 . . . . 0.0 109.854 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 67.8 mm-40 50.94 25.63 2.3 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.251 -0.906 . . . . 0.0 109.362 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 55.58 58.46 4.53 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.348 -0.845 . . . . 0.0 109.388 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.91 -161.29 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.311 -0.868 . . . . 0.0 109.471 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -171.37 -167.21 0.51 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.157 -0.964 . . . . 0.0 109.441 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.579 ' N ' HD12 ' A' ' 130' ' ' LEU . 8.5 mp -75.79 164.44 26.24 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.2 -0.938 . . . . 0.0 109.248 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -65.75 -67.65 1.94 Allowed Glycine 0 N--CA 1.49 2.25 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 52.37 92.09 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.217 -1.166 . . . . 0.0 109.528 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 98.6 p -67.87 -26.66 66.13 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.263 -0.898 . . . . 0.0 109.456 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 68.56 -97.65 0.49 Allowed Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 49.2 m -60.57 152.33 26.43 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.286 -1.126 . . . . 0.0 109.444 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 68.9 m -166.4 157.58 12.98 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.3 -0.875 . . . . 0.0 109.467 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 55.7 m -64.53 -68.21 0.37 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.272 -0.893 . . . . 0.0 109.474 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.496 ' OG ' ' N ' ' A' ' 139' ' ' LYS . 24.3 p 52.95 -134.86 1.61 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.282 -0.886 . . . . 0.0 109.463 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.496 ' N ' ' OG ' ' A' ' 138' ' ' SER . 55.2 pttt -161.6 -6.88 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.202 -0.937 . . . . 0.0 109.457 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 43.8 m -64.43 132.43 50.01 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.21 -0.931 . . . . 0.0 109.431 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . 0.426 ' O ' ' O ' ' A' ' 142' ' ' THR . 42.6 t -166.86 162.88 16.18 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.164 -0.96 . . . . 0.0 109.434 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . 0.426 ' O ' ' O ' ' A' ' 141' ' ' SER . 19.4 m 53.98 100.96 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.234 -0.916 . . . . 0.0 109.496 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 -159.65 82.54 0.74 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.204 -0.935 . . . . 0.0 109.468 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . 0.515 ' O ' ' N ' ' A' ' 146' ' ' GLN . 78.5 p -167.28 123.5 1.13 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.269 -0.894 . . . . 0.0 109.515 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . 0.422 ' C ' ' H ' ' A' ' 147' ' ' PHE . 16.2 pttp -62.12 76.66 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.222 -0.924 . . . . 0.0 109.388 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . 0.515 ' N ' ' O ' ' A' ' 144' ' ' SER . 76.3 mt-30 -53.75 -10.63 0.31 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.256 -0.902 . . . . 0.0 109.497 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . 0.422 ' H ' ' C ' ' A' ' 145' ' ' LYS . 60.3 t80 -67.83 -34.44 76.73 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.233 -0.917 . . . . 0.0 109.457 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 23.0 t 52.44 95.19 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.226 -0.921 . . . . 0.0 109.475 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 49.0 m -67.63 -62.04 1.6 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.234 -0.917 . . . . 0.0 109.397 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 49.3 m -58.51 115.46 3.02 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.293 -0.879 . . . . 0.0 109.49 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 90.6 p -169.95 -56.52 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.295 -0.878 . . . . 0.0 109.496 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 1.8 t -172.98 174.56 3.47 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.289 -0.882 . . . . 0.0 109.499 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . 0.422 HG22 ' H ' ' A' ' 153' ' ' THR . 0.0 OUTLIER -53.37 124.17 14.0 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.183 -0.948 . . . . 0.0 109.52 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.419 ' O ' ' O ' ' A' ' 155' ' ' ASN . 27.6 m -71.61 145.54 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.194 -0.941 . . . . 0.0 109.504 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . 0.419 ' O ' ' O ' ' A' ' 154' ' ' VAL . 6.1 m120 50.88 -179.7 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.228 -0.92 . . . . 0.0 109.559 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 54.6 mtp180 -77.03 -12.78 59.98 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.225 -0.922 . . . . 0.0 109.472 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 68.05 24.24 74.54 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 66.61 -149.74 51.53 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 88.6 p -171.37 22.69 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.255 -1.144 . . . . 0.0 109.428 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -71.9 -54.15 10.94 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.269 -0.895 . . . . 0.0 109.465 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . 0.5 HG23 ' O ' ' A' ' 161' ' ' ILE . 13.8 tt -74.0 118.13 19.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.207 -0.933 . . . . 0.0 109.577 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 6.1 tm-20 -165.33 115.8 1.09 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.194 -0.941 . . . . 0.0 109.284 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . 0.478 ' O ' ' N ' ' A' ' 165' ' ' HIS . 30.0 t -165.57 -31.87 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.302 -0.874 . . . . 0.0 109.46 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 48.5 mtmt 51.31 -92.47 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.281 -0.887 . . . . 0.0 109.424 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . 0.478 ' N ' ' O ' ' A' ' 163' ' ' SER . 0.0 OUTLIER -169.34 69.3 0.06 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.298 -0.876 . . . . 0.0 109.432 -179.984 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 48.7 p90 . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 118.012 -0.995 . . . . 0.0 109.462 179.955 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.0 ptt? . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 164.55 166.1 22.92 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.0 t -65.68 146.67 54.51 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.211 -1.17 . . . . 0.0 109.459 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -167.56 71.61 0.1 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.236 -0.915 . . . . 0.0 109.397 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 59.8 mtm180 -149.9 142.97 24.96 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.314 -0.866 . . . . 0.0 109.375 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -170.64 -29.06 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.232 -0.917 . . . . 0.0 109.429 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -170.63 85.22 0.1 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.298 -0.876 . . . . 0.0 109.415 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.422 ' O ' ' O ' ' A' ' 9' ' ' SER . . . 152.24 48.28 0.02 OUTLIER Glycine 0 N--CA 1.493 2.45 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.422 ' O ' ' O ' ' A' ' 8' ' ' GLY . 29.7 t -55.68 -103.78 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.253 -1.145 . . . . 0.0 109.513 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 43.5 t -74.92 -76.07 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.188 -0.945 . . . . 0.0 109.496 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 89.4 p -75.27 125.54 29.17 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.18 -0.95 . . . . 0.0 109.547 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.0 m -60.59 -158.35 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.232 -0.917 . . . . 0.0 109.465 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -60.24 -165.89 0.23 Allowed Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 37.6 m -61.02 132.83 55.1 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.213 -1.169 . . . . 0.0 109.519 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -59.23 -71.12 0.13 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.323 -0.86 . . . . 0.0 109.535 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -66.03 111.07 3.18 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.239 -0.913 . . . . 0.0 109.473 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -59.77 -41.84 91.98 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.183 -0.948 . . . . 0.0 109.479 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -67.44 -156.87 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.298 -0.877 . . . . 0.0 109.498 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.408 ' O ' ' OG1' ' A' ' 20' ' ' THR . 1.2 p-80 -174.62 10.65 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.253 -0.905 . . . . 0.0 109.508 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.408 ' OG1' ' O ' ' A' ' 19' ' ' HIS . 91.3 m -166.38 -64.82 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.204 -0.935 . . . . 0.0 109.465 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 165.28 -161.77 35.14 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.541 -1.423 . . . . 0.0 109.541 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 22.7 pttm -166.47 132.8 2.44 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.183 -1.187 . . . . 0.0 109.474 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.585 ' N ' HD12 ' A' ' 23' ' ' LEU . 8.9 mp 50.0 76.29 0.14 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.204 -0.935 . . . . 0.0 109.266 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.0 t -56.46 -47.71 81.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.314 -0.866 . . . . 0.0 109.44 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 68.6 p -76.37 112.46 12.89 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.24 -0.913 . . . . 0.0 109.415 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 4.2 t -167.28 137.13 2.87 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.269 -0.895 . . . . 0.0 109.466 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -80.71 -87.97 0.08 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.23 -0.919 . . . . 0.0 109.429 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 171.02 69.88 0.04 OUTLIER Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -169.3 79.26 0.12 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.323 -1.104 . . . . 0.0 109.412 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' A' ' 32' ' ' LEU . 61.8 mttp -75.55 96.89 3.6 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.296 -0.877 . . . . 0.0 109.464 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 82.9 mt-10 -69.48 48.62 0.08 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.21 -0.931 . . . . 0.0 109.389 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.541 ' O ' HD13 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -65.01 -36.25 83.79 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.271 -0.893 . . . . 0.0 109.063 -179.962 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.428 ' O ' ' O ' ' A' ' 34' ' ' ILE . 15.1 mt -67.22 5.82 0.66 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.197 -0.939 . . . . 0.0 109.517 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.449 ' H ' ' C ' ' A' ' 32' ' ' LEU . 88.2 mt 51.65 98.01 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.254 -0.904 . . . . 0.0 109.53 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.41 ' O ' ' O ' ' A' ' 34' ' ' ILE . 15.4 p-10 -62.79 -123.66 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.251 -0.906 . . . . 0.0 109.404 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 59.1 t30 53.01 38.27 26.84 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.184 -0.947 . . . . 0.0 109.426 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -68.21 116.26 8.61 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.214 -0.929 . . . . 0.0 109.441 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -68.51 -145.48 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.28 -0.888 . . . . 0.0 109.436 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 28.1 m -56.87 147.93 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.204 -0.935 . . . . 0.0 109.439 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 48.4 m -165.31 -53.42 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.237 -0.915 . . . . 0.0 109.47 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 40.7 t -61.64 -59.66 4.85 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.228 -0.92 . . . . 0.0 109.444 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -178.16 116.36 0.53 Allowed Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.432 ' O ' ' ND1' ' A' ' 43' ' ' HIS . 14.3 p80 -60.78 100.56 0.11 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.218 -1.166 . . . . 0.0 109.532 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.1 m -165.16 154.45 12.64 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.273 -0.892 . . . . 0.0 109.394 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -173.02 139.67 0.84 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.167 -0.958 . . . . 0.0 109.508 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 36.6 m -66.99 124.52 23.25 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.15 -0.969 . . . . 0.0 109.329 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 74.2 p -152.98 -136.9 0.06 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.315 -0.866 . . . . 0.0 108.833 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -146.6 142.36 27.88 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.188 -0.945 . . . . 0.0 108.958 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.475 ' O ' ' O ' ' A' ' 52' ' ' SER . 22.6 mmt180 -99.79 122.25 42.48 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.232 -0.917 . . . . 0.0 109.488 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.497 ' C ' ' H ' ' A' ' 52' ' ' SER . 29.5 t -78.71 -36.84 42.83 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.063 -1.023 . . . . 0.0 110.22 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 25.9 p -56.02 -4.02 0.11 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.029 -1.044 . . . . 0.0 109.744 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.524 ' OG ' ' N ' ' A' ' 53' ' ' LYS . 0.9 OUTLIER -166.26 -175.17 3.17 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 -179.78 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.524 ' N ' ' OG ' ' A' ' 52' ' ' SER . 44.6 tptt -103.89 101.67 11.46 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 120.95 -1.094 . . . . 0.0 108.049 179.176 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 21.7 t -127.63 114.73 37.03 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.875 0 O-C-N 121.479 -0.763 . . . . 0.0 109.975 -179.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.491 ' CG2' ' NZ ' ' A' ' 57' ' ' LYS . 35.9 mm -117.84 113.64 42.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 179.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 81.7 p -130.34 112.97 13.79 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.223 -0.923 . . . . 0.0 109.937 -179.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.57 ' N ' ' OG1' ' A' ' 69' ' ' THR . 10.9 mmtp -123.86 114.19 19.52 Favored 'General case' 0 N--CA 1.515 2.777 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 178.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 53.3 m -119.5 124.43 46.44 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.609 -0.682 . . . . 0.0 109.613 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 59' ' ' VAL . 2.8 m -131.48 124.88 55.47 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.187 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.011 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.513 HG23 ' O ' ' A' ' 60' ' ' THR . 8.0 t -109.23 122.93 48.38 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.757 -0.589 . . . . 0.0 110.323 -179.465 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -110.56 144.94 38.66 Favored 'General case' 0 N--CA 1.513 2.685 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.464 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -62.82 -34.7 77.86 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 120.084 -1.635 . . . . 0.0 112.944 -177.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -66.24 5.63 0.52 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.355 -1.466 . . . . 0.0 110.045 -178.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.464 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 90.83 5.49 68.41 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 110.423 -1.071 . . . . 0.0 110.423 178.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 41.2 ttm180 -90.54 111.98 23.47 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.644 -1.504 . . . . 0.0 107.834 178.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.8 p -138.47 116.95 12.04 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.255 -0.903 . . . . 0.0 109.81 -179.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -94.35 119.51 33.21 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.281 -0.887 . . . . 0.0 109.77 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.0 p -103.46 109.0 20.49 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.431 -0.793 . . . . 0.0 109.395 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.57 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 4.6 p -111.62 26.72 10.35 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 107.383 -1.339 . . . . 0.0 107.383 178.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 36.4 pttt -65.36 65.9 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' A' ' 69' ' ' THR . 46.5 mt-10 -102.34 156.69 17.42 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.373 -0.83 . . . . 0.0 110.26 -179.121 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.3 p -127.56 136.32 60.8 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.449 ' O ' ' CB ' ' A' ' 74' ' ' LYS . 20.1 t -129.44 117.53 42.98 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.101 0 CA-C-O 121.972 0.891 . . . . 0.0 109.921 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.449 ' CB ' ' O ' ' A' ' 73' ' ' VAL . 0.1 OUTLIER 161.44 -68.02 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 107.742 -1.207 . . . . 0.0 107.742 179.627 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 97.1 p -160.94 -137.89 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.402 -0.812 . . . . 0.0 109.307 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -66.45 -50.33 63.72 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.185 -0.947 . . . . 0.0 109.282 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.411 ' O ' ' OD1' ' A' ' 77' ' ' ASP . 60.7 t0 -166.19 47.82 0.08 Allowed 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.313 -0.867 . . . . 0.0 109.198 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.493 ' C ' ' H ' ' A' ' 80' ' ' ASP . . . 89.82 83.06 1.34 Allowed Glycine 0 N--CA 1.494 2.529 0 N-CA-C 109.396 -1.482 . . . . 0.0 109.396 -179.732 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 49.5 m -61.15 -0.01 0.29 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.301 -1.117 . . . . 0.0 109.464 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.493 ' H ' ' C ' ' A' ' 78' ' ' GLY . 39.2 m-20 -151.79 45.57 0.77 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.262 -0.899 . . . . 0.0 109.354 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.408 ' SG ' ' C ' ' A' ' 80' ' ' ASP . 25.6 m -150.84 -58.86 0.17 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.299 -0.875 . . . . 0.0 109.284 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -145.72 42.69 0.96 Allowed Glycine 0 N--CA 1.496 2.641 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.486 ' CG ' ' H ' ' A' ' 84' ' ' ALA . 13.5 t70 -171.05 -170.09 0.82 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.259 -1.142 . . . . 0.0 109.518 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.486 ' H ' ' CG ' ' A' ' 83' ' ' ASP . . . -160.79 146.88 14.9 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.269 -0.895 . . . . 0.0 109.34 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.483 ' OD1' ' N ' ' A' ' 86' ' ' PHE . 57.4 t0 -167.35 137.97 2.98 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.229 -0.92 . . . . 0.0 109.345 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.483 ' N ' ' OD1' ' A' ' 85' ' ' ASP . 47.7 m-85 -60.25 93.32 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.235 -0.915 . . . . 0.0 109.437 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -68.83 -41.51 78.47 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.256 -0.903 . . . . 0.0 109.48 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 -85.07 56.43 3.94 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.193 -0.942 . . . . 0.0 109.352 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.469 ' HD1' ' C ' ' A' ' 89' ' ' HIS . 0.2 OUTLIER -69.51 158.4 35.29 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.298 -0.876 . . . . 0.0 109.443 -179.952 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 30.4 p80 -168.05 137.37 2.5 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.251 -0.906 . . . . 0.0 109.319 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 80.5 p -76.38 -163.4 0.31 Allowed 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.177 -0.952 . . . . 0.0 109.547 -179.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.437 ' CD2' ' O ' ' A' ' 92' ' ' PHE . 82.2 t80 -168.6 67.95 0.72 Allowed Pre-proline 0 N--CA 1.49 1.545 0 O-C-N 121.3 -0.875 . . . . 0.0 109.594 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -61.59 131.78 37.37 Favored 'Trans proline' 0 C--N 1.317 -1.08 0 C-N-CA 121.367 1.378 . . . . 0.0 109.815 -179.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 92.1 p -93.48 130.22 39.4 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.333 -0.854 . . . . 0.0 109.356 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.542 ' CG ' HH11 ' A' ' 95' ' ' ARG . 4.1 mtt-85 -68.3 -60.3 2.56 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.209 -0.932 . . . . 0.0 109.307 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 74.08 -154.81 48.51 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.417 -1.473 . . . . 0.0 109.417 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 17.8 p-10 -172.24 166.64 5.94 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.226 -1.161 . . . . 0.0 109.583 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -154.6 167.85 28.75 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.289 -0.882 . . . . 0.0 109.317 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.454 ' C ' ' H ' ' A' ' 101' ' ' PHE . 26.4 t70 -168.21 30.31 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.248 -0.908 . . . . 0.0 109.508 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -75.85 31.65 0.11 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.246 -0.909 . . . . 0.0 109.35 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.454 ' H ' ' C ' ' A' ' 99' ' ' ASP . 67.2 t80 -70.83 -32.48 69.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.276 -0.89 . . . . 0.0 109.406 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -61.94 -36.03 80.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.267 -0.896 . . . . 0.0 109.465 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 6.7 m80 -60.89 -47.93 84.14 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.214 -0.929 . . . . 0.0 109.439 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.441 ' HG2' ' H ' ' A' ' 106' ' ' LYS . 38.9 ttp180 -86.28 110.35 19.58 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.317 -0.864 . . . . 0.0 109.393 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.96 1.58 20.29 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.331 -0.855 . . . . 0.0 109.457 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.441 ' H ' ' HG2' ' A' ' 104' ' ' ARG . 85.5 tttt 51.8 70.9 0.5 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.283 -0.886 . . . . 0.0 109.48 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.403 ' C ' ' O ' ' A' ' 106' ' ' LYS . 2.7 p30 41.94 -158.99 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.667 -0.645 . . . . 0.0 110.173 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.403 ' N ' ' OD1' ' A' ' 107' ' ' ASP . 18.3 t70 -167.9 -31.99 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.267 -0.896 . . . . 0.0 109.509 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.446 ' O ' ' N ' ' A' ' 111' ' ' THR . 69.9 t80 -66.28 -19.48 65.83 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.243 -0.911 . . . . 0.0 109.466 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . 0.511 ' O ' ' CD2' ' A' ' 110' ' ' PHE . 75.1 t80 -70.57 52.27 0.14 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.311 -0.868 . . . . 0.0 109.465 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . 0.446 ' N ' ' O ' ' A' ' 109' ' ' PHE . 42.9 m -165.11 81.42 0.35 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.258 -0.901 . . . . 0.0 109.475 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -64.05 130.96 46.08 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.327 -0.858 . . . . 0.0 109.465 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 93.5 p -70.14 -65.01 0.78 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.219 -0.925 . . . . 0.0 109.453 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 49.7 m -62.48 147.02 50.07 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.255 -0.903 . . . . 0.0 109.5 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 7.1 m-70 -67.41 174.59 3.25 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.245 -0.91 . . . . 0.0 109.515 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -67.23 -73.51 0.14 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.247 -0.908 . . . . 0.0 109.475 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -68.04 75.71 0.22 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.258 -0.902 . . . . 0.0 109.478 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -74.08 -21.26 59.99 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.238 -0.914 . . . . 0.0 109.504 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 69.23 94.87 0.05 OUTLIER Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -67.46 118.89 11.4 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.283 -1.128 . . . . 0.0 109.459 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 69.9 p -68.18 -158.23 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.233 -0.917 . . . . 0.0 109.479 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -175.87 -45.27 0.06 OUTLIER Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.578 ' N ' HD12 ' A' ' 123' ' ' LEU . 7.7 mp -76.3 129.59 36.87 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.213 -1.169 . . . . 0.0 109.264 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.524 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -70.05 162.37 69.31 Favored Pre-proline 0 N--CA 1.49 1.535 0 O-C-N 121.172 -0.955 . . . . 0.0 108.759 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.524 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 2.1 Cg_endo -56.47 114.16 1.78 Allowed 'Trans proline' 0 C--N 1.32 -0.963 0 C-N-CA 121.344 1.363 . . . . 0.0 109.763 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -66.41 148.82 51.32 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.223 -0.923 . . . . 0.0 109.468 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -81.55 10.61 5.63 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.227 -0.921 . . . . 0.0 109.408 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -76.41 -71.67 0.38 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.242 -0.911 . . . . 0.0 109.46 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -67.31 -166.53 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.239 -0.913 . . . . 0.0 109.436 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 13.9 mt 54.37 -177.37 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.269 -0.894 . . . . 0.0 109.438 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 171.04 88.83 0.07 OUTLIER Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.581 -1.407 . . . . 0.0 109.581 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 22.6 tp10 -168.82 -75.05 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.222 -1.164 . . . . 0.0 109.49 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 45.6 t -72.72 139.31 47.12 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.208 -0.933 . . . . 0.0 109.452 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 177.34 138.44 3.0 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . 0.428 ' O ' ' N ' ' A' ' 137' ' ' SER . 87.6 p -170.0 33.26 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.272 -1.134 . . . . 0.0 109.45 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.465 ' O ' ' N ' ' A' ' 138' ' ' SER . 88.5 p -69.99 54.3 0.13 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.283 -0.886 . . . . 0.0 109.478 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . 0.428 ' N ' ' O ' ' A' ' 135' ' ' SER . 52.5 m -69.61 55.61 0.12 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.283 -0.886 . . . . 0.0 109.526 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.465 ' N ' ' O ' ' A' ' 136' ' ' SER . 92.1 p -66.95 114.77 6.01 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.323 -0.86 . . . . 0.0 109.537 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 61.8 mttm -70.47 58.37 0.19 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.247 -0.908 . . . . 0.0 109.45 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 2.8 t -61.99 159.04 15.0 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.2 -0.937 . . . . 0.0 109.474 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . 0.402 ' O ' ' OG1' ' A' ' 142' ' ' THR . 60.3 m -74.62 -39.32 62.2 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.273 -0.892 . . . . 0.0 109.444 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . 0.519 ' O ' ' CG ' ' A' ' 143' ' ' HIS . 90.0 m -165.58 -77.62 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.287 -0.883 . . . . 0.0 109.449 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . 0.519 ' CG ' ' O ' ' A' ' 142' ' ' THR . 43.6 m80 -158.22 149.98 21.52 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.242 -0.911 . . . . 0.0 109.472 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 50.8 m -71.14 79.19 0.69 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.25 -0.906 . . . . 0.0 109.492 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -67.53 82.26 0.17 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.259 -0.9 . . . . 0.0 109.479 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . 0.457 ' C ' ' H ' ' A' ' 148' ' ' VAL . 49.4 tt0 -168.44 -65.44 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.19 -0.943 . . . . 0.0 109.439 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . 0.519 ' CD2' ' O ' ' A' ' 147' ' ' PHE . 80.9 t80 -72.49 14.0 0.29 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.294 -0.879 . . . . 0.0 109.364 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . 0.457 ' H ' ' C ' ' A' ' 146' ' ' GLN . 44.0 t -148.07 -75.97 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.219 -0.925 . . . . 0.0 109.363 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 47.5 t -76.79 -178.94 5.1 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.269 -0.894 . . . . 0.0 109.509 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 13.3 t 51.86 17.19 0.6 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.269 -0.894 . . . . 0.0 109.477 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . 0.418 ' OG ' ' N ' ' A' ' 152' ' ' THR . 78.6 p -71.35 -100.93 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.24 -0.913 . . . . 0.0 109.542 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . 0.418 ' N ' ' OG ' ' A' ' 151' ' ' SER . 47.5 m -78.5 105.97 10.13 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.246 -0.909 . . . . 0.0 109.566 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 70.6 p -144.55 -12.6 0.59 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.311 -0.868 . . . . 0.0 109.39 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 21.7 t 51.08 80.68 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.182 -0.949 . . . . 0.0 109.47 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 44.2 m-20 50.87 -146.48 0.44 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.221 -0.925 . . . . 0.0 109.452 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 69.6 ttt180 -166.05 149.61 7.64 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.248 -0.907 . . . . 0.0 109.454 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 73.49 176.79 33.31 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -69.25 -106.43 0.03 OUTLIER Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 73.2 p -169.01 0.56 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.265 -1.138 . . . . 0.0 109.452 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -159.69 78.71 0.7 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.296 -0.878 . . . . 0.0 109.461 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . 0.474 ' O ' ' N ' ' A' ' 163' ' ' SER . 75.8 mt -72.97 -40.57 59.49 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.259 -0.901 . . . . 0.0 109.461 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -68.9 44.39 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.163 -0.961 . . . . 0.0 109.494 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . 0.474 ' N ' ' O ' ' A' ' 161' ' ' ILE . 54.2 m -72.12 65.23 0.57 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.225 -0.922 . . . . 0.0 109.368 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.407 ' O ' ' O ' ' A' ' 163' ' ' SER . 62.5 mmtt 53.24 176.6 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.256 -0.903 . . . . 0.0 109.448 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 11.9 m170 -64.87 -58.64 5.64 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.261 -0.899 . . . . 0.0 109.548 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 117.901 -1.047 . . . . 0.0 109.419 -179.985 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.4 ptt? . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 178.1 16.24 0.03 OUTLIER Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 25.7 m -165.37 98.39 0.71 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.321 -1.105 . . . . 0.0 109.453 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.513 ' CD2' ' O ' ' A' ' 4' ' ' PHE . 12.2 p90 -70.18 102.92 2.2 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.309 -0.87 . . . . 0.0 109.525 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 69.5 mtm180 -83.68 7.15 18.45 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.244 -0.91 . . . . 0.0 109.522 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -60.64 143.0 55.0 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.209 -0.932 . . . . 0.0 109.44 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.438 ' CD ' ' N ' ' A' ' 7' ' ' GLU . 21.0 mp0 -72.82 141.73 48.01 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.217 -0.927 . . . . 0.0 109.489 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -66.1 142.4 43.02 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.8 m 50.57 81.71 0.06 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.296 -1.12 . . . . 0.0 109.388 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 10' ' ' VAL . 35.3 m -71.68 121.88 22.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.27 -0.894 . . . . 0.0 109.639 -179.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.7 m -161.08 126.86 3.8 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.177 -0.952 . . . . 0.0 109.45 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.1 t 54.17 -168.66 0.07 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.315 -0.866 . . . . 0.0 109.443 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 176.42 -67.61 0.09 OUTLIER Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.6 t -170.04 37.97 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.224 -1.162 . . . . 0.0 109.527 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.46 ' C ' ' H ' ' A' ' 17' ' ' GLU . 19.8 tptp -83.79 -24.07 31.2 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.282 -0.886 . . . . 0.0 109.441 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -66.95 5.96 0.58 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.235 -0.916 . . . . 0.0 109.488 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.46 ' H ' ' C ' ' A' ' 15' ' ' LYS . 58.1 mm-40 -62.89 -42.51 99.8 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.269 -0.895 . . . . 0.0 109.392 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -67.58 81.06 0.17 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.208 -0.932 . . . . 0.0 109.372 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.541 ' N ' ' ND1' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -76.74 -168.33 1.01 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.226 -0.921 . . . . 0.0 109.42 -179.923 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 85.4 m -71.36 105.28 3.46 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.205 -0.935 . . . . 0.0 109.494 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -82.91 -15.34 72.98 Favored Glycine 0 N--CA 1.492 2.382 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -45.86 142.1 2.73 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.277 -1.131 . . . . 0.0 109.724 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.581 ' N ' HD12 ' A' ' 23' ' ' LEU . 8.8 mp -80.98 72.95 8.03 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.315 -0.866 . . . . 0.0 109.15 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 29.7 m -74.04 141.32 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.262 -0.899 . . . . 0.0 109.465 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 70.4 p -149.98 89.34 1.59 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.235 -0.916 . . . . 0.0 109.289 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 47.0 m -78.46 149.21 33.27 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.283 -0.885 . . . . 0.0 109.47 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.419 ' CB ' ' NZ ' ' A' ' 27' ' ' LYS . 7.0 ttpm? -149.84 165.27 33.02 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.265 -0.897 . . . . 0.0 109.316 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 167.3 107.4 0.2 Allowed Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -79.31 124.17 28.15 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.168 -1.195 . . . . 0.0 109.301 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -90.73 148.86 22.3 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.241 -0.912 . . . . 0.0 109.652 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 53.05 86.34 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.375 -0.828 . . . . 0.0 109.807 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.588 ' N ' HD12 ' A' ' 32' ' ' LEU . 9.7 mp -84.18 -17.78 38.83 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.244 -0.91 . . . . 0.0 109.158 179.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 14.3 mt 50.3 11.07 0.06 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.31 -0.869 . . . . 0.0 109.548 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.475 ' H ' ' C ' ' A' ' 32' ' ' LEU . 96.5 mt -135.35 116.64 19.82 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.013 0 O-C-N 121.441 -0.787 . . . . 0.0 109.073 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -74.26 74.87 1.83 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.233 -0.917 . . . . 0.0 109.619 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.517 ' O ' ' N ' ' A' ' 38' ' ' LYS . 27.6 m120 -71.84 -179.55 2.73 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.279 -0.888 . . . . 0.0 109.39 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 80.3 mt-10 -62.69 75.78 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.262 -0.899 . . . . 0.0 109.43 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.517 ' N ' ' O ' ' A' ' 36' ' ' ASN . 7.3 tppt? -69.91 -28.95 66.03 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.315 -0.865 . . . . 0.0 109.472 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.435 ' O ' HG13 ' A' ' 39' ' ' VAL . 7.2 p -60.48 128.18 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 121.183 -0.948 . . . . 0.0 109.407 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 42.0 m -166.74 117.29 0.92 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.259 -0.901 . . . . 0.0 109.4 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 69.0 m -166.06 -12.38 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.292 -0.88 . . . . 0.0 109.431 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 62.08 -134.42 46.03 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 67.1 t60 -171.33 -35.47 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.257 -1.143 . . . . 0.0 109.263 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.433 ' O ' ' O ' ' A' ' 45' ' ' THR . 20.0 p 50.79 -143.12 0.64 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.405 -0.809 . . . . 0.0 109.341 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.513 ' O ' ' N ' ' A' ' 47' ' ' THR . 30.9 p 49.3 95.62 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.22 -0.925 . . . . 0.0 109.486 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.428 HG22 ' H ' ' A' ' 46' ' ' THR . 0.7 OUTLIER -65.06 68.47 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.222 -0.924 . . . . 0.0 109.565 -179.955 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.513 ' N ' ' O ' ' A' ' 45' ' ' THR . 65.8 p -68.16 -58.25 4.76 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.251 -0.906 . . . . 0.0 109.276 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 15.9 ptm180 -145.72 141.86 28.43 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.277 -0.89 . . . . 0.0 109.194 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.427 ' O ' ' O ' ' A' ' 50' ' ' SER . 32.9 ttp180 -95.83 140.87 29.99 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.165 -0.959 . . . . 0.0 110.286 -179.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.427 ' O ' ' O ' ' A' ' 49' ' ' ARG . 11.9 m 53.45 171.36 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.338 -0.851 . . . . 0.0 110.206 179.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.448 ' SG ' ' N ' ' A' ' 52' ' ' SER . 6.2 p -58.88 -62.05 2.17 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.387 -0.821 . . . . 0.0 109.165 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.448 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 9.0 t -49.27 146.05 4.02 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.077 -1.015 . . . . 0.0 108.764 179.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -84.1 102.02 12.24 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 120.999 -1.063 . . . . 0.0 109.689 -179.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.603 HG13 ' O ' ' A' ' 54' ' ' VAL . 13.6 p -125.82 117.12 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 CA-C-O 121.576 0.703 . . . . 0.0 109.107 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 7.3 tp -128.36 138.4 54.75 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 49.0 m -128.07 113.31 15.62 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.35 -0.844 . . . . 0.0 109.518 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.54 ' H ' ' HB ' ' A' ' 69' ' ' THR . 5.5 mtmm -125.14 116.26 21.76 Favored 'General case' 0 N--CA 1.511 2.61 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 178.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.4 t -116.81 141.29 48.4 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.395 -0.816 . . . . 0.0 109.92 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 59' ' ' VAL . 2.8 m -132.31 120.8 44.29 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.16 0 O-C-N 121.554 -0.716 . . . . 0.0 109.311 179.067 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 32.0 p -110.16 133.36 53.3 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.836 -0.54 . . . . 0.0 109.841 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.429 ' OD1' ' N ' ' A' ' 62' ' ' ALA . 16.2 t-20 -137.55 172.18 13.36 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.367 -0.833 . . . . 0.0 109.734 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.429 ' N ' ' OD1' ' A' ' 61' ' ' ASN . . . -63.32 -39.96 96.0 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.85 -1.156 . . . . 0.0 112.621 -177.357 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 35.9 m-20 -68.8 6.04 0.97 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.445 -1.409 . . . . 0.0 109.929 -178.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.519 ' O ' ' N ' ' A' ' 66' ' ' THR . . . 89.22 8.69 68.28 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.865 -1.294 . . . . 0.0 109.865 179.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.418 ' O ' ' O ' ' A' ' 59' ' ' VAL . 12.8 tpt180 -64.09 79.94 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.35 0 O-C-N 120.728 -1.454 . . . . 0.0 108.139 179.306 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.519 ' N ' ' O ' ' A' ' 64' ' ' GLY . 72.9 p -112.2 72.32 0.77 Allowed 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 -179.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -94.79 128.33 41.43 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.341 -0.85 . . . . 0.0 109.775 -179.013 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.525 ' C ' ' H ' ' A' ' 70' ' ' LYS . 31.3 p -100.01 109.8 22.12 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.323 -0.861 . . . . 0.0 109.675 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.54 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 5.3 m -78.7 36.39 0.26 Allowed 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 178.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.525 ' H ' ' C ' ' A' ' 68' ' ' THR . 40.7 pttt -65.07 62.65 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 179.098 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.531 ' N ' ' O ' ' A' ' 69' ' ' THR . 45.8 mt-10 -85.36 139.91 31.19 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.097 -1.002 . . . . 0.0 110.07 -179.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.549 HG23 ' O ' ' A' ' 72' ' ' VAL . 16.2 m -128.41 124.14 61.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 179.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 21.6 t -126.04 117.41 48.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 CA-C-O 122.16 0.981 . . . . 0.0 109.077 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.419 ' O ' ' O ' ' A' ' 75' ' ' SER . 96.1 mttt -86.85 51.76 2.33 Favored 'General case' 0 C--N 1.29 -2.001 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.545 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.419 ' O ' ' O ' ' A' ' 74' ' ' LYS . 2.3 m 60.32 149.6 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.324 -0.86 . . . . 0.0 109.648 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -79.63 9.13 5.35 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.41 -0.806 . . . . 0.0 109.338 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -165.3 -36.07 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.21 -0.931 . . . . 0.0 109.854 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 69.56 55.81 9.4 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 42.7 t -65.65 -17.78 64.84 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.245 -1.15 . . . . 0.0 109.434 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -162.82 24.19 0.09 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.324 -0.86 . . . . 0.0 109.493 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.404 ' SG ' ' N ' ' A' ' 52' ' ' SER . 12.1 t -162.53 133.71 5.04 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.368 -0.833 . . . . 0.0 109.415 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 83.2 -24.16 5.65 Favored Glycine 0 N--CA 1.492 2.429 0 N-CA-C 109.469 -1.452 . . . . 0.0 109.469 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 29.3 t70 51.35 21.29 1.13 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.196 -1.179 . . . . 0.0 109.432 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -71.57 55.16 0.24 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.264 -0.898 . . . . 0.0 109.447 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -61.03 137.91 58.21 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.274 -0.891 . . . . 0.0 109.537 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -69.16 161.14 29.76 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.195 -0.94 . . . . 0.0 109.447 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.436 ' O ' ' O ' ' A' ' 88' ' ' TRP . 6.9 p-10 -169.9 91.99 0.21 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.228 -0.92 . . . . 0.0 109.406 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . 0.436 ' O ' ' O ' ' A' ' 87' ' ' ASP . 1.7 m0 61.26 137.48 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.431 -0.793 . . . . 0.0 109.7 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -168.28 -70.83 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.215 -0.928 . . . . 0.0 109.376 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -66.78 -95.74 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.279 -0.888 . . . . 0.0 109.424 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.1 m -159.03 51.65 0.38 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.181 -0.95 . . . . 0.0 109.305 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.568 ' N ' ' CD ' ' A' ' 93' ' ' PRO . 0.2 OUTLIER -79.26 -44.77 1.69 Allowed Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.291 -0.88 . . . . 0.0 110.658 -179.932 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.568 ' CD ' ' N ' ' A' ' 92' ' ' PHE . 6.3 Cg_exo -64.54 130.17 25.82 Favored 'Trans proline' 0 C--N 1.32 -0.954 0 C-N-CA 121.075 1.183 . . . . 0.0 110.164 -178.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 79.4 p -167.38 130.5 1.73 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.409 -0.807 . . . . 0.0 109.295 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.43 ' O ' ' O ' ' A' ' 96' ' ' GLY . 38.3 ttm180 -58.18 -91.84 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.24 -0.912 . . . . 0.0 109.537 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.43 ' O ' ' O ' ' A' ' 95' ' ' ARG . . . 51.45 97.71 0.01 OUTLIER Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.616 -1.394 . . . . 0.0 109.616 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 31.6 p-10 -170.84 121.22 0.56 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.217 -1.167 . . . . 0.0 109.605 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.59 ' N ' HD12 ' A' ' 98' ' ' LEU . 8.7 mp 50.07 70.38 0.51 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.178 -0.951 . . . . 0.0 109.353 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -158.5 121.28 3.74 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.233 -0.917 . . . . 0.0 109.466 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 -57.77 128.82 39.01 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.246 -0.909 . . . . 0.0 109.428 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -61.92 -17.26 56.16 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.181 -0.95 . . . . 0.0 109.494 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -70.32 143.97 51.85 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.17 -0.956 . . . . 0.0 108.915 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -60.72 -48.78 80.24 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.162 -0.961 . . . . 0.0 109.782 -179.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -168.54 110.15 0.54 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.221 -0.924 . . . . 0.0 109.425 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -169.34 71.3 0.07 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.262 -0.899 . . . . 0.0 109.312 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -68.04 -89.2 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.208 -0.933 . . . . 0.0 109.414 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -168.7 -140.7 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.245 -0.91 . . . . 0.0 109.413 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 22.4 p30 -171.71 63.91 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.119 -0.988 . . . . 0.0 109.5 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -66.43 -50.58 62.93 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.256 -0.902 . . . . 0.0 109.429 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -82.48 105.02 13.19 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.215 -0.928 . . . . 0.0 109.481 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 40.8 m -77.36 109.46 11.29 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.198 -0.939 . . . . 0.0 109.469 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.589 ' CG ' HH11 ' A' ' 112' ' ' ARG . 4.0 mtt-85 -72.92 111.57 8.16 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.233 -0.917 . . . . 0.0 109.492 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 95.2 p -67.46 102.16 1.09 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.264 -0.897 . . . . 0.0 109.486 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.525 ' O ' ' CG ' ' A' ' 115' ' ' HIS . 29.6 t -171.76 124.64 0.56 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.269 -0.894 . . . . 0.0 109.45 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . 0.525 ' CG ' ' O ' ' A' ' 114' ' ' SER . 88.8 m-70 -158.2 161.7 37.84 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.224 -0.923 . . . . 0.0 109.445 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -63.42 124.19 20.67 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.277 -0.89 . . . . 0.0 109.411 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -67.38 -28.42 67.92 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.219 -0.925 . . . . 0.0 109.539 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -62.19 -175.83 0.08 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.273 -0.892 . . . . 0.0 109.433 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.423 ' O ' ' N ' ' A' ' 121' ' ' THR . . . 71.7 3.07 53.67 Favored Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 50.35 -96.66 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.289 -1.124 . . . . 0.0 109.401 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.423 ' N ' ' O ' ' A' ' 119' ' ' GLY . 5.4 m 58.39 162.4 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.318 -0.864 . . . . 0.0 109.644 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 64.93 112.11 0.01 OUTLIER Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.678 -1.369 . . . . 0.0 109.678 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 14.8 mt -70.35 135.65 49.01 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.298 -1.119 . . . . 0.0 109.18 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -77.0 151.73 82.05 Favored Pre-proline 0 N--CA 1.49 1.534 0 O-C-N 121.109 -0.994 . . . . 0.0 108.985 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -59.85 -9.29 9.32 Favored 'Trans proline' 0 C--N 1.323 -0.798 0 C-N-CA 121.012 1.142 . . . . 0.0 109.675 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -49.17 165.01 0.06 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.238 -0.914 . . . . 0.0 109.841 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 36.8 p90 -171.93 165.29 6.38 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.496 -0.753 . . . . 0.0 109.511 179.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.37 100.21 1.32 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.261 -0.899 . . . . 0.0 109.438 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -77.82 147.91 34.99 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.294 -0.879 . . . . 0.0 109.396 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.586 ' N ' HD12 ' A' ' 130' ' ' LEU . 8.4 mp -64.81 -5.43 5.92 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.298 -0.876 . . . . 0.0 109.266 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -173.22 130.71 1.93 Allowed Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.611 -1.395 . . . . 0.0 109.611 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -63.13 162.39 11.8 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.295 -1.121 . . . . 0.0 109.419 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . 0.42 ' C ' ' H ' ' A' ' 135' ' ' SER . 31.4 t -170.63 153.01 3.99 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.168 -0.957 . . . . 0.0 109.473 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 67.1 -3.41 4.19 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . 0.42 ' H ' ' C ' ' A' ' 133' ' ' SER . 48.9 m -67.11 147.16 53.48 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.198 -1.178 . . . . 0.0 109.371 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 50.9 m -65.46 118.79 9.93 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.128 -0.982 . . . . 0.0 109.45 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 69.0 m -166.05 73.36 0.17 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.321 -0.862 . . . . 0.0 109.432 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 87.4 p -70.62 69.61 0.43 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.313 -0.867 . . . . 0.0 109.494 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 67.7 mmtt -68.66 99.23 0.97 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.223 -0.923 . . . . 0.0 109.318 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 74.6 p -68.31 -177.51 0.91 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.261 -0.9 . . . . 0.0 109.402 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 74.9 m -166.32 49.87 0.08 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.245 -0.909 . . . . 0.0 109.446 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 2.3 t -60.04 163.4 4.79 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.25 -0.906 . . . . 0.0 109.443 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 56.5 t-80 -66.49 99.24 0.55 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.221 -0.924 . . . . 0.0 109.465 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 43.5 t -65.48 114.43 4.86 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.291 -0.881 . . . . 0.0 109.492 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -65.79 137.8 57.49 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.214 -0.929 . . . . 0.0 109.455 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 53.18 86.5 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.258 -0.901 . . . . 0.0 109.452 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 44.3 p90 -61.12 164.64 4.97 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.137 -0.977 . . . . 0.0 109.473 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 43.1 t -148.2 116.36 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.289 -0.882 . . . . 0.0 109.284 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . 0.449 ' O ' ' N ' ' A' ' 151' ' ' SER . 30.3 t -170.04 150.66 3.82 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.256 -0.902 . . . . 0.0 109.44 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 48.2 t -66.05 74.0 0.08 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.268 -0.895 . . . . 0.0 109.498 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . 0.449 ' N ' ' O ' ' A' ' 149' ' ' SER . 67.4 m -165.95 64.16 0.11 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.269 -0.894 . . . . 0.0 109.514 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 62.5 p -75.26 -13.99 60.48 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.18 -0.95 . . . . 0.0 109.414 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 30.5 p 49.22 85.47 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.156 -0.965 . . . . 0.0 109.52 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 30.4 t -66.01 -12.27 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.281 -0.887 . . . . 0.0 109.425 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -157.44 127.0 6.04 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.284 -0.885 . . . . 0.0 109.329 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -65.05 -75.29 0.09 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.166 -0.959 . . . . 0.0 109.371 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 172.26 16.68 0.02 OUTLIER Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -171.71 -83.78 0.06 OUTLIER Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.606 -1.397 . . . . 0.0 109.606 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . 0.532 ' O ' ' N ' ' A' ' 161' ' ' ILE . 9.4 m 52.84 53.16 12.56 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.303 -1.116 . . . . 0.0 109.407 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.447 ' O ' ' O ' ' A' ' 161' ' ' ILE . . . -57.29 82.08 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.394 -0.816 . . . . 0.0 109.881 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . 0.601 HG22 ' N ' ' A' ' 162' ' ' GLU . 77.9 mt -42.66 167.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.58 -0.7 . . . . 0.0 110.251 -179.581 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.601 ' N ' HG22 ' A' ' 161' ' ' ILE . 66.0 mt-10 -149.81 126.56 11.04 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.229 -0.919 . . . . 0.0 109.435 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 94.2 p -69.97 142.73 52.81 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.268 -0.895 . . . . 0.0 109.456 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 17.2 ttmm -68.56 -38.46 80.77 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.28 -0.887 . . . . 0.0 109.403 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . 0.601 ' ND1' ' N ' ' A' ' 166' ' ' PHE . 50.1 t-80 51.37 -102.59 0.12 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.242 -0.911 . . . . 0.0 109.399 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' PHE . . . . . 0.601 ' N ' ' ND1' ' A' ' 165' ' ' HIS . 51.7 p90 . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 118.003 -0.999 . . . . 0.0 109.409 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.5 mtp . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.452 ' C ' ' H ' ' A' ' 4' ' ' PHE . . . -179.44 161.65 27.83 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 72.0 p -76.04 27.38 0.12 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.232 -1.158 . . . . 0.0 109.41 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.452 ' H ' ' C ' ' A' ' 2' ' ' GLY . 62.2 t80 -75.45 104.17 5.9 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.228 -0.92 . . . . 0.0 109.46 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -167.87 152.31 6.52 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.209 -0.932 . . . . 0.0 109.488 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -90.79 84.5 5.84 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.322 -0.861 . . . . 0.0 109.342 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -67.32 -76.45 0.08 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.18 -0.95 . . . . 0.0 109.457 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 159.62 167.01 19.66 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.44 ' O ' ' N ' ' A' ' 11' ' ' SER . 78.0 p -171.71 -6.95 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.257 -1.143 . . . . 0.0 109.492 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.43 ' H ' HG22 ' A' ' 10' ' ' VAL . 15.6 m -69.8 51.98 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.236 -0.915 . . . . 0.0 109.419 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.44 ' N ' ' O ' ' A' ' 9' ' ' SER . 92.1 p -166.04 -157.5 0.3 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.193 -0.942 . . . . 0.0 109.47 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.2 t -168.32 -63.64 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.224 -0.922 . . . . 0.0 109.469 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -171.92 151.41 14.89 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 49.4 m -57.33 -18.99 19.7 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.274 -1.133 . . . . 0.0 109.514 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 20.9 pttp -55.55 147.7 17.37 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.308 -0.87 . . . . 0.0 109.485 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 27.1 mm100 -63.32 152.49 37.74 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.271 -0.893 . . . . 0.0 109.469 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -72.53 -32.29 65.99 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.227 -0.921 . . . . 0.0 109.472 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.452 ' CD2' ' O ' ' A' ' 19' ' ' HIS . 81.0 t80 -169.35 137.04 1.82 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.3 -0.875 . . . . 0.0 109.435 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.452 ' O ' ' CD2' ' A' ' 18' ' ' PHE . 55.8 m80 -59.95 146.56 41.99 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.311 -0.868 . . . . 0.0 109.405 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.9 m 53.08 92.94 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.237 -0.914 . . . . 0.0 109.453 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 175.51 124.88 0.83 Allowed Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -152.26 147.07 25.93 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.197 -1.178 . . . . 0.0 109.528 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.439 HD23 ' C ' ' A' ' 23' ' ' LEU . 1.9 tt 57.47 83.83 0.1 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.33 -0.856 . . . . 0.0 109.149 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.4 t -149.85 90.94 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.144 -0.972 . . . . 0.0 109.271 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.8 t -56.9 159.84 3.86 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.29 -0.881 . . . . 0.0 109.434 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 50.8 m -163.5 -12.53 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.204 -0.935 . . . . 0.0 109.481 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.419 ' O ' ' N ' ' A' ' 29' ' ' ASP . 24.6 mtpp -51.21 123.12 8.83 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.215 -0.928 . . . . 0.0 109.545 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -68.71 68.77 0.42 Allowed Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 27' ' ' LYS . 2.0 p30 -79.85 -163.95 0.6 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.308 -1.113 . . . . 0.0 109.45 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.423 ' O ' ' OE2' ' A' ' 31' ' ' GLU . 60.5 tttp -170.46 76.87 0.08 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.31 -0.869 . . . . 0.0 109.439 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.423 ' OE2' ' O ' ' A' ' 30' ' ' LYS . 57.8 mm-40 -137.93 -41.65 0.53 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.409 -0.807 . . . . 0.0 109.206 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.582 ' N ' HD12 ' A' ' 32' ' ' LEU . 8.4 mp -75.79 -24.41 55.96 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.277 -0.89 . . . . 0.0 109.346 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.574 ' N ' HD12 ' A' ' 33' ' ' LEU . 8.4 mp -84.93 85.39 7.48 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.209 -0.932 . . . . 0.0 109.115 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 19.8 pt -75.2 155.66 6.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.241 -0.912 . . . . 0.0 109.524 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.476 ' O ' ' ND2' ' A' ' 36' ' ' ASN . 17.1 p-10 -159.7 65.35 0.37 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.228 -0.92 . . . . 0.0 109.485 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.476 ' ND2' ' O ' ' A' ' 35' ' ' ASP . 32.9 m120 -157.95 -83.79 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.275 -0.89 . . . . 0.0 109.42 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.434 ' O ' ' O ' ' A' ' 38' ' ' LYS . 24.5 tt0 59.92 19.56 8.57 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.343 -0.848 . . . . 0.0 109.36 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.434 ' O ' ' O ' ' A' ' 37' ' ' GLU . 69.6 mttt 58.38 113.7 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.288 -0.882 . . . . 0.0 109.742 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 26.8 m -53.51 176.43 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.238 -0.914 . . . . 0.0 109.446 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.535 HG22 ' N ' ' A' ' 41' ' ' SER . 53.8 m -69.4 165.42 20.84 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.26 -0.9 . . . . 0.0 109.42 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.535 ' N ' HG22 ' A' ' 40' ' ' THR . 51.6 m -157.33 -51.9 0.07 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.213 -0.93 . . . . 0.0 109.382 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 179.17 68.08 0.07 OUTLIER Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 59.3 t-80 -74.66 81.53 2.04 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.252 -1.146 . . . . 0.0 109.508 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 14.6 p 51.37 -167.93 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.18 -0.95 . . . . 0.0 109.488 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 77.4 p -68.93 99.64 1.09 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.259 -0.9 . . . . 0.0 109.428 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 57.4 p -65.98 -124.58 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.148 -0.97 . . . . 0.0 109.505 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 67.3 p -101.27 57.52 0.86 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.372 -0.83 . . . . 0.0 109.447 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -146.07 142.79 28.9 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.181 -0.949 . . . . 0.0 109.495 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -94.87 144.42 25.67 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.235 -0.916 . . . . 0.0 109.654 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.2 m 67.86 169.78 0.27 Allowed 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.472 -0.767 . . . . 0.0 110.194 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.444 ' O ' ' O ' ' A' ' 52' ' ' SER . 1.6 m -56.91 -65.15 0.66 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.267 -0.895 . . . . 0.0 109.431 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.553 ' OG ' ' N ' ' A' ' 53' ' ' LYS . 12.7 t -58.64 -157.37 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.553 ' N ' ' OG ' ' A' ' 52' ' ' SER . 89.2 tttt -122.42 100.47 6.96 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.145 -0.972 . . . . 0.0 108.612 179.02 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.588 HG13 ' O ' ' A' ' 54' ' ' VAL . 11.3 p -126.65 120.37 55.92 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.709 -0.619 . . . . 0.0 109.58 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 2.3 pt -126.4 134.15 67.06 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.53 -0.731 . . . . 0.0 109.037 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 46.8 p -132.42 114.51 14.43 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.404 -0.81 . . . . 0.0 109.384 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.569 ' H ' ' HB ' ' A' ' 69' ' ' THR . 22.1 mttt -121.47 113.06 19.3 Favored 'General case' 0 N--CA 1.513 2.686 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 29.7 p -119.76 138.29 53.42 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.638 -0.664 . . . . 0.0 109.934 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.403 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.9 m -131.47 125.69 56.93 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.135 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 48.7 p -107.77 110.39 22.19 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.7 -0.625 . . . . 0.0 110.373 -179.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.44 ' N ' ' ND2' ' A' ' 61' ' ' ASN . 1.0 OUTLIER -100.24 144.08 29.68 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.354 -0.841 . . . . 0.0 108.769 179.395 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.445 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -67.03 -32.64 73.99 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 120.047 -1.658 . . . . 0.0 112.908 -177.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -65.74 4.28 0.63 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.291 -1.505 . . . . 0.0 110.006 -178.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.445 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 95.64 6.47 59.56 Favored Glycine 0 N--CA 1.496 2.693 0 N-CA-C 110.778 -0.929 . . . . 0.0 110.778 178.405 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 60.1 ttt180 -92.94 112.31 24.23 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.677 -1.484 . . . . 0.0 107.794 178.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.5 p -138.73 113.89 9.44 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.227 -0.921 . . . . 0.0 109.769 -178.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -99.83 130.23 46.0 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.319 -0.863 . . . . 0.0 109.993 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -107.07 108.93 20.66 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.586 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.569 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 4.5 m -96.31 28.7 3.14 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 107.531 -1.285 . . . . 0.0 107.531 179.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.1 pttp -64.81 67.74 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.515 ' N ' ' O ' ' A' ' 69' ' ' THR . 50.8 mt-10 -104.26 157.09 17.37 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.312 -0.868 . . . . 0.0 110.046 -179.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.468 ' O ' HG13 ' A' ' 72' ' ' VAL . 7.4 p -128.16 125.42 64.34 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.437 ' O ' ' O ' ' A' ' 53' ' ' LYS . 79.0 t -107.19 135.44 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 CA-C-O 121.922 0.868 . . . . 0.0 109.434 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 65.1 tttt 69.9 -137.27 0.06 Allowed 'General case' 0 N--CA 1.505 2.301 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.399 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 2.7 t 52.28 71.36 0.47 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.284 -0.885 . . . . 0.0 109.28 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 62.5 mm-40 -121.06 18.02 11.65 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.58 -0.7 . . . . 0.0 109.201 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -171.22 29.04 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.257 -0.902 . . . . 0.0 109.437 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.549 ' O ' ' N ' ' A' ' 80' ' ' ASP . . . -150.47 -42.25 0.03 OUTLIER Glycine 0 N--CA 1.492 2.43 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 70.8 m 51.67 -89.48 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.38 -1.071 . . . . 0.0 108.899 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.549 ' N ' ' O ' ' A' ' 78' ' ' GLY . 59.6 t0 -83.68 42.73 0.86 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.294 -0.879 . . . . 0.0 109.085 179.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.512 ' O ' ' N ' ' A' ' 83' ' ' ASP . 6.8 m 50.1 60.89 3.5 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.138 -0.976 . . . . 0.0 108.845 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 49.8 8.06 0.12 Allowed Glycine 0 N--CA 1.49 2.291 0 N-CA-C 110.131 -1.188 . . . . 0.0 110.131 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.512 ' N ' ' O ' ' A' ' 81' ' ' CYS . 8.3 m-20 -105.97 -156.92 0.59 Allowed 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.213 -1.169 . . . . 0.0 109.435 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -171.13 -156.39 0.12 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.371 -0.83 . . . . 0.0 109.31 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -169.43 126.55 0.92 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.306 -0.871 . . . . 0.0 109.455 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 66.9 t80 52.28 92.72 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.27 -0.894 . . . . 0.0 109.399 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -51.34 143.42 11.52 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.248 -0.908 . . . . 0.0 109.513 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 6.2 m-90 -58.9 -56.41 22.64 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.196 -0.94 . . . . 0.0 109.467 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.563 ' CG ' ' H ' ' A' ' 90' ' ' HIS . 54.9 t-80 -58.54 179.12 0.09 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.297 -0.877 . . . . 0.0 109.345 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.563 ' H ' ' CG ' ' A' ' 89' ' ' HIS . 2.1 p80 -166.64 143.93 4.97 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.205 -0.934 . . . . 0.0 109.636 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.445 ' OG1' ' N ' ' A' ' 92' ' ' PHE . 82.7 p -48.59 -84.23 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.251 -0.906 . . . . 0.0 109.505 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.445 ' N ' ' OG1' ' A' ' 91' ' ' THR . 84.6 t80 51.43 68.12 3.58 Favored Pre-proline 0 N--CA 1.491 1.594 0 O-C-N 121.239 -0.913 . . . . 0.0 109.607 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -62.14 146.18 96.14 Favored 'Trans proline' 0 C--N 1.317 -1.121 0 C-N-CA 121.429 1.42 . . . . 0.0 109.805 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 31.0 t -172.26 67.96 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.267 -0.896 . . . . 0.0 109.409 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 20.9 tpt180 -61.18 -19.79 61.99 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.338 -0.851 . . . . 0.0 109.289 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.464 ' O ' ' N ' ' A' ' 98' ' ' LEU . . . -165.05 -59.29 0.02 OUTLIER Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.584 -1.407 . . . . 0.0 109.584 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.569 ' N ' HD22 ' A' ' 97' ' ' ASN . 1.5 m120 51.01 -93.91 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.267 -1.137 . . . . 0.0 109.509 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.464 ' N ' ' O ' ' A' ' 96' ' ' GLY . 55.5 tp -63.82 78.69 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.256 -0.903 . . . . 0.0 109.286 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.469 ' N ' ' O ' ' A' ' 97' ' ' ASN . 22.5 m-20 -74.85 53.72 0.6 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.301 -0.874 . . . . 0.0 109.45 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -78.74 -3.67 45.46 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.301 -0.874 . . . . 0.0 109.352 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.419 ' O ' ' N ' ' A' ' 103' ' ' HIS . 57.0 t80 -66.36 -55.72 14.55 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.279 -0.888 . . . . 0.0 109.525 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -59.03 88.91 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.174 -0.954 . . . . 0.0 109.432 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.465 ' O ' ' ND1' ' A' ' 103' ' ' HIS . 0.8 OUTLIER -71.22 -26.09 62.78 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.162 -0.961 . . . . 0.0 109.284 179.981 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.416 ' O ' ' O ' ' A' ' 103' ' ' HIS . 44.3 mtp180 50.99 -178.96 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.304 -0.872 . . . . 0.0 109.495 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -157.98 4.63 0.12 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.289 -0.882 . . . . 0.0 109.384 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.429 ' C ' ' H ' ' A' ' 108' ' ' ASP . 58.8 mttp -59.53 -21.43 60.21 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.26 -0.9 . . . . 0.0 109.472 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -66.65 3.17 1.07 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.234 -0.916 . . . . 0.0 109.438 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.429 ' H ' ' C ' ' A' ' 106' ' ' LYS . 15.2 t70 -64.32 125.87 25.97 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.168 -0.957 . . . . 0.0 109.491 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -74.28 0.71 13.4 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.26 -0.9 . . . . 0.0 109.496 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 75.6 t80 51.57 91.57 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.235 -0.915 . . . . 0.0 109.431 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 67.1 p -72.84 165.56 24.66 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.216 -0.928 . . . . 0.0 109.502 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.585 ' CG ' HH11 ' A' ' 112' ' ' ARG . 0.0 OUTLIER -169.38 138.77 2.04 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.274 -0.891 . . . . 0.0 109.506 -179.995 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 61.2 p -168.69 81.22 0.15 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.296 -0.877 . . . . 0.0 109.505 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 50.7 m -62.09 162.28 9.67 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.242 -0.911 . . . . 0.0 109.384 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 25.1 m-70 -60.19 108.87 0.85 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.253 -0.904 . . . . 0.0 109.434 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -56.36 -58.74 6.73 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.319 -0.863 . . . . 0.0 109.43 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -61.15 -74.22 0.08 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.232 -0.918 . . . . 0.0 109.521 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.455 ' N ' ' OD1' ' A' ' 118' ' ' ASP . 1.5 m-20 -72.52 -137.51 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.182 -0.949 . . . . 0.0 109.485 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 69.49 138.9 0.11 Allowed Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -71.53 -179.51 2.57 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.237 -1.155 . . . . 0.0 109.461 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.424 ' O ' ' N ' ' A' ' 123' ' ' LEU . 71.4 p -73.98 2.48 8.6 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.279 -0.888 . . . . 0.0 109.571 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 61.49 -85.57 0.03 OUTLIER Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.384 -1.486 . . . . 0.0 109.384 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.424 ' N ' ' O ' ' A' ' 121' ' ' THR . 24.7 mt -64.03 143.09 58.13 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.187 -1.184 . . . . 0.0 109.076 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.533 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -81.14 163.0 57.29 Favored Pre-proline 0 N--CA 1.492 1.626 0 O-C-N 121.17 -0.956 . . . . 0.0 108.87 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.533 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 1.1 Cg_endo -58.28 1.67 0.24 Allowed 'Trans proline' 0 C--N 1.319 -0.986 0 C-N-CA 121.414 1.409 . . . . 0.0 110.203 179.523 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.532 ' O ' ' CG ' ' A' ' 127' ' ' PHE . 74.4 mt-10 52.4 -100.56 0.1 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.183 -0.948 . . . . 0.0 109.489 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . 0.532 ' CG ' ' O ' ' A' ' 126' ' ' GLU . 97.4 m-85 -157.9 75.47 0.76 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.199 -0.938 . . . . 0.0 109.347 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -168.67 -156.99 0.18 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.241 -0.912 . . . . 0.0 109.511 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -167.96 -11.89 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.298 -0.876 . . . . 0.0 109.399 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 10.8 tp 53.41 95.48 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.187 -0.945 . . . . 0.0 109.381 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -177.11 -45.53 0.06 OUTLIER Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 53.92 67.76 0.96 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.228 -1.16 . . . . 0.0 109.453 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 40.0 t -70.81 166.17 21.59 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.2 -0.937 . . . . 0.0 109.538 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 64.14 89.08 0.04 OUTLIER Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.566 -1.413 . . . . 0.0 109.566 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . 0.412 ' OG ' ' N ' ' A' ' 136' ' ' SER . 41.2 t -68.16 -149.89 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.302 -1.116 . . . . 0.0 109.444 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.427 ' O ' ' N ' ' A' ' 138' ' ' SER . 87.7 p -169.66 -28.82 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.236 -0.915 . . . . 0.0 109.508 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 51.8 m -68.71 68.76 0.15 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.263 -0.898 . . . . 0.0 109.476 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.427 ' N ' ' O ' ' A' ' 136' ' ' SER . 72.9 m -166.47 -99.54 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.299 -0.876 . . . . 0.0 109.477 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -170.35 142.77 2.22 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.266 -0.896 . . . . 0.0 109.496 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 13.4 m -165.35 63.13 0.12 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.205 -0.934 . . . . 0.0 109.401 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 48.2 t -76.55 -28.22 56.2 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.237 -0.914 . . . . 0.0 109.536 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 1.4 t -170.12 158.41 6.93 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.242 -0.911 . . . . 0.0 109.376 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 75.8 m80 -65.92 -33.03 74.89 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.287 -0.883 . . . . 0.0 109.482 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 45.0 t -62.06 146.28 50.77 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.203 -0.935 . . . . 0.0 109.468 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -170.38 -13.39 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.257 -0.902 . . . . 0.0 109.418 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -67.95 78.78 0.22 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.254 -0.904 . . . . 0.0 109.431 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . 0.476 ' CD1' ' O ' ' A' ' 147' ' ' PHE . 40.6 p90 -73.32 134.37 44.13 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.328 -0.858 . . . . 0.0 109.427 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 33.2 t -76.17 138.99 19.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.256 -0.903 . . . . 0.0 109.494 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 26.1 t -172.4 22.59 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.263 -0.898 . . . . 0.0 109.413 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 49.9 m -71.18 -58.78 3.22 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.307 -0.87 . . . . 0.0 109.465 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 48.3 t -64.12 134.92 55.81 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.216 -0.927 . . . . 0.0 109.501 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 47.1 p -69.67 -145.54 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.181 -0.95 . . . . 0.0 109.488 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 61.3 p -98.74 -141.68 0.31 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.293 -0.879 . . . . 0.0 109.15 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 23.0 t -65.91 -63.39 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.25 -0.907 . . . . 0.0 109.261 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 2.0 m120 56.2 -114.36 0.84 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.423 -0.798 . . . . 0.0 109.462 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -74.91 -103.35 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.13 -0.981 . . . . 0.0 109.446 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -172.01 -93.59 0.09 OUTLIER Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -169.82 85.52 0.09 OUTLIER Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 44.9 t 50.88 -104.22 0.16 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.321 -1.105 . . . . 0.0 109.498 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . 53.29 53.14 12.25 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.283 -0.886 . . . . 0.0 109.426 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . 0.4 HG23 ' N ' ' A' ' 162' ' ' GLU . 6.8 tp -72.12 -35.32 52.92 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.268 -0.895 . . . . 0.0 109.248 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.4 ' N ' HG23 ' A' ' 161' ' ' ILE . 65.1 mm-40 51.7 76.58 0.17 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.285 -0.884 . . . . 0.0 109.447 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 52.0 m -165.69 113.1 0.94 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.26 -0.9 . . . . 0.0 109.397 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 15.3 tptp -69.1 -46.38 67.85 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.218 -0.926 . . . . 0.0 109.388 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . 0.524 ' O ' ' CG ' ' A' ' 166' ' ' PHE . 3.5 m-70 -62.7 -80.0 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.247 -0.908 . . . . 0.0 109.509 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' PHE . . . . . 0.524 ' CG ' ' O ' ' A' ' 165' ' ' HIS . 97.8 m-85 . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 118.034 -0.984 . . . . 0.0 109.397 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.7 mtt . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.424 ' O ' ' O ' ' A' ' 3' ' ' THR . . . 178.42 -135.71 2.73 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.424 ' O ' ' O ' ' A' ' 2' ' ' GLY . 11.9 m 55.29 103.47 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.249 -1.148 . . . . 0.0 109.53 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -158.33 -4.74 0.08 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.278 -0.889 . . . . 0.0 109.518 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.415 ' HG3' HH11 ' A' ' 5' ' ' ARG . 27.3 ttm-85 -65.75 -19.31 65.85 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.338 -0.851 . . . . 0.0 109.415 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -74.46 79.34 1.92 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.313 -0.867 . . . . 0.0 109.372 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -59.92 -38.62 82.85 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.258 -0.901 . . . . 0.0 109.462 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 64.69 53.49 34.52 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.6 t -171.28 146.4 2.33 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.258 -1.142 . . . . 0.0 109.474 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.8 p -168.62 136.49 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.301 -0.875 . . . . 0.0 109.48 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 43.6 t -77.54 133.15 38.58 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.197 -0.939 . . . . 0.0 109.473 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.3 t -71.64 -8.02 51.45 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.24 -0.912 . . . . 0.0 109.46 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 69.08 17.84 72.28 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.445 -1.462 . . . . 0.0 109.445 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.9 t -66.42 -177.13 0.51 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.244 -1.151 . . . . 0.0 109.406 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 77.5 tttt 56.37 -124.38 1.89 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.192 -0.943 . . . . 0.0 109.262 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 51.4 52.6 14.43 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.086 -1.009 . . . . 0.0 109.436 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.427 ' O ' ' O ' ' A' ' 18' ' ' PHE . 72.2 mm-40 -72.06 -27.77 62.9 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.283 -0.885 . . . . 0.0 109.565 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.427 ' O ' ' O ' ' A' ' 17' ' ' GLU . 40.8 t80 59.33 150.01 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.556 -0.715 . . . . 0.0 109.739 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 51.8 m80 -78.83 163.92 24.92 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.275 -0.89 . . . . 0.0 109.51 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 6.3 t -73.32 -11.12 60.38 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.225 -0.922 . . . . 0.0 109.427 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -170.15 173.89 44.2 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -70.91 153.6 42.55 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.231 -1.158 . . . . 0.0 109.46 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 18.0 mt -140.35 -172.25 3.39 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.391 -0.818 . . . . 0.0 109.156 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 34.6 t -64.19 101.94 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.269 -0.894 . . . . 0.0 109.481 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 37.8 m -165.33 111.02 0.91 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.253 -0.904 . . . . 0.0 109.52 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.434 ' C ' ' H ' ' A' ' 28' ' ' GLY . 76.9 p -81.11 116.54 21.08 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.27 -0.894 . . . . 0.0 109.389 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -75.43 36.6 0.13 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.333 -0.854 . . . . 0.0 109.636 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.459 ' C ' ' H ' ' A' ' 30' ' ' LYS . . . 76.89 150.92 3.85 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.537 -1.425 . . . . 0.0 109.537 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.27 28.35 0.12 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.177 -1.19 . . . . 0.0 109.457 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.459 ' H ' ' C ' ' A' ' 28' ' ' GLY . 96.1 mttt -62.26 127.22 30.34 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.287 -0.883 . . . . 0.0 109.403 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -167.59 -153.16 0.13 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.195 -0.941 . . . . 0.0 109.095 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.508 ' N ' HD12 ' A' ' 32' ' ' LEU . 11.0 mp -86.21 8.67 20.22 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.093 -1.004 . . . . 0.0 109.168 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.571 ' N ' HD12 ' A' ' 33' ' ' LEU . 8.8 mp 52.07 99.86 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.269 -0.894 . . . . 0.0 109.376 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.426 ' O ' ' O ' ' A' ' 33' ' ' LEU . 20.3 pt -51.8 -178.46 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.193 -0.942 . . . . 0.0 109.424 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -157.33 -9.92 0.09 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.253 -0.904 . . . . 0.0 109.47 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.682 HD22 ' N ' ' A' ' 37' ' ' GLU . 0.0 OUTLIER -58.29 -18.82 29.68 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.218 -0.926 . . . . 0.0 109.426 -179.955 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.682 ' N ' HD22 ' A' ' 36' ' ' ASN . 18.2 tp10 49.01 65.13 1.46 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.302 -0.874 . . . . 0.0 109.603 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 59.9 mttm -75.0 162.43 28.58 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.227 -0.921 . . . . 0.0 109.453 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 30.2 m -58.94 139.17 19.03 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.154 -0.966 . . . . 0.0 109.505 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 4.6 m -69.46 -126.58 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.222 -0.924 . . . . 0.0 109.284 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 42.3 t -62.18 173.0 1.24 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.124 -0.985 . . . . 0.0 109.397 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -179.83 -17.14 0.03 OUTLIER Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.447 ' O ' ' CG ' ' A' ' 43' ' ' HIS . 26.6 p-80 -171.08 102.59 0.21 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.235 -1.156 . . . . 0.0 109.509 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 58.5 m -154.79 129.66 9.4 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.289 -0.882 . . . . 0.0 109.388 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 26.6 m 52.5 87.72 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.206 -0.934 . . . . 0.0 109.401 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 82.1 p -149.54 72.69 1.15 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.271 -0.893 . . . . 0.0 109.336 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 50.5 p -81.78 110.83 17.46 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.232 -0.917 . . . . 0.0 109.358 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 79.2 mtt180 -142.67 142.53 32.06 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.31 -0.869 . . . . 0.0 109.345 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -89.69 138.69 31.26 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.338 -0.851 . . . . 0.0 109.831 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.3 m 57.97 174.22 0.06 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.364 -0.835 . . . . 0.0 109.969 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 39.1 t -59.53 -75.4 0.06 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.347 -0.845 . . . . 0.0 109.511 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 3.0 t -47.17 141.12 4.66 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.204 -0.935 . . . . 0.0 109.191 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -73.92 103.51 4.46 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 120.998 -1.064 . . . . 0.0 109.599 -179.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.596 HG13 ' O ' ' A' ' 54' ' ' VAL . 10.7 p -126.57 118.08 49.99 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.776 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.545 HG23 ' O ' ' A' ' 55' ' ' ILE . 6.6 tt -126.99 122.45 60.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.531 -0.731 . . . . 0.0 109.125 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 17.9 m -129.21 111.86 13.33 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.437 -0.789 . . . . 0.0 109.671 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.526 ' H ' ' HB ' ' A' ' 69' ' ' THR . 31.1 mmtt -126.03 113.35 17.0 Favored 'General case' 0 N--CA 1.515 2.775 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 178.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 96.6 m -110.3 125.03 52.72 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.533 -0.729 . . . . 0.0 109.489 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.4 m -132.49 119.98 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.3 m -109.52 133.68 52.8 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.713 -0.617 . . . . 0.0 109.842 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -125.24 159.01 32.65 Favored 'General case' 0 N--CA 1.516 2.861 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.88 -33.96 68.78 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 120.538 -1.351 . . . . 0.0 112.477 -177.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.508 ' OD2' ' NH2' ' A' ' 65' ' ' ARG . 11.6 p30 -70.69 2.34 4.25 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.445 -1.409 . . . . 0.0 110.411 -178.417 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 98.32 1.07 58.09 Favored Glycine 0 N--CA 1.494 2.525 0 N-CA-C 109.629 -1.388 . . . . 0.0 109.629 179.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.508 ' NH2' ' OD2' ' A' ' 63' ' ' ASP . 1.3 mpp_? -76.8 85.55 3.4 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 178.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 93.4 m -122.18 93.35 3.96 Favored 'General case' 0 N--CA 1.492 1.665 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 -178.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -100.0 129.78 46.1 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.427 -0.796 . . . . 0.0 109.909 -179.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 40.1 p -106.04 109.76 21.81 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.413 -0.804 . . . . 0.0 109.609 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.526 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 3.5 m -88.95 30.5 0.93 Allowed 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 178.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.404 ' CB ' ' NZ ' ' A' ' 70' ' ' LYS . 0.3 OUTLIER -66.75 58.12 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 109.02 -0.734 . . . . 0.0 109.02 179.623 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.501 ' N ' ' O ' ' A' ' 69' ' ' THR . 79.8 mt-10 -101.07 141.45 33.94 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.221 -0.925 . . . . 0.0 109.833 -179.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.404 HG13 ' O ' ' A' ' 72' ' ' VAL . 7.7 p -128.17 131.53 69.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 15.7 t -129.87 116.05 36.13 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.942 0 CA-C-O 122.146 0.974 . . . . 0.0 109.418 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.39 174.72 2.55 Favored 'General case' 0 C--N 1.288 -2.067 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.42 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 75.8 m -64.91 -174.67 0.15 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.306 -0.871 . . . . 0.0 109.421 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -61.81 -62.98 1.42 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.275 -0.891 . . . . 0.0 109.306 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 18.3 p-10 -159.1 22.96 0.2 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.273 -0.892 . . . . 0.0 109.511 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 83.07 29.91 32.82 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.308 -1.517 . . . . 0.0 109.308 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 39.2 t -77.24 -25.0 51.12 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.317 -1.108 . . . . 0.0 109.388 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 44.5 m-20 -157.51 60.94 0.49 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.354 -0.841 . . . . 0.0 109.398 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 39.1 t -170.93 66.82 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.18 -0.95 . . . . 0.0 109.08 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 83.21 43.67 7.39 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.319 -1.513 . . . . 0.0 109.319 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.417 ' O ' ' OD1' ' A' ' 83' ' ' ASP . 19.6 p30 -66.3 81.34 0.09 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.281 -1.129 . . . . 0.0 109.535 -179.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -172.46 -174.04 1.13 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.295 -0.878 . . . . 0.0 109.435 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -59.47 141.07 55.57 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.312 -0.867 . . . . 0.0 109.34 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -168.83 -49.54 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.233 -0.917 . . . . 0.0 109.422 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 42.7 t0 52.49 -120.17 1.63 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.222 -0.924 . . . . 0.0 109.361 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 64.1 t-105 53.71 55.25 8.74 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.175 -0.953 . . . . 0.0 109.453 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.502 ' C ' ' H ' ' A' ' 91' ' ' THR . 15.8 t-160 -72.92 46.39 0.16 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.22 -0.925 . . . . 0.0 109.44 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.448 ' O ' ' ND1' ' A' ' 90' ' ' HIS . 0.8 OUTLIER 56.7 2.32 0.1 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.372 -0.83 . . . . 0.0 109.741 -179.875 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.502 ' H ' ' C ' ' A' ' 89' ' ' HIS . 2.6 m -52.61 164.37 0.35 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.228 -0.92 . . . . 0.0 109.217 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.501 ' N ' ' CD1' ' A' ' 92' ' ' PHE . 10.4 p90 -150.6 70.09 8.79 Favored Pre-proline 0 N--CA 1.494 1.756 0 O-C-N 121.206 -0.934 . . . . 0.0 109.559 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -63.97 120.56 7.96 Favored 'Trans proline' 0 C--N 1.316 -1.132 0 C-N-CA 121.519 1.479 . . . . 0.0 109.85 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 30.9 t -171.86 18.59 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.209 -0.932 . . . . 0.0 109.599 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 31.8 ptt180 -72.02 136.92 46.86 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.168 -0.958 . . . . 0.0 109.406 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.456 ' C ' ' H ' ' A' ' 98' ' ' LEU . . . 162.46 34.04 0.02 OUTLIER Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.381 -1.488 . . . . 0.0 109.381 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.747 ' H ' HD22 ' A' ' 97' ' ' ASN . 0.8 OUTLIER -69.58 8.49 0.64 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.36 -1.082 . . . . 0.0 109.314 179.931 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.488 HD13 ' N ' ' A' ' 99' ' ' ASP . 0.3 OUTLIER -68.13 114.22 6.45 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.389 -0.819 . . . . 0.0 109.177 -179.964 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.488 ' N ' HD13 ' A' ' 98' ' ' LEU . 0.8 OUTLIER -49.1 -68.27 0.19 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.238 -0.914 . . . . 0.0 109.489 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.425 ' N ' ' OD1' ' A' ' 100' ' ' ASP . 26.1 p-10 -165.11 126.82 2.08 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.242 -0.911 . . . . 0.0 109.485 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.548 ' CD2' ' N ' ' A' ' 102' ' ' PHE . 24.3 p90 -77.35 -47.53 19.67 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.284 -0.885 . . . . 0.0 109.505 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.548 ' N ' ' CD2' ' A' ' 101' ' ' PHE . 65.0 t80 48.76 73.7 0.21 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.253 -0.905 . . . . 0.0 109.569 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 37.4 m80 -74.26 -23.23 59.1 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.165 -0.959 . . . . 0.0 109.361 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.422 ' O ' ' CE2' ' A' ' 102' ' ' PHE . 67.6 ttt180 -61.04 155.2 20.8 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.289 -0.882 . . . . 0.0 109.49 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -166.56 79.24 0.23 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.288 -0.882 . . . . 0.0 109.392 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -72.4 98.31 2.22 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.285 -0.884 . . . . 0.0 109.453 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.469 ' OD1' ' N ' ' A' ' 107' ' ' ASP . 1.4 m-20 51.68 -128.31 2.37 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.242 -0.911 . . . . 0.0 109.462 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -157.18 138.55 13.8 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.255 -0.903 . . . . 0.0 109.36 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -73.47 -29.9 62.82 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.317 -0.864 . . . . 0.0 109.532 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -56.13 108.62 0.48 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.287 -0.883 . . . . 0.0 109.51 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 76.6 p -69.5 -10.27 57.38 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.252 -0.905 . . . . 0.0 109.425 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.583 ' CG ' HH11 ' A' ' 112' ' ' ARG . 0.3 OUTLIER -56.85 -37.47 71.31 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.205 -0.934 . . . . 0.0 109.458 179.984 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.408 ' O ' ' OG ' ' A' ' 114' ' ' SER . 65.2 m -71.79 164.01 26.77 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.284 -0.885 . . . . 0.0 109.455 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.408 ' OG ' ' O ' ' A' ' 113' ' ' SER . 26.1 p 52.32 61.87 2.98 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.216 -0.928 . . . . 0.0 109.497 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . 0.461 ' C ' ' H ' ' A' ' 117' ' ' PHE . 2.3 t60 -168.49 -38.4 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.275 -0.89 . . . . 0.0 109.459 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.519 ' O ' ' CG ' ' A' ' 117' ' ' PHE . 19.7 mm-40 -75.77 28.16 0.11 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.323 -0.861 . . . . 0.0 109.467 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.519 ' CG ' ' O ' ' A' ' 116' ' ' GLU . 97.2 m-85 -158.19 114.2 2.75 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.192 -0.943 . . . . 0.0 109.462 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -68.51 62.63 0.1 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.243 -0.911 . . . . 0.0 109.365 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.448 ' N ' ' O ' ' A' ' 117' ' ' PHE . . . -70.78 -160.35 3.44 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.449 -1.46 . . . . 0.0 109.449 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 37.8 ttp180 52.43 85.92 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.274 -1.133 . . . . 0.0 109.416 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 82.6 p -68.75 86.12 0.32 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.219 -0.926 . . . . 0.0 109.557 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -63.82 -112.42 0.01 OUTLIER Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.588 ' N ' HD12 ' A' ' 123' ' ' LEU . 8.1 mp -67.02 127.46 32.65 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.249 -1.148 . . . . 0.0 109.265 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.543 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -73.69 162.49 73.94 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.208 -0.933 . . . . 0.0 108.764 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.543 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 2.5 Cg_endo -55.88 148.64 55.67 Favored 'Trans proline' 0 C--N 1.319 -0.989 0 C-N-CA 121.287 1.325 . . . . 0.0 109.707 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -139.9 110.22 6.6 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.303 -0.873 . . . . 0.0 109.421 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -135.92 110.77 8.75 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.42 -0.8 . . . . 0.0 109.389 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -71.28 95.41 1.3 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.268 -0.895 . . . . 0.0 109.367 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -68.02 117.68 10.2 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.228 -0.92 . . . . 0.0 109.534 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 13.5 mt 53.12 -160.37 0.12 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.314 -0.867 . . . . 0.0 109.587 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -176.09 164.48 34.49 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.589 -1.405 . . . . 0.0 109.589 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.413 ' O ' ' OG ' ' A' ' 133' ' ' SER . 64.3 mm-40 -62.91 -55.46 25.79 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.216 -1.167 . . . . 0.0 109.492 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . 0.413 ' OG ' ' O ' ' A' ' 132' ' ' GLU . 27.6 p 52.13 62.8 2.51 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.227 -0.92 . . . . 0.0 109.488 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -175.53 67.34 0.09 OUTLIER Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 41.6 t -65.86 104.9 1.17 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.279 -1.13 . . . . 0.0 109.437 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.451 ' C ' ' H ' ' A' ' 138' ' ' SER . 41.7 t -65.11 -30.11 71.03 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.267 -0.895 . . . . 0.0 109.413 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 94.0 p -75.66 22.15 0.14 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.229 -0.919 . . . . 0.0 109.433 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.451 ' H ' ' C ' ' A' ' 136' ' ' SER . 69.2 m -165.57 82.85 0.33 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.243 -0.911 . . . . 0.0 109.469 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -170.46 76.88 0.08 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.269 -0.894 . . . . 0.0 109.455 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 73.3 p -67.89 85.86 0.23 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.259 -0.901 . . . . 0.0 109.479 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . 0.423 ' O ' ' O ' ' A' ' 142' ' ' THR . 41.1 t -68.29 -70.85 0.24 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.295 -0.878 . . . . 0.0 109.476 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . 0.423 ' O ' ' O ' ' A' ' 141' ' ' SER . 6.0 m 57.5 162.0 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.339 -0.85 . . . . 0.0 109.513 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 25.2 p80 -170.23 21.12 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.279 -0.888 . . . . 0.0 109.464 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 49.2 m -72.53 -0.35 12.51 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.298 -0.876 . . . . 0.0 109.418 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 91.3 mttt 52.49 55.47 9.05 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.265 -0.897 . . . . 0.0 109.418 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -65.08 -31.27 72.39 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.276 -0.89 . . . . 0.0 109.434 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -65.47 133.79 52.03 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.322 -0.861 . . . . 0.0 109.505 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 8.6 p -170.03 150.34 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.299 -0.876 . . . . 0.0 109.414 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 31.4 t -171.43 -106.87 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.23 -0.919 . . . . 0.0 109.391 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 26.8 p 50.6 34.87 10.36 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.224 -0.922 . . . . 0.0 109.533 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 30.6 t -169.23 86.24 0.15 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.314 -0.866 . . . . 0.0 109.289 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 26.9 m -62.0 -54.71 37.73 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.294 -0.879 . . . . 0.0 109.458 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . 0.516 ' OG1' ' N ' ' A' ' 154' ' ' VAL . 4.3 t -172.98 -140.34 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.272 -0.892 . . . . 0.0 109.512 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.516 ' N ' ' OG1' ' A' ' 153' ' ' THR . 11.5 m -145.53 161.01 12.44 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 O-C-N 121.303 -0.873 . . . . 0.0 109.035 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . 0.432 ' ND2' HG23 ' A' ' 154' ' ' VAL . 15.5 p30 40.28 63.15 1.15 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.719 -0.613 . . . . 0.0 110.09 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 94.0 mtt180 42.55 -125.64 0.71 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.554 -0.716 . . . . 0.0 110.044 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -148.5 -137.15 2.81 Favored Glycine 0 N--CA 1.494 2.533 0 N-CA-C 109.414 -1.475 . . . . 0.0 109.414 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 76.9 -133.51 13.59 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.539 -1.424 . . . . 0.0 109.539 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 33.8 t -165.45 -29.62 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.271 -1.135 . . . . 0.0 109.469 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -151.87 -19.91 0.19 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.284 -0.885 . . . . 0.0 109.37 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 18.8 tt -60.11 -8.08 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.222 -0.924 . . . . 0.0 109.373 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 55.4 tt0 -47.71 -70.75 0.08 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.29 -0.881 . . . . 0.0 109.679 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 87.8 p -168.49 -40.49 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.291 -0.88 . . . . 0.0 109.483 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -53.08 107.77 0.26 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.202 -0.936 . . . . 0.0 109.522 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 47.0 m80 -67.04 -48.28 68.82 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.205 -0.934 . . . . 0.0 109.491 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 52.1 t80 . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 118.041 -0.981 . . . . 0.0 109.492 -179.977 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.3 mtt . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 121.28 0.562 . . . . 0.0 109.525 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -67.0 143.19 42.9 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 61.6 p -67.59 -161.78 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.225 -1.162 . . . . 0.0 109.437 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -69.71 -109.64 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.227 -0.92 . . . . 0.0 109.483 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -170.99 -53.15 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.269 -0.895 . . . . 0.0 109.476 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.553 ' H ' ' CD ' ' A' ' 6' ' ' GLU . 13.5 mp0 -58.68 -41.79 87.02 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.242 -0.911 . . . . 0.0 109.514 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 57.4 mt-10 -66.13 158.91 27.39 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.286 -0.884 . . . . 0.0 109.412 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 70.89 121.83 0.05 OUTLIER Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.5 m 52.85 80.57 0.1 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.141 -1.211 . . . . 0.0 109.52 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.7 p -71.49 149.3 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 O-C-N 121.31 -0.869 . . . . 0.0 109.503 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 29.4 t -169.46 49.73 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.181 -0.95 . . . . 0.0 109.39 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 21.8 m -65.99 -144.64 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.221 -0.924 . . . . 0.0 109.317 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -169.09 -121.26 0.57 Allowed Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.8 t -60.88 142.65 56.08 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.266 -1.138 . . . . 0.0 109.46 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.429 ' O ' ' O ' ' A' ' 16' ' ' GLN . 92.6 mttt -75.19 -142.36 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.23 -0.919 . . . . 0.0 109.452 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.429 ' O ' ' O ' ' A' ' 15' ' ' LYS . 4.1 pt20 -60.85 -151.29 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.362 -0.836 . . . . 0.0 109.289 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -59.16 -38.74 80.47 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.023 -1.048 . . . . 0.0 109.646 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.405 ' CE2' ' CE1' ' A' ' 19' ' ' HIS . 9.9 t80 62.18 -146.3 0.39 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.341 -0.849 . . . . 0.0 109.275 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.435 ' N ' ' ND1' ' A' ' 19' ' ' HIS . 0.4 OUTLIER -63.8 -45.36 90.02 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.213 -0.93 . . . . 0.0 109.45 -179.879 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.422 ' O ' ' O ' ' A' ' 21' ' ' GLY . 37.1 m -165.29 -23.89 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.257 -0.902 . . . . 0.0 109.541 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.422 ' O ' ' O ' ' A' ' 20' ' ' THR . . . 62.3 132.02 0.01 OUTLIER Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.5 ttmt -166.86 -32.7 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.249 -1.148 . . . . 0.0 109.528 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 16.8 mt -85.09 111.65 19.95 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.263 -0.898 . . . . 0.0 109.225 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 30.1 m -75.9 -176.84 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.251 -0.906 . . . . 0.0 109.824 -179.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 60.1 p -44.33 106.42 0.07 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.524 -0.735 . . . . 0.0 109.906 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 47.5 m -78.42 104.07 8.77 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.322 -0.861 . . . . 0.0 109.502 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.5 mmtm -76.75 -177.75 4.46 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.243 -0.911 . . . . 0.0 109.44 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 175.91 49.22 0.06 OUTLIER Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.329 -1.508 . . . . 0.0 109.329 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -79.14 122.6 26.46 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.32 -1.106 . . . . 0.0 109.703 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 31.9 mttm -151.75 -170.89 3.78 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.38 -0.825 . . . . 0.0 108.982 179.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -160.2 -15.75 0.05 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.397 -0.814 . . . . 0.0 109.091 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.7 mt -57.64 -41.11 80.73 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.31 -0.869 . . . . 0.0 109.437 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 18.5 mt -69.87 -51.24 34.99 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.247 -0.908 . . . . 0.0 109.467 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.642 ' N ' HD12 ' A' ' 34' ' ' ILE . 1.5 mp -72.86 150.01 8.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.26 -0.9 . . . . 0.0 108.805 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.7 t70 53.75 90.45 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.239 -0.913 . . . . 0.0 109.455 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -70.57 -81.02 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.262 -0.899 . . . . 0.0 109.494 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 65.7 tt0 -170.19 -13.38 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.239 -0.913 . . . . 0.0 109.511 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 53.4 pttt -52.87 165.86 0.26 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.238 -0.914 . . . . 0.0 109.515 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 20.9 m -153.42 -164.99 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.253 -0.904 . . . . 0.0 109.306 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 63.5 p -65.93 -175.89 0.34 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.186 -0.946 . . . . 0.0 109.535 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.466 ' C ' ' H ' ' A' ' 43' ' ' HIS . 67.5 p -169.68 14.84 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.254 -0.904 . . . . 0.0 109.507 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -75.06 20.89 1.8 Allowed Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.466 ' H ' ' C ' ' A' ' 41' ' ' SER . 67.9 m-70 -72.83 -30.88 64.38 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.239 -1.154 . . . . 0.0 109.347 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 26.8 m -72.48 110.74 7.09 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.276 -0.89 . . . . 0.0 109.47 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.487 HG23 ' H ' ' A' ' 46' ' ' THR . 0.1 OUTLIER -68.91 -90.48 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.303 -0.873 . . . . 0.0 109.448 -179.974 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.487 ' H ' HG23 ' A' ' 45' ' ' THR . 5.3 t -77.03 150.68 35.78 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.232 -0.917 . . . . 0.0 109.375 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 67.7 p -77.56 146.63 36.16 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.172 -0.955 . . . . 0.0 109.594 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -145.8 164.85 30.59 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.254 -0.904 . . . . 0.0 109.156 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.435 ' O ' ' O ' ' A' ' 50' ' ' SER . 44.6 ttm180 -87.86 132.08 34.32 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.185 -0.947 . . . . 0.0 109.599 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.435 ' O ' ' O ' ' A' ' 49' ' ' ARG . 73.3 m -45.98 -94.48 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.337 -0.852 . . . . 0.0 109.876 -179.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 1.9 t -58.28 162.51 3.55 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.247 -0.908 . . . . 0.0 109.315 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.59 ' N ' ' SG ' ' A' ' 81' ' ' CYS . 4.5 p 61.82 152.4 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.25 -0.906 . . . . 0.0 109.492 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -95.71 112.33 24.07 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.323 -0.861 . . . . 0.0 109.08 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 96.6 t -126.94 116.4 44.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.489 -0.757 . . . . 0.0 109.358 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.496 ' O ' HD12 ' A' ' 55' ' ' ILE . 2.4 pp -127.81 121.64 56.98 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 67.9 p -130.74 112.61 13.23 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.355 -0.84 . . . . 0.0 109.625 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.5 ' H ' ' HB ' ' A' ' 69' ' ' THR . 0.7 OUTLIER -123.38 111.51 16.45 Favored 'General case' 0 N--CA 1.51 2.549 0 N-CA-C 108.72 -0.845 . . . . 0.0 108.72 178.791 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 70.4 p -120.63 126.13 49.49 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.604 -0.685 . . . . 0.0 109.198 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.538 HG23 ' O ' ' A' ' 59' ' ' VAL . 2.8 m -131.71 118.68 39.49 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.214 0 O-C-N 121.399 -0.813 . . . . 0.0 109.476 179.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 69.3 p -113.48 135.72 53.58 Favored 'General case' 0 N--CA 1.499 1.979 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.647 ' ND2' ' H ' ' A' ' 62' ' ' ALA . 4.5 t-20 -164.52 165.05 21.61 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.651 -1.281 . . . . 0.0 110.25 179.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.647 ' H ' ' ND2' ' A' ' 61' ' ' ASN . . . -74.81 -11.42 60.14 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 120.97 -1.081 . . . . 0.0 111.189 -179.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -74.71 8.95 2.05 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.122 -0.986 . . . . 0.0 109.591 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.42 10.08 84.0 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 108.9 -1.68 . . . . 0.0 108.9 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -91.7 97.2 10.87 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.059 -1.259 . . . . 0.0 108.705 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 48.4 p -129.79 66.12 1.48 Allowed 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 107.659 -1.238 . . . . 0.0 107.659 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -94.15 122.04 36.27 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.688 0.756 . . . . 0.0 111.195 -177.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.2 p -101.29 111.55 23.8 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 178.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.515 ' O ' ' N ' ' A' ' 71' ' ' GLU . 4.3 m -112.97 25.62 11.24 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 179.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 26.9 pttt -66.2 68.76 0.05 Allowed 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 179.179 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.515 ' N ' ' O ' ' A' ' 69' ' ' THR . 43.8 mm-40 -105.41 149.92 25.71 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.423 -0.798 . . . . 0.0 109.696 -179.455 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 24.1 m -127.43 142.99 42.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 16.5 t -128.62 119.84 51.07 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 CA-C-O 121.945 0.879 . . . . 0.0 109.012 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -58.46 -73.29 0.08 Allowed 'General case' 0 C--N 1.291 -1.974 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.523 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.493 ' C ' ' H ' ' A' ' 77' ' ' ASP . 79.6 p -161.47 71.56 0.38 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.259 -0.901 . . . . 0.0 109.495 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -68.28 43.41 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.225 -0.922 . . . . 0.0 109.351 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.493 ' H ' ' C ' ' A' ' 75' ' ' SER . 23.4 t0 -171.84 -37.03 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.294 -0.878 . . . . 0.0 109.174 -179.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.475 ' O ' ' N ' ' A' ' 80' ' ' ASP . . . 88.34 43.58 5.53 Favored Glycine 0 N--CA 1.493 2.481 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 48.7 m -68.51 50.66 0.07 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.339 -1.095 . . . . 0.0 109.297 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.514 ' N ' ' OD1' ' A' ' 80' ' ' ASP . 0.4 OUTLIER 54.84 25.87 7.14 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.343 -0.848 . . . . 0.0 109.512 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.59 ' SG ' ' N ' ' A' ' 52' ' ' SER . 12.3 t -108.0 -71.83 0.74 Allowed 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.45 -0.781 . . . . 0.0 109.275 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.504 ' O ' ' N ' ' A' ' 84' ' ' ALA . . . -72.77 -34.05 59.76 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 17.3 t70 51.07 -90.99 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.217 -1.167 . . . . 0.0 109.497 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.504 ' N ' ' O ' ' A' ' 82' ' ' GLY . . . -64.38 173.95 1.86 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.287 -0.883 . . . . 0.0 109.406 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -157.64 -110.9 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.303 -0.873 . . . . 0.0 109.368 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -70.58 113.16 7.41 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.13 -0.981 . . . . 0.0 109.577 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -64.08 -145.25 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.256 -0.902 . . . . 0.0 109.253 179.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . 0.444 ' O ' ' N ' ' A' ' 90' ' ' HIS . 18.5 m-90 -152.23 137.01 17.05 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.215 -0.928 . . . . 0.0 109.382 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 34.3 t60 -68.53 66.8 0.12 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.283 -0.886 . . . . 0.0 109.527 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.446 ' CG ' ' O ' ' A' ' 90' ' ' HIS . 18.9 t-80 52.81 43.88 30.95 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.281 -0.887 . . . . 0.0 109.614 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 11.5 p -142.13 119.03 11.2 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.221 -0.924 . . . . 0.0 109.297 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.534 ' N ' ' CD ' ' A' ' 93' ' ' PRO . 0.2 OUTLIER -69.19 -47.32 28.78 Favored Pre-proline 0 N--CA 1.487 1.421 0 O-C-N 121.273 -0.892 . . . . 0.0 110.385 -179.973 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.534 ' CD ' ' N ' ' A' ' 92' ' ' PHE . 5.2 Cg_exo -64.45 143.06 81.05 Favored 'Trans proline' 0 C--N 1.322 -0.851 0 C-N-CA 120.914 1.076 . . . . 0.0 109.877 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 43.7 m -60.99 -52.84 63.31 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.321 -0.862 . . . . 0.0 109.54 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 32.6 ptt180 -164.63 141.12 6.07 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.188 -0.945 . . . . 0.0 109.492 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 161.79 -170.91 37.61 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 57.7 t-20 -167.87 -78.11 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.26 -1.141 . . . . 0.0 109.588 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 55.8 mt -75.2 -92.43 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.247 -0.908 . . . . 0.0 109.526 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 49.0 35.31 6.61 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.99 -1.069 . . . . 0.0 109.551 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.473 ' CG ' ' H ' ' A' ' 101' ' ' PHE . 7.7 p-10 -67.35 -114.86 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.24 -0.912 . . . . 0.0 109.443 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.473 ' H ' ' CG ' ' A' ' 100' ' ' ASP . 64.9 t80 -66.38 -31.36 72.09 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.192 -0.943 . . . . 0.0 109.417 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -169.95 161.44 8.83 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.282 -0.886 . . . . 0.0 109.439 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.421 ' O ' ' O ' ' A' ' 104' ' ' ARG . 59.2 t-80 -63.23 -47.65 81.6 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.168 -0.958 . . . . 0.0 109.576 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.421 ' O ' ' O ' ' A' ' 103' ' ' HIS . 42.0 ttm180 51.81 98.24 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.26 -0.9 . . . . 0.0 109.56 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.405 ' O ' ' O ' ' A' ' 104' ' ' ARG . 47.3 m-20 -60.77 -154.55 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.238 -0.914 . . . . 0.0 109.496 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.467 ' CB ' ' NZ ' ' A' ' 106' ' ' LYS . 6.4 ttpm? -163.97 160.59 22.08 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.293 -0.88 . . . . 0.0 109.443 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -171.36 76.56 0.06 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.192 -0.943 . . . . 0.0 109.548 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 31.3 t70 51.29 77.44 0.13 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.238 -0.914 . . . . 0.0 109.515 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.508 ' O ' ' CD2' ' A' ' 109' ' ' PHE . 81.8 t80 -83.43 0.1 47.68 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.28 -0.887 . . . . 0.0 109.52 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -73.2 -20.83 60.79 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.222 -0.924 . . . . 0.0 109.434 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -177.32 145.23 0.44 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.268 -0.895 . . . . 0.0 109.53 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 30.1 mmt180 -76.04 -113.67 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.187 -0.946 . . . . 0.0 109.264 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.422 ' O ' ' OE2' ' A' ' 116' ' ' GLU . 46.3 t -71.16 120.51 16.84 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.232 -0.917 . . . . 0.0 109.435 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.409 ' O ' ' OE1' ' A' ' 116' ' ' GLU . 36.7 t -66.69 2.23 1.44 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.25 -0.906 . . . . 0.0 109.485 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . 0.417 ' H ' ' C ' ' A' ' 113' ' ' SER . 20.5 m170 -80.22 65.58 5.43 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.219 -0.925 . . . . 0.0 109.385 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.422 ' OE2' ' O ' ' A' ' 113' ' ' SER . 4.9 mp0 -68.42 -179.69 1.4 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.293 -0.88 . . . . 0.0 109.432 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -66.87 115.29 6.48 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.235 -0.915 . . . . 0.0 109.344 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -64.68 -38.02 89.58 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.245 -0.91 . . . . 0.0 109.412 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -178.08 139.68 4.29 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 51.3 mtp180 -63.56 166.43 6.77 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.255 -1.144 . . . . 0.0 109.388 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 7.5 t -80.99 -32.14 34.39 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.148 -0.97 . . . . 0.0 109.352 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 167.94 172.7 35.24 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.453 -1.459 . . . . 0.0 109.453 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 14.0 mt -68.31 128.45 36.62 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.232 -1.157 . . . . 0.0 109.344 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -72.25 153.74 92.24 Favored Pre-proline 0 N--CA 1.49 1.535 0 O-C-N 121.187 -0.946 . . . . 0.0 108.831 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -56.79 130.72 41.42 Favored 'Trans proline' 0 C--N 1.322 -0.829 0 C-N-CA 121.024 1.149 . . . . 0.0 109.786 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.516 ' O ' ' CG ' ' A' ' 127' ' ' PHE . 69.1 mm-40 -72.49 -49.65 31.5 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.208 -0.933 . . . . 0.0 109.359 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . 0.516 ' CG ' ' O ' ' A' ' 126' ' ' GLU . 97.9 m-85 -158.12 90.23 1.04 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.339 -0.851 . . . . 0.0 109.395 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . 54.59 -139.83 0.98 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.285 -0.885 . . . . 0.0 109.444 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -166.6 91.28 0.43 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.189 -0.944 . . . . 0.0 109.415 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.571 HD22 ' N ' ' A' ' 130' ' ' LEU . 3.5 mm? -70.78 73.45 0.57 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.176 -0.953 . . . . 0.0 109.182 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 178.26 74.86 0.06 OUTLIER Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.442 ' O ' ' N ' ' A' ' 134' ' ' GLY . 72.6 mt-10 -60.2 100.26 0.09 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.228 -1.16 . . . . 0.0 109.428 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 93.0 p -67.2 71.66 0.11 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.216 -0.928 . . . . 0.0 109.474 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . 0.459 ' O ' ' N ' ' A' ' 136' ' ' SER . . . -169.67 -55.29 0.03 OUTLIER Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 92.3 p -69.91 43.84 0.06 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.246 -1.149 . . . . 0.0 109.53 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.459 ' N ' ' O ' ' A' ' 134' ' ' GLY . 85.7 p -63.21 145.56 55.26 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.213 -0.93 . . . . 0.0 109.388 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 79.1 p -169.41 119.4 0.67 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.265 -0.897 . . . . 0.0 109.428 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 70.6 m -163.6 98.42 0.89 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.176 -0.953 . . . . 0.0 109.436 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 32.5 mtmm -62.73 -166.99 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.253 -0.904 . . . . 0.0 109.483 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 37.7 m -164.42 -46.74 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.296 -0.877 . . . . 0.0 109.408 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 14.6 t 53.14 78.99 0.13 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.21 -0.931 . . . . 0.0 109.46 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . 0.41 ' OG1' ' ND1' ' A' ' 143' ' ' HIS . 78.5 p -67.11 -31.97 72.79 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.214 -0.929 . . . . 0.0 109.492 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . 0.507 ' N ' ' ND1' ' A' ' 143' ' ' HIS . 1.0 OUTLIER -171.77 -33.02 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.201 -0.937 . . . . 0.0 109.432 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . 0.402 ' OG ' ' O ' ' A' ' 143' ' ' HIS . 72.6 m -167.7 104.8 0.51 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.251 -0.906 . . . . 0.0 109.43 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -61.46 -65.61 0.66 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.299 -0.876 . . . . 0.0 109.484 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 37.2 tt0 -168.34 -22.85 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.25 -0.906 . . . . 0.0 109.469 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -57.64 176.16 0.15 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.258 -0.901 . . . . 0.0 109.439 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . 0.445 ' C ' ' H ' ' A' ' 150' ' ' SER . 27.5 m -150.94 160.19 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.205 -0.935 . . . . 0.0 109.393 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 47.7 t -68.99 7.24 0.73 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.194 -0.941 . . . . 0.0 109.515 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . 0.445 ' H ' ' C ' ' A' ' 148' ' ' VAL . 15.0 t 52.79 -175.16 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.27 -0.894 . . . . 0.0 109.431 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 88.3 p -170.54 70.24 0.05 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.269 -0.894 . . . . 0.0 109.483 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 1.5 t -170.22 -25.95 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.275 -0.89 . . . . 0.0 109.505 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . 0.436 ' OG1' ' N ' ' A' ' 154' ' ' VAL . 82.8 p -69.47 -83.47 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.269 -0.894 . . . . 0.0 109.45 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.436 ' N ' ' OG1' ' A' ' 153' ' ' THR . 22.7 t 52.51 84.41 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.184 -0.948 . . . . 0.0 109.447 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . 0.415 ' O ' ' O ' ' A' ' 156' ' ' ARG . 7.1 m120 -64.69 -21.31 66.71 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.311 -0.868 . . . . 0.0 109.478 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . 0.415 ' O ' ' O ' ' A' ' 155' ' ' ASN . 62.6 mtm180 -57.6 -162.29 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.313 -0.867 . . . . 0.0 109.526 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -64.55 175.12 12.6 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -163.92 10.69 0.09 OUTLIER Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.708 -1.357 . . . . 0.0 109.708 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 12.6 m 52.08 -166.18 0.05 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.235 -1.156 . . . . 0.0 109.437 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.413 ' H ' ' H ' ' A' ' 161' ' ' ILE . . . -171.25 -1.66 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.184 -0.948 . . . . 0.0 109.52 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . 0.413 ' H ' ' H ' ' A' ' 160' ' ' ALA . 78.4 mt -79.32 89.17 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.235 -0.915 . . . . 0.0 109.468 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 74.2 mt-10 -63.73 -102.3 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.27 -0.893 . . . . 0.0 109.488 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 29.0 t -171.99 0.64 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.224 -0.922 . . . . 0.0 109.435 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 53.3 pttt -168.76 144.06 3.37 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.212 -0.93 . . . . 0.0 109.452 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 5.0 m-70 -69.05 -78.78 0.06 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.302 -0.874 . . . . 0.0 109.412 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 . . . . . 0 N--CA 1.489 1.519 0 CA-C-O 118.038 -0.982 . . . . 0.0 109.485 179.969 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.5 ttt . . . . . 0 N--CA 1.491 1.595 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 171.24 78.62 0.05 OUTLIER Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 70.8 p -65.36 94.82 0.18 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.187 -1.184 . . . . 0.0 109.506 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.541 ' CD2' ' N ' ' A' ' 5' ' ' ARG . 72.1 t80 -69.52 175.9 3.81 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.27 -0.894 . . . . 0.0 109.406 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.587 ' CG ' HH11 ' A' ' 5' ' ' ARG . 3.5 mtt-85 -63.12 -64.59 0.87 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.281 -0.887 . . . . 0.0 109.493 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 48.6 tt0 53.41 90.64 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.198 -0.939 . . . . 0.0 109.502 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -65.61 -125.96 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.241 -0.912 . . . . 0.0 109.375 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -178.38 36.24 0.08 OUTLIER Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.576 -1.409 . . . . 0.0 109.576 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.457 ' C ' ' H ' ' A' ' 11' ' ' SER . 69.2 m -166.04 93.37 0.53 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.262 -1.14 . . . . 0.0 109.551 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.4 m -74.7 18.9 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.224 -0.922 . . . . 0.0 109.434 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.457 ' H ' ' C ' ' A' ' 9' ' ' SER . 12.4 m 52.66 39.25 28.04 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.335 -0.853 . . . . 0.0 109.438 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.7 t 48.2 -140.6 0.62 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.298 -0.876 . . . . 0.0 109.529 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -168.04 69.0 0.17 Allowed Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 59.9 p -63.15 -46.9 85.02 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.339 -1.095 . . . . 0.0 109.552 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.457 ' C ' ' H ' ' A' ' 17' ' ' GLU . 91.8 mttt 52.5 64.86 1.69 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.156 -0.965 . . . . 0.0 109.374 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -70.97 10.17 0.58 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.249 -0.907 . . . . 0.0 109.42 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.457 ' H ' ' C ' ' A' ' 15' ' ' LYS . 48.7 mt-10 -80.19 -41.49 25.14 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.306 -0.871 . . . . 0.0 109.604 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 50.91 13.88 0.16 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.193 -0.942 . . . . 0.0 109.275 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.436 ' N ' ' C ' ' A' ' 17' ' ' GLU . 6.4 m-70 -75.42 -24.38 57.09 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.278 -0.889 . . . . 0.0 109.484 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 71.5 p -69.01 92.97 0.54 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.213 -0.929 . . . . 0.0 109.485 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -70.35 -149.14 0.47 Allowed Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -90.75 128.2 36.6 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.289 -1.124 . . . . 0.0 109.244 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.583 ' N ' HD12 ' A' ' 23' ' ' LEU . 8.6 mp 51.01 87.24 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.134 -0.979 . . . . 0.0 109.199 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 25.5 t -60.35 -40.98 85.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.28 -0.888 . . . . 0.0 109.48 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.443 ' H ' HG22 ' A' ' 25' ' ' THR . 0.0 OUTLIER -64.97 128.63 36.55 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.279 -0.888 . . . . 0.0 109.487 -179.953 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 49.3 m -156.81 -12.96 0.09 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.299 -0.875 . . . . 0.0 109.479 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 58.7 mttp -55.23 112.58 1.12 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.195 -0.941 . . . . 0.0 109.472 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 179.71 -155.13 14.87 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.421 ' O ' ' O ' ' A' ' 30' ' ' LYS . 1.2 m-20 -72.28 3.94 4.17 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.281 -1.129 . . . . 0.0 109.384 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.421 ' O ' ' O ' ' A' ' 29' ' ' ASP . 49.9 mtpt 52.56 175.66 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.403 -0.81 . . . . 0.0 109.568 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.46 ' N ' ' CD ' ' A' ' 31' ' ' GLU . 17.8 mp0 -84.43 114.39 21.87 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.247 -0.908 . . . . 0.0 109.526 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 15.8 mt -72.44 -6.84 46.42 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.207 -0.933 . . . . 0.0 109.361 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 11.0 tp -168.47 139.41 2.61 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.277 -0.889 . . . . 0.0 109.281 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 21.1 pt -67.94 164.79 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.215 -0.928 . . . . 0.0 109.522 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 35.3 t0 53.03 178.33 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.291 -0.88 . . . . 0.0 109.557 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.556 ' N ' HD22 ' A' ' 36' ' ' ASN . 1.8 m120 -55.96 156.68 5.07 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.256 -0.902 . . . . 0.0 109.498 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -73.89 -67.72 0.58 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.22 -0.925 . . . . 0.0 109.24 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -72.56 93.8 1.63 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.248 -0.908 . . . . 0.0 109.447 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.5 m -75.42 -158.93 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.244 -0.91 . . . . 0.0 109.427 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 79.6 p -59.24 132.02 52.75 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.236 -0.915 . . . . 0.0 109.433 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 50.9 m -69.72 87.87 0.52 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.326 -0.858 . . . . 0.0 109.441 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 168.36 40.47 0.03 OUTLIER Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.469 ' C ' ' H ' ' A' ' 45' ' ' THR . 63.4 t60 -73.92 11.02 0.96 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.242 -1.152 . . . . 0.0 109.384 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.7 m -75.8 25.36 0.12 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.231 -0.918 . . . . 0.0 109.224 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.469 ' H ' ' C ' ' A' ' 43' ' ' HIS . 70.0 p -75.34 109.55 8.95 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.172 -0.955 . . . . 0.0 109.295 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 56.9 p -151.78 123.13 7.77 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.247 -0.908 . . . . 0.0 109.359 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 61.2 p -71.42 103.72 3.0 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.247 -0.908 . . . . 0.0 109.428 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 55.6 mtp180 -145.75 143.97 30.05 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.343 -0.848 . . . . 0.0 109.174 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.1 mmm180 -88.05 122.26 31.43 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.191 -0.943 . . . . 0.0 109.709 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.445 ' O ' ' O ' ' A' ' 51' ' ' CYS . 41.7 t -67.02 -67.82 0.42 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.222 -0.924 . . . . 0.0 109.668 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.445 ' O ' ' O ' ' A' ' 50' ' ' SER . 41.7 t -47.73 -93.39 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.157 -0.964 . . . . 0.0 109.235 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 48.7 m -55.47 149.79 12.9 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 22.9 tptp -95.56 100.4 12.14 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 120.959 -1.088 . . . . 0.0 108.438 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 41.2 t -128.45 116.2 40.83 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.647 -0.658 . . . . 0.0 109.562 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.519 HG23 ' O ' ' A' ' 55' ' ' ILE . 17.0 tt -127.89 124.92 63.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 179.545 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.6 m -128.19 111.65 13.67 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.365 -0.835 . . . . 0.0 109.488 -179.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.525 ' H ' ' HB ' ' A' ' 69' ' ' THR . 10.0 mtmt -124.3 114.42 19.54 Favored 'General case' 0 N--CA 1.512 2.652 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 178.203 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.9 p -118.96 126.63 52.2 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.433 -0.792 . . . . 0.0 109.752 -179.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.6 m -132.35 122.93 49.12 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.13 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 178.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.539 HG23 ' O ' ' A' ' 60' ' ' THR . 7.9 t -107.57 120.17 41.46 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.561 -0.712 . . . . 0.0 109.98 -179.43 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.462 ' ND2' ' O ' ' A' ' 65' ' ' ARG . 2.5 m-20 -111.82 145.45 39.41 Favored 'General case' 0 N--CA 1.51 2.553 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.418 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -69.96 -30.26 67.58 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 120.07 -1.644 . . . . 0.0 112.737 -177.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 11.5 p30 -67.07 3.99 1.0 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.249 -1.532 . . . . 0.0 109.863 -178.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.418 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 96.83 5.6 58.51 Favored Glycine 0 N--CA 1.496 2.654 0 N-CA-C 110.664 -0.974 . . . . 0.0 110.664 178.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.462 ' O ' ' ND2' ' A' ' 61' ' ' ASN . 11.7 mpt_? -91.68 104.82 17.24 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.568 -1.548 . . . . 0.0 108.043 178.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 28.7 p -130.1 104.53 7.38 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.536 -0.728 . . . . 0.0 109.128 -179.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -94.58 127.61 40.63 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.154 -0.966 . . . . 0.0 109.979 -179.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.409 HG22 ' H ' ' A' ' 70' ' ' LYS . 73.3 m -108.68 108.37 19.2 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.546 -0.721 . . . . 0.0 109.286 179.571 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.525 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 5.8 m -102.08 27.14 6.86 Favored 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 178.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.409 ' H ' HG22 ' A' ' 68' ' ' THR . 86.7 tttt -70.09 69.04 0.33 Allowed 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -106.26 143.98 33.61 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.552 -0.718 . . . . 0.0 109.275 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 43.1 t -128.11 129.19 69.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 179.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 17.2 t -130.12 116.93 38.76 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 CA-C-O 122.072 0.939 . . . . 0.0 108.95 179.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 58.1 mttp -78.77 -164.56 0.6 Allowed 'General case' 0 C--N 1.287 -2.109 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.614 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.519 ' O ' ' N ' ' A' ' 77' ' ' ASP . 86.1 p -77.6 90.34 3.94 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.192 -0.943 . . . . 0.0 109.643 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -46.15 -14.93 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.36 -0.837 . . . . 0.0 109.839 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.519 ' N ' ' O ' ' A' ' 75' ' ' SER . 44.0 m-20 -158.12 -38.79 0.07 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.203 -0.936 . . . . 0.0 109.316 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.411 ' O ' ' OG ' ' A' ' 79' ' ' SER . . . 177.51 -5.5 0.03 OUTLIER Glycine 0 N--CA 1.488 2.162 0 N-CA-C 109.24 -1.544 . . . . 0.0 109.24 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . 0.45 ' OG ' ' SG ' ' A' ' 81' ' ' CYS . 96.9 p 47.16 27.09 0.75 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.277 -1.131 . . . . 0.0 109.242 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 54.12 24.35 4.77 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.417 -0.802 . . . . 0.0 109.233 -179.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.45 ' SG ' ' OG ' ' A' ' 79' ' ' SER . 99.3 m -95.7 18.82 12.22 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.185 -0.947 . . . . 0.0 109.49 -179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -158.8 -8.07 0.05 OUTLIER Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.452 ' C ' ' H ' ' A' ' 85' ' ' ASP . 9.0 p-10 -161.77 95.46 0.99 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.397 -1.061 . . . . 0.0 109.502 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -67.12 4.64 0.86 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.241 -0.912 . . . . 0.0 109.364 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.452 ' H ' ' C ' ' A' ' 83' ' ' ASP . 27.0 t70 -168.42 141.43 3.02 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.298 -0.876 . . . . 0.0 109.474 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -58.6 123.5 16.49 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.269 -0.894 . . . . 0.0 109.456 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -60.67 -48.14 83.11 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.215 -0.928 . . . . 0.0 109.467 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . 0.426 ' O ' ' O ' ' A' ' 89' ' ' HIS . 35.6 m95 -65.3 -37.51 87.36 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.194 -0.941 . . . . 0.0 109.491 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.426 ' O ' ' O ' ' A' ' 88' ' ' TRP . 49.9 t-80 54.89 169.8 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.389 -0.82 . . . . 0.0 109.516 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.416 ' ND1' ' N ' ' A' ' 90' ' ' HIS . 8.3 m80 -82.2 53.68 2.33 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.282 -0.886 . . . . 0.0 109.449 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.434 HG22 ' CD2' ' A' ' 92' ' ' PHE . 7.1 m -60.27 136.83 58.15 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.176 -0.952 . . . . 0.0 109.488 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.434 ' CD2' HG22 ' A' ' 91' ' ' THR . 56.3 m-85 50.23 67.9 3.94 Favored Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.23 -0.919 . . . . 0.0 109.707 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -61.77 -31.4 85.67 Favored 'Trans proline' 0 C--N 1.318 -1.077 0 C-N-CA 121.399 1.399 . . . . 0.0 109.693 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 88.1 p -83.84 157.3 22.07 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.343 -0.848 . . . . 0.0 109.297 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.603 ' CG ' HH11 ' A' ' 95' ' ' ARG . 0.1 OUTLIER -167.35 -2.14 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.188 -0.945 . . . . 0.0 109.389 -179.938 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -67.91 54.68 0.38 Allowed Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.513 ' N ' ' O ' ' A' ' 95' ' ' ARG . 69.9 m-80 50.74 94.22 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.261 -1.141 . . . . 0.0 109.451 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 10.7 tp -170.91 118.25 0.49 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.317 -0.864 . . . . 0.0 109.317 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.443 ' OD1' ' N ' ' A' ' 100' ' ' ASP . 63.3 t0 -168.71 133.66 1.62 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.25 -0.906 . . . . 0.0 109.535 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.525 ' O ' ' CE2' ' A' ' 102' ' ' PHE . 56.8 m-20 52.07 86.73 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.3 -0.875 . . . . 0.0 109.667 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 22.0 p90 -59.49 -9.37 2.43 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.242 -0.911 . . . . 0.0 109.473 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.525 ' CE2' ' O ' ' A' ' 100' ' ' ASP . 13.2 m-85 60.21 105.99 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.406 -0.808 . . . . 0.0 109.488 -179.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -76.52 -32.18 58.11 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.227 -0.921 . . . . 0.0 109.53 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 58.6 ttt180 57.02 167.73 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.217 -0.927 . . . . 0.0 109.321 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.486 ' C ' ' H ' ' A' ' 107' ' ' ASP . 3.5 p30 -131.36 125.19 32.03 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.426 -0.796 . . . . 0.0 109.174 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -71.56 15.59 0.13 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.245 -0.909 . . . . 0.0 109.652 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.486 ' H ' ' C ' ' A' ' 105' ' ' ASP . 8.3 p-10 -171.76 87.85 0.1 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.267 -0.896 . . . . 0.0 109.518 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -66.05 134.62 53.25 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.258 -0.901 . . . . 0.0 109.307 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -63.21 -34.77 78.36 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.231 -0.918 . . . . 0.0 109.465 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -66.69 80.67 0.1 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.291 -0.88 . . . . 0.0 109.483 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 73.4 p -63.72 95.33 0.11 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.317 -0.864 . . . . 0.0 109.436 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.457 ' C ' ' H ' ' A' ' 114' ' ' SER . 69.2 ttt180 -67.86 87.43 0.24 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.245 -0.909 . . . . 0.0 109.428 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.406 ' OG ' ' O ' ' A' ' 112' ' ' ARG . 17.4 p 54.81 7.51 0.17 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.29 -0.881 . . . . 0.0 109.385 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.457 ' H ' ' C ' ' A' ' 112' ' ' ARG . 26.8 p 51.9 -156.55 0.14 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.28 -0.887 . . . . 0.0 109.433 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 32.0 p-80 -69.33 -165.23 0.07 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.345 -0.847 . . . . 0.0 109.554 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -69.55 161.44 29.55 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.261 -0.899 . . . . 0.0 109.403 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -63.14 130.87 46.48 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.193 -0.942 . . . . 0.0 109.517 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -169.33 73.18 0.08 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.33 -0.856 . . . . 0.0 109.259 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 176.66 86.45 0.06 OUTLIER Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 38.1 ttm180 -66.19 139.4 58.11 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.335 -1.097 . . . . 0.0 109.399 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 1.9 t -170.37 26.94 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.238 -0.914 . . . . 0.0 109.526 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 178.91 140.48 3.99 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.587 HD22 ' N ' ' A' ' 123' ' ' LEU . 3.4 mm? -75.4 127.46 33.17 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.219 -1.166 . . . . 0.0 109.064 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.525 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -77.28 161.78 71.58 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.156 -0.965 . . . . 0.0 108.816 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.525 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 1.4 Cg_endo -57.79 154.64 36.59 Favored 'Trans proline' 0 C--N 1.32 -0.951 0 C-N-CA 121.409 1.406 . . . . 0.0 109.804 179.588 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -65.04 -133.94 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.202 -0.936 . . . . 0.0 109.159 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -76.72 -133.37 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.927 -1.108 . . . . 0.0 109.327 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -66.79 -69.31 0.31 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.216 -0.928 . . . . 0.0 109.443 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -172.29 158.84 4.55 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.267 -0.896 . . . . 0.0 109.39 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 10.9 tp -64.76 95.72 0.16 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.317 -0.865 . . . . 0.0 109.321 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . 0.425 ' O ' ' O ' ' A' ' 132' ' ' GLU . . . 175.79 31.55 0.04 OUTLIER Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.59 ' CD ' ' H ' ' A' ' 132' ' ' GLU . 0.4 OUTLIER -55.29 -169.12 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.247 -1.149 . . . . 0.0 109.616 -179.934 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 27.8 t -170.93 -87.78 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.286 -0.884 . . . . 0.0 109.503 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 173.04 70.38 0.05 OUTLIER Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.485 -1.446 . . . . 0.0 109.485 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . 0.401 ' O ' ' O ' ' A' ' 136' ' ' SER . 41.7 t -69.27 176.83 3.08 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.281 -1.129 . . . . 0.0 109.469 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.41 ' C ' ' H ' ' A' ' 138' ' ' SER . 12.8 t 53.19 97.67 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.253 -0.904 . . . . 0.0 109.418 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . 0.445 ' C ' ' H ' ' A' ' 139' ' ' LYS . 90.7 p -58.39 -6.91 0.75 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.276 -0.89 . . . . 0.0 109.509 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.483 ' O ' ' N ' ' A' ' 140' ' ' THR . 84.8 p -72.7 13.36 0.37 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.316 -0.865 . . . . 0.0 109.401 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.445 ' H ' ' C ' ' A' ' 137' ' ' SER . 61.0 tttp -59.16 84.75 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.266 -0.896 . . . . 0.0 109.47 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . 0.483 ' N ' ' O ' ' A' ' 138' ' ' SER . 39.9 m -165.4 -44.03 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.279 -0.888 . . . . 0.0 109.492 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 87.6 p -169.86 -167.94 0.71 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.341 -0.849 . . . . 0.0 109.408 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 1.5 t -171.75 164.93 6.62 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.292 -0.88 . . . . 0.0 109.48 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . 0.403 ' CG ' ' N ' ' A' ' 144' ' ' SER . 57.9 t-80 -63.0 164.76 7.79 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.195 -0.94 . . . . 0.0 109.444 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . 0.403 ' N ' ' CG ' ' A' ' 143' ' ' HIS . 89.7 p -169.63 -138.51 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.218 -0.926 . . . . 0.0 109.51 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 19.1 ttpp -163.95 144.55 8.49 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.232 -0.917 . . . . 0.0 109.495 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 45.4 tt0 -169.73 -85.7 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.299 -0.875 . . . . 0.0 109.43 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . 0.52 ' CD2' ' O ' ' A' ' 147' ' ' PHE . 70.6 t80 51.15 47.8 24.19 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.234 -0.916 . . . . 0.0 109.47 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 9.0 p -171.16 151.75 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.328 -0.858 . . . . 0.0 109.403 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 31.4 t -170.78 170.2 6.64 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.257 -0.902 . . . . 0.0 109.398 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 81.1 p -169.36 89.73 0.2 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.257 -0.902 . . . . 0.0 109.471 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 14.0 m 52.73 62.55 2.63 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.262 -0.899 . . . . 0.0 109.504 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . 0.47 ' H ' HG22 ' A' ' 152' ' ' THR . 0.5 OUTLIER -75.43 -30.67 60.1 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.266 -0.896 . . . . 0.0 109.527 179.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 24.0 p -77.11 161.23 28.42 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.243 -0.911 . . . . 0.0 109.4 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.428 ' O ' ' O ' ' A' ' 155' ' ' ASN . 38.8 t -72.51 -74.77 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.252 -0.905 . . . . 0.0 109.466 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . 0.428 ' O ' ' O ' ' A' ' 154' ' ' VAL . 10.8 m120 -60.88 -149.74 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.279 -0.888 . . . . 0.0 109.561 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 54.6 mtp180 -148.79 100.96 3.15 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.17 -0.956 . . . . 0.0 109.304 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 65.55 82.32 0.11 Allowed Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -66.32 -98.39 0.02 OUTLIER Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 98.3 p -63.28 164.53 8.76 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.249 -1.147 . . . . 0.0 109.525 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.487 ' O ' ' N ' ' A' ' 162' ' ' GLU . . . -67.13 -39.93 86.67 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.256 -0.902 . . . . 0.0 109.443 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . 0.431 ' C ' ' H ' ' A' ' 163' ' ' SER . 15.8 pt -68.46 56.5 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.281 -0.887 . . . . 0.0 109.483 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.487 ' N ' ' O ' ' A' ' 160' ' ' ALA . 15.3 pt-20 -73.92 39.7 0.11 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.215 -0.928 . . . . 0.0 109.452 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . 0.431 ' H ' ' C ' ' A' ' 161' ' ' ILE . 53.4 p 50.69 77.83 0.12 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.187 -0.946 . . . . 0.0 109.495 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -66.92 90.11 0.17 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.166 -0.959 . . . . 0.0 109.443 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 16.1 p-80 -71.84 57.14 0.31 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.253 -0.904 . . . . 0.0 109.425 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 51.8 t80 . . . . . 0 N--CA 1.49 1.542 0 CA-C-O 118.04 -0.981 . . . . 0.0 109.501 179.974 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.3 mtm . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 121.292 0.568 . . . . 0.0 109.528 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -66.69 -112.62 0.01 OUTLIER Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.544 -1.423 . . . . 0.0 109.544 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.402 ' O ' ' N ' ' A' ' 5' ' ' ARG . 42.9 p -152.75 178.75 9.29 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.336 -1.096 . . . . 0.0 109.339 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 34.0 m-85 -70.99 49.42 0.13 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.257 -0.902 . . . . 0.0 109.394 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.402 ' N ' ' O ' ' A' ' 3' ' ' THR . 38.4 ttm180 -71.24 -12.7 61.6 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.152 -0.967 . . . . 0.0 109.445 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -59.3 -84.6 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.247 -0.908 . . . . 0.0 109.296 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.618 ' H ' ' CD ' ' A' ' 7' ' ' GLU . 1.1 pm0 -71.51 80.03 0.79 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.232 -0.918 . . . . 0.0 109.192 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -88.42 -70.44 1.27 Allowed Glycine 0 N--CA 1.494 2.527 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.9 t -172.87 -79.05 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.276 -1.132 . . . . 0.0 109.378 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.7 p -171.54 138.24 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.244 -0.91 . . . . 0.0 109.449 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.9 t -171.05 149.8 2.96 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.181 -0.949 . . . . 0.0 109.553 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.8 t -71.08 -74.69 0.14 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.243 -0.911 . . . . 0.0 109.534 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -171.3 141.81 6.66 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.415 ' OG1' ' N ' ' A' ' 15' ' ' LYS . 75.1 p -72.04 -86.62 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.123 -1.222 . . . . 0.0 109.445 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.415 ' N ' ' OG1' ' A' ' 14' ' ' THR . 61.3 tttm -168.95 75.06 0.1 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.209 -0.932 . . . . 0.0 109.548 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.444 ' N ' ' CD ' ' A' ' 16' ' ' GLN . 3.1 mp0 -73.23 86.85 1.44 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.252 -0.905 . . . . 0.0 109.519 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -67.67 -31.55 71.61 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.292 -0.88 . . . . 0.0 109.397 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 80.9 t80 -72.58 154.49 40.76 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.195 -0.941 . . . . 0.0 109.451 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 77.8 m-70 -58.84 148.68 29.1 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.252 -0.905 . . . . 0.0 109.461 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 60.9 m -62.48 -34.08 76.14 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.237 -0.914 . . . . 0.0 109.443 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.426 ' O ' ' O ' ' A' ' 22' ' ' LYS . . . 69.01 5.55 48.05 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.426 ' O ' ' O ' ' A' ' 21' ' ' GLY . 33.6 ttpt 54.5 172.23 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.208 -1.172 . . . . 0.0 109.283 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.59 ' N ' HD22 ' A' ' 23' ' ' LEU . 3.5 mm? -81.76 158.85 24.0 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.236 -0.915 . . . . 0.0 109.049 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.407 ' O ' ' O ' ' A' ' 25' ' ' THR . 4.8 t 58.95 95.42 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.4 -0.813 . . . . 0.0 109.385 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.407 ' O ' ' O ' ' A' ' 24' ' ' VAL . 61.3 p -50.71 178.27 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.32 -0.863 . . . . 0.0 109.598 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.448 ' C ' ' H ' ' A' ' 28' ' ' GLY . 70.3 p -68.94 155.34 40.48 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.273 -0.892 . . . . 0.0 109.543 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.462 ' O ' ' N ' ' A' ' 29' ' ' ASP . 52.6 tttm -76.3 33.55 0.13 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.225 -0.922 . . . . 0.0 109.182 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.448 ' H ' ' C ' ' A' ' 26' ' ' THR . . . 68.12 -61.45 0.38 Allowed Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.462 ' N ' ' O ' ' A' ' 27' ' ' LYS . 70.3 m-20 -55.83 99.35 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.165 -1.197 . . . . 0.0 109.52 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.7 tttm -171.09 150.32 3.02 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.242 -0.912 . . . . 0.0 109.472 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.45 ' N ' ' CD ' ' A' ' 31' ' ' GLU . 13.9 mp0 -74.25 89.62 2.05 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.281 -0.887 . . . . 0.0 109.424 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 14.6 mt -78.4 -1.07 31.69 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.219 -0.926 . . . . 0.0 109.449 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 11.3 tp -170.87 148.33 2.85 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.233 -0.917 . . . . 0.0 109.303 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 75.5 mt -132.33 102.24 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.461 -0.774 . . . . 0.0 109.172 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -67.72 -160.5 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.277 -0.889 . . . . 0.0 109.491 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -169.55 -39.7 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.315 -0.866 . . . . 0.0 109.346 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -169.21 145.6 3.4 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.204 -0.935 . . . . 0.0 109.379 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 27.0 mtmm -153.27 -47.6 0.1 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.224 -0.923 . . . . 0.0 109.347 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.455 HG22 ' N ' ' A' ' 40' ' ' THR . 7.8 p -170.11 157.96 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.234 -0.916 . . . . 0.0 109.508 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.455 ' N ' HG22 ' A' ' 39' ' ' VAL . 43.8 p -59.54 -160.28 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.252 -0.905 . . . . 0.0 109.43 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 81.0 p -164.5 -15.36 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.278 -0.889 . . . . 0.0 109.429 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -177.82 149.77 9.48 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.417 -1.473 . . . . 0.0 109.417 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 8.1 p80 -174.58 172.54 3.06 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.214 -1.168 . . . . 0.0 109.425 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 25.9 p 49.91 -134.68 1.42 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.278 -0.889 . . . . 0.0 109.556 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.428 ' O ' ' O ' ' A' ' 46' ' ' THR . 80.6 p 43.47 -155.73 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.454 -0.779 . . . . 0.0 110.085 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.492 ' O ' ' N ' ' A' ' 48' ' ' ARG . 7.4 p 55.29 107.71 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.427 -0.796 . . . . 0.0 109.813 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 77.2 p -66.21 69.67 0.06 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.151 -0.968 . . . . 0.0 109.485 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.492 ' N ' ' O ' ' A' ' 46' ' ' THR . 44.7 mtp180 -141.97 143.04 33.02 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.308 -0.87 . . . . 0.0 109.155 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.574 ' CG ' HH11 ' A' ' 49' ' ' ARG . 0.4 OUTLIER -94.35 131.15 40.29 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.177 -0.952 . . . . 0.0 109.995 -179.772 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.446 ' O ' ' O ' ' A' ' 51' ' ' CYS . 31.0 m -70.45 -55.67 8.46 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.261 -0.899 . . . . 0.0 110.217 -179.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.446 ' O ' ' O ' ' A' ' 50' ' ' SER . 45.8 t -56.69 -107.88 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.214 -0.929 . . . . 0.0 109.346 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.3 t -51.06 165.89 0.11 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.867 -1.146 . . . . 0.0 108.469 179.476 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 16.4 mmmt -107.53 99.68 9.16 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.268 -0.895 . . . . 0.0 109.524 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.611 HG13 ' O ' ' A' ' 54' ' ' VAL . 9.6 p -129.28 115.79 37.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 179.301 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.9 mm -127.11 118.43 50.16 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.0 m -129.4 112.41 13.79 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.424 -0.797 . . . . 0.0 109.068 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.54 ' N ' ' OG1' ' A' ' 69' ' ' THR . 17.3 mttp -123.1 113.39 18.93 Favored 'General case' 0 N--CA 1.514 2.759 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 178.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 58.1 m -114.84 127.05 55.49 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.469 -0.769 . . . . 0.0 109.521 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.432 ' O ' HG23 ' A' ' 59' ' ' VAL . 2.8 m -131.56 123.84 53.17 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.144 0 O-C-N 121.486 -0.759 . . . . 0.0 109.051 179.081 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 73.2 p -108.37 120.61 42.9 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.703 -0.623 . . . . 0.0 110.006 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.545 ' N ' ' OD1' ' A' ' 61' ' ' ASN . 0.7 OUTLIER -108.53 144.16 36.56 Favored 'General case' 0 N--CA 1.512 2.675 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.692 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.426 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -66.66 -31.08 71.52 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 119.949 -1.719 . . . . 0.0 112.474 -177.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.433 ' N ' ' OD1' ' A' ' 63' ' ' ASP . 16.1 p-10 -66.96 3.58 1.06 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.295 -1.503 . . . . 0.0 109.798 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.426 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 94.61 5.34 61.61 Favored Glycine 0 N--CA 1.497 2.719 0 N-CA-C 110.586 -1.006 . . . . 0.0 110.586 178.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.429 ' O ' ' OD1' ' A' ' 61' ' ' ASN . 63.0 ttt180 -92.3 109.5 20.88 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.608 -1.525 . . . . 0.0 108.086 178.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 17.6 p -134.19 112.5 11.15 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.31 -0.869 . . . . 0.0 109.48 -179.307 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -94.35 130.9 40.48 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.326 -0.859 . . . . 0.0 109.827 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.494 ' CG2' ' O ' ' A' ' 68' ' ' THR . 1.1 t -111.52 110.33 20.7 Favored 'General case' 0 N--CA 1.5 2.052 0 CA-C-O 122.013 0.911 . . . . 0.0 109.525 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.54 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 68.4 p -110.68 28.65 8.47 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 179.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.47 ' HZ3' ' HB2' ' A' ' 70' ' ' LYS . 18.4 mtmm -65.68 63.28 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.583 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.527 ' N ' ' O ' ' A' ' 69' ' ' THR . 56.5 mt-10 -102.23 140.83 35.99 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.447 -0.783 . . . . 0.0 109.502 -179.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.407 ' O ' HG23 ' A' ' 72' ' ' VAL . 17.9 m -127.78 136.29 60.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 179.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 13.2 t -129.79 116.51 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 CA-C-O 121.863 0.839 . . . . 0.0 109.077 179.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -53.58 177.2 0.03 OUTLIER 'General case' 0 C--N 1.287 -2.115 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.474 ' C ' ' H ' ' A' ' 77' ' ' ASP . 93.7 p -69.36 123.95 22.57 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.207 -0.933 . . . . 0.0 109.476 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -73.67 20.09 0.1 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.303 -0.873 . . . . 0.0 109.482 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.474 ' H ' ' C ' ' A' ' 75' ' ' SER . 34.1 t70 -165.31 -46.52 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.256 -0.902 . . . . 0.0 109.317 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 83.11 53.43 3.48 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.494 -1.443 . . . . 0.0 109.494 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 95.7 p -64.49 -33.13 75.18 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.258 -1.142 . . . . 0.0 109.505 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -168.57 24.91 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.248 -0.907 . . . . 0.0 109.554 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 59.1 m -126.73 18.77 7.32 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.558 -0.714 . . . . 0.0 109.342 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -161.25 16.29 0.17 Allowed Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.707 -1.357 . . . . 0.0 109.707 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -157.62 141.31 15.71 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.249 -1.148 . . . . 0.0 109.476 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -171.12 54.26 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.343 -0.848 . . . . 0.0 109.497 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -171.06 69.63 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.257 -0.902 . . . . 0.0 109.431 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -57.06 106.11 0.28 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.303 -0.873 . . . . 0.0 109.518 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.471 ' CG ' ' H ' ' A' ' 88' ' ' TRP . 19.0 t70 -167.06 -172.43 2.04 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.209 -0.932 . . . . 0.0 109.599 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . 0.471 ' H ' ' CG ' ' A' ' 87' ' ' ASP . 1.8 t-105 -73.09 111.21 7.99 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.276 -0.89 . . . . 0.0 109.218 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -162.31 75.48 0.44 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.2 -0.937 . . . . 0.0 109.519 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -171.64 60.7 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.377 -0.827 . . . . 0.0 109.477 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 71.3 p -148.23 -151.25 0.38 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.249 -0.907 . . . . 0.0 109.284 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.529 ' C ' ' H ' ' A' ' 94' ' ' SER . 45.3 t80 53.52 70.17 1.91 Allowed Pre-proline 0 N--CA 1.49 1.528 0 O-C-N 121.208 -0.933 . . . . 0.0 109.647 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.492 ' C ' ' H ' ' A' ' 95' ' ' ARG . 1.4 Cg_endo -67.11 29.46 0.12 Allowed 'Trans proline' 0 C--N 1.316 -1.132 0 C-N-CA 121.601 1.534 . . . . 0.0 110.385 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.529 ' H ' ' C ' ' A' ' 92' ' ' PHE . 8.4 t 55.29 5.27 0.11 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.001 -1.062 . . . . 0.0 109.628 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.507 ' HG2' HH11 ' A' ' 95' ' ' ARG . 0.0 OUTLIER -91.57 120.06 32.03 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.248 -0.907 . . . . 0.0 109.262 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -171.69 94.03 0.1 Allowed Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.444 ' OD1' ' N ' ' A' ' 98' ' ' LEU . 46.4 t30 -75.06 164.54 26.42 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.335 -1.097 . . . . 0.0 109.525 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.444 ' N ' ' OD1' ' A' ' 97' ' ' ASN . 23.3 tp -65.41 126.81 29.42 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.268 -0.895 . . . . 0.0 109.242 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -157.03 141.92 16.98 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.214 -0.929 . . . . 0.0 109.529 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -172.45 -10.22 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.231 -0.918 . . . . 0.0 109.52 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 51.2 p90 -66.3 -19.83 65.93 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.254 -0.904 . . . . 0.0 109.476 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -64.87 -25.24 67.81 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.171 -0.956 . . . . 0.0 109.496 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.444 ' O ' ' O ' ' A' ' 104' ' ' ARG . 56.2 t-80 -65.92 -22.81 66.52 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.275 -0.891 . . . . 0.0 109.486 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.444 ' O ' ' O ' ' A' ' 103' ' ' HIS . 34.8 ttp180 61.08 133.14 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.566 -0.709 . . . . 0.0 109.705 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -157.58 -33.07 0.08 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.259 -0.901 . . . . 0.0 109.372 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -65.17 141.18 58.76 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.212 -0.93 . . . . 0.0 109.42 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -169.87 39.41 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.226 -0.921 . . . . 0.0 109.511 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 53.2 41.11 32.15 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.29 -0.881 . . . . 0.0 109.516 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -71.75 -40.51 69.31 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.266 -0.896 . . . . 0.0 109.475 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . 0.429 ' O ' ' O ' ' A' ' 111' ' ' THR . 71.6 t80 -171.35 -23.52 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.352 -0.842 . . . . 0.0 109.295 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . 0.429 ' O ' ' O ' ' A' ' 110' ' ' PHE . 3.8 m 61.81 132.48 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.549 -0.719 . . . . 0.0 109.519 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 42.6 ttm180 -68.19 92.69 0.41 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.317 -0.864 . . . . 0.0 109.468 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.452 ' OG ' ' N ' ' A' ' 114' ' ' SER . 48.2 t -74.5 -149.85 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.269 -0.894 . . . . 0.0 109.416 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.452 ' N ' ' OG ' ' A' ' 113' ' ' SER . 80.0 p -171.55 12.93 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.251 -0.906 . . . . 0.0 109.422 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 21.7 t60 -70.4 156.69 39.0 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.221 -0.925 . . . . 0.0 109.403 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -72.64 158.67 35.21 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.203 -0.936 . . . . 0.0 109.51 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.508 ' O ' ' N ' ' A' ' 119' ' ' GLY . 61.5 t80 -74.11 -39.97 63.01 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.261 -0.899 . . . . 0.0 109.454 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 30.3 t0 -54.82 87.48 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.295 -0.878 . . . . 0.0 109.431 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.508 ' N ' ' O ' ' A' ' 117' ' ' PHE . . . -77.9 -87.72 0.41 Allowed Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 -179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 53.1 mtp180 -144.3 -90.98 0.11 Allowed 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.145 -1.209 . . . . 0.0 109.309 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 71.9 m -166.06 -77.27 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.227 -0.92 . . . . 0.0 109.483 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 164.99 -179.61 39.51 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.454 -1.459 . . . . 0.0 109.454 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.593 ' N ' HD12 ' A' ' 123' ' ' LEU . 7.9 mp -67.06 130.99 44.92 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.228 -1.16 . . . . 0.0 109.266 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.54 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -72.24 162.36 74.16 Favored Pre-proline 0 N--CA 1.49 1.545 0 O-C-N 121.192 -0.943 . . . . 0.0 108.862 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.54 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 2.2 Cg_endo -56.47 148.42 62.99 Favored 'Trans proline' 0 C--N 1.319 -0.985 0 C-N-CA 121.317 1.345 . . . . 0.0 109.721 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.432 ' O ' ' O ' ' A' ' 127' ' ' PHE . 38.4 tt0 -77.33 50.84 0.81 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.288 -0.882 . . . . 0.0 109.364 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . 0.432 ' O ' ' O ' ' A' ' 126' ' ' GLU . 32.9 t80 60.06 121.99 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.438 -0.789 . . . . 0.0 109.727 -179.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -162.97 43.05 0.12 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.216 -0.928 . . . . 0.0 109.365 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -63.99 -155.29 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.318 -0.864 . . . . 0.0 109.503 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.568 ' N ' HD12 ' A' ' 130' ' ' LEU . 9.7 mp -55.6 -15.99 3.54 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.238 -0.914 . . . . 0.0 109.201 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 82.73 -100.39 2.18 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 52.21 -113.25 0.73 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.268 -1.136 . . . . 0.0 109.43 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 97.3 p -77.71 -152.83 0.05 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.184 -0.948 . . . . 0.0 109.468 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 177.14 25.38 0.03 OUTLIER Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 13.4 m 52.77 77.54 0.16 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.176 -1.19 . . . . 0.0 109.51 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 29.6 t -171.26 0.19 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.242 -0.911 . . . . 0.0 109.491 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 78.3 p -169.1 102.86 0.37 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.232 -0.917 . . . . 0.0 109.505 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 92.2 p -73.09 -129.15 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.202 -0.936 . . . . 0.0 109.398 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -58.42 113.05 1.79 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.164 -0.96 . . . . 0.0 109.494 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 67.4 p -78.74 37.08 0.28 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.264 -0.897 . . . . 0.0 109.467 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 29.3 t -169.59 98.41 0.32 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.251 -0.905 . . . . 0.0 109.511 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . 0.523 ' O ' ' CG ' ' A' ' 143' ' ' HIS . 58.2 p -78.28 -172.75 2.95 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.282 -0.886 . . . . 0.0 109.495 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . 0.523 ' CG ' ' O ' ' A' ' 142' ' ' THR . 78.4 m80 -158.14 -58.26 0.08 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.318 -0.864 . . . . 0.0 109.359 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . 0.405 ' O ' ' O ' ' A' ' 143' ' ' HIS . 11.1 t 53.82 100.44 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.322 -0.861 . . . . 0.0 109.503 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . 0.488 ' C ' ' H ' ' A' ' 147' ' ' PHE . 79.3 tttt -61.84 -86.14 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.273 -0.892 . . . . 0.0 109.368 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 59.0 1.82 0.22 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.256 -0.902 . . . . 0.0 109.563 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . 0.488 ' H ' ' C ' ' A' ' 145' ' ' LYS . 60.4 t80 -57.31 124.21 18.07 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.111 -0.993 . . . . 0.0 109.47 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 37.1 t -70.07 86.54 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.241 -0.912 . . . . 0.0 109.506 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 98.0 p -70.87 109.52 5.07 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.286 -0.883 . . . . 0.0 109.462 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 62.3 m -68.09 102.57 1.35 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.29 -0.881 . . . . 0.0 109.424 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 68.6 p -169.56 -76.56 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.237 -0.914 . . . . 0.0 109.419 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . 0.411 ' O ' ' OG1' ' A' ' 153' ' ' THR . 6.9 t -75.76 -30.08 59.04 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.258 -0.901 . . . . 0.0 109.461 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . 0.411 ' OG1' ' O ' ' A' ' 152' ' ' THR . 9.4 p 52.75 177.63 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.247 -0.908 . . . . 0.0 109.524 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 8.2 p -78.94 -31.43 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.206 -0.934 . . . . 0.0 109.533 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . 0.43 ' O ' ' O ' ' A' ' 156' ' ' ARG . 49.1 p30 -165.83 177.36 7.23 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.202 -0.936 . . . . 0.0 109.51 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . 0.43 ' O ' ' O ' ' A' ' 155' ' ' ASN . 35.6 ttm180 58.89 155.06 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.366 -0.834 . . . . 0.0 109.662 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -81.26 -161.0 26.06 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 171.55 173.95 38.84 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 10.0 t 51.55 -125.69 2.35 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.246 -1.149 . . . . 0.0 109.347 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -150.33 134.72 17.22 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.133 -0.979 . . . . 0.0 109.375 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . 0.415 ' O ' ' O ' ' A' ' 162' ' ' GLU . 16.6 tt -168.92 162.18 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.237 -0.915 . . . . 0.0 109.346 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.415 ' O ' ' O ' ' A' ' 161' ' ' ILE . 63.9 mt-10 -58.81 -158.58 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.277 -0.889 . . . . 0.0 109.503 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 41.6 m -156.02 147.58 22.81 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.253 -0.905 . . . . 0.0 109.381 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.406 ' H ' ' HD3' ' A' ' 164' ' ' LYS . 0.0 OUTLIER -89.51 91.08 8.55 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.202 -0.936 . . . . 0.0 109.408 -179.963 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . 0.481 ' N ' ' ND1' ' A' ' 165' ' ' HIS . 0.9 OUTLIER -65.55 133.65 51.67 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.231 -0.918 . . . . 0.0 109.4 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 118.071 -0.966 . . . . 0.0 109.448 -179.938 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 8.9 tpt . . . . . 0 N--CA 1.491 1.596 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -71.93 130.24 16.7 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.7 t -169.66 -34.73 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.274 -1.133 . . . . 0.0 109.532 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 50.8 -101.71 0.1 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.213 -0.929 . . . . 0.0 109.458 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -168.47 46.26 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.224 -0.923 . . . . 0.0 109.492 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 52.2 -168.75 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.233 -0.917 . . . . 0.0 109.521 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 52.7 tt0 -66.51 -61.63 1.89 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.319 -0.863 . . . . 0.0 109.561 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 69.8 64.81 2.78 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.445 -1.462 . . . . 0.0 109.445 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.4 m -67.78 -51.85 44.04 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.249 -1.147 . . . . 0.0 109.504 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.408 HG12 ' N ' ' A' ' 11' ' ' SER . 41.4 t -147.98 156.84 9.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.266 -0.896 . . . . 0.0 109.35 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.423 ' OG ' ' N ' ' A' ' 12' ' ' SER . 79.1 p -164.53 -94.69 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.191 -0.943 . . . . 0.0 109.487 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.423 ' N ' ' OG ' ' A' ' 11' ' ' SER . 35.3 t -68.61 -22.92 64.41 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.308 -0.87 . . . . 0.0 109.389 179.855 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 62.94 67.92 1.87 Allowed Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 73.5 p -150.17 -16.63 0.25 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.271 -1.134 . . . . 0.0 109.243 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 89.0 mttt 50.51 67.2 0.96 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.252 -0.905 . . . . 0.0 109.407 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -69.8 179.64 2.14 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.27 -0.894 . . . . 0.0 109.54 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -77.48 -27.39 51.96 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.277 -0.889 . . . . 0.0 109.516 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 84.6 m-85 48.77 75.07 0.15 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.262 -0.899 . . . . 0.0 109.571 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 62.6 t-80 -170.54 -73.67 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.277 -0.889 . . . . 0.0 109.499 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 63.7 p -68.0 121.83 16.93 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.227 -0.921 . . . . 0.0 109.454 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.405 ' C ' ' H ' ' A' ' 23' ' ' LEU . . . -179.76 -155.41 15.22 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 179.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.412 ' O ' ' N ' ' A' ' 24' ' ' VAL . 44.4 mtmt -60.36 -5.39 1.13 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.2 -1.176 . . . . 0.0 109.433 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.405 ' H ' ' C ' ' A' ' 21' ' ' GLY . 16.3 mt -69.5 69.5 0.26 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.208 -0.932 . . . . 0.0 109.523 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.549 HG23 ' N ' ' A' ' 25' ' ' THR . 34.0 m -150.71 -45.36 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 121.28 -0.887 . . . . 0.0 109.354 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.549 ' N ' HG23 ' A' ' 24' ' ' VAL . 40.7 p 46.82 94.06 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.248 -0.907 . . . . 0.0 109.847 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.8 t -168.87 141.15 2.68 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.146 -0.971 . . . . 0.0 109.673 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 51.4 tttp -55.23 170.2 0.22 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.356 -0.84 . . . . 0.0 109.033 179.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -67.1 -17.96 68.5 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.249 -1.541 . . . . 0.0 109.249 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -64.42 100.11 0.34 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.26 -1.141 . . . . 0.0 109.383 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 33.1 ttmt -66.76 -65.61 0.66 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.29 -0.881 . . . . 0.0 109.48 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 80.5 mt-10 -59.32 115.65 3.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.232 -0.917 . . . . 0.0 109.422 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 11.5 tp -68.74 -40.96 79.57 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.224 -0.923 . . . . 0.0 109.271 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 16.8 mt -76.67 147.39 37.5 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.353 -0.842 . . . . 0.0 109.357 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.428 ' O ' ' O ' ' A' ' 35' ' ' ASP . 84.1 mt -69.2 -92.63 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.159 -0.963 . . . . 0.0 109.537 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.428 ' O ' ' O ' ' A' ' 34' ' ' ILE . 2.9 m-20 60.27 147.65 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.334 -0.854 . . . . 0.0 109.644 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -159.3 88.67 0.88 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.18 -0.95 . . . . 0.0 109.428 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.455 ' CD ' ' H ' ' A' ' 37' ' ' GLU . 1.9 mp0 -64.69 -14.06 56.87 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.231 -0.918 . . . . 0.0 109.471 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.8 mtpp -67.12 -120.89 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.228 -0.92 . . . . 0.0 109.492 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.9 t 52.68 88.19 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.143 -0.973 . . . . 0.0 109.409 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 81.6 p -73.38 -14.52 61.29 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.21 -0.932 . . . . 0.0 109.51 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 41.5 m 52.13 -111.21 0.56 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.274 -0.891 . . . . 0.0 109.453 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 179.36 16.33 0.03 OUTLIER Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 52.87 23.64 2.92 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.279 -1.13 . . . . 0.0 109.526 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.43 ' O ' ' O ' ' A' ' 45' ' ' THR . 10.8 m -70.71 60.76 0.23 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.335 -0.853 . . . . 0.0 109.493 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.43 ' O ' ' O ' ' A' ' 44' ' ' THR . 4.8 p 55.9 166.01 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.335 -0.853 . . . . 0.0 109.576 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.425 ' H ' HG22 ' A' ' 46' ' ' THR . 0.0 OUTLIER -90.9 117.48 29.54 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.216 -0.927 . . . . 0.0 109.486 -179.896 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 34.3 m -66.26 -49.44 67.13 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.216 -0.928 . . . . 0.0 109.298 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.581 ' CG ' HH11 ' A' ' 48' ' ' ARG . 3.4 mtt-85 -112.42 143.54 43.37 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -111.45 127.6 55.74 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.448 -0.782 . . . . 0.0 109.721 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.444 ' O ' ' O ' ' A' ' 51' ' ' CYS . 50.7 m -63.55 -52.66 60.15 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.215 -0.928 . . . . 0.0 109.862 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.444 ' O ' ' O ' ' A' ' 50' ' ' SER . 36.8 t -48.01 -93.85 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.147 -0.971 . . . . 0.0 109.187 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 11.3 t -63.09 138.29 58.51 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.053 -1.029 . . . . 0.0 108.369 179.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -73.06 104.81 4.27 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 120.918 -1.114 . . . . 0.0 109.543 -179.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 21.1 t -125.12 116.19 46.28 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 41.5 mm -126.64 121.6 58.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 22.8 m -128.17 110.59 12.58 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.445 -0.784 . . . . 0.0 109.193 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.528 ' H ' ' HB ' ' A' ' 69' ' ' THR . 7.3 mtmt -124.9 113.91 18.48 Favored 'General case' 0 N--CA 1.511 2.624 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 178.435 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 59.0 p -114.31 132.43 56.18 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.551 -0.718 . . . . 0.0 109.776 -179.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 59' ' ' VAL . 2.8 m -131.58 122.79 50.98 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.156 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 65.2 p -107.41 122.96 47.66 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.731 -0.605 . . . . 0.0 110.015 -179.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.444 ' ND2' ' O ' ' A' ' 65' ' ' ARG . 3.4 m-20 -113.2 145.16 41.46 Favored 'General case' 0 N--CA 1.511 2.61 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 179.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.59 -28.33 64.78 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 119.956 -1.715 . . . . 0.0 112.319 -177.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -67.33 2.38 1.7 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 120.536 -1.353 . . . . 0.0 109.827 -178.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.25 7.27 58.4 Favored Glycine 0 N--CA 1.496 2.681 0 N-CA-C 110.519 -1.032 . . . . 0.0 110.519 178.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.444 ' O ' ' ND2' ' A' ' 61' ' ' ASN . 16.0 mmm180 -95.98 109.46 21.84 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.876 -1.367 . . . . 0.0 108.344 179.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.7 p -134.67 109.24 8.49 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.347 -0.846 . . . . 0.0 109.336 -179.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -96.8 132.02 42.94 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.28 -0.887 . . . . 0.0 110.221 -179.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.522 HG22 ' H ' ' A' ' 70' ' ' LYS . 81.1 m -108.82 107.25 17.6 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.468 -0.77 . . . . 0.0 109.495 179.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.528 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 6.3 m -94.31 32.29 1.57 Allowed 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 178.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.522 ' H ' HG22 ' A' ' 68' ' ' THR . 55.0 tttm -73.54 68.83 1.19 Allowed 'General case' 0 N--CA 1.504 2.249 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.276 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -107.5 147.44 30.5 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.529 -0.732 . . . . 0.0 109.598 -179.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 38.6 t -128.08 125.99 65.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 20.5 t -128.19 116.06 40.81 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 CA-C-O 122.238 1.018 . . . . 0.0 109.351 179.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.491 ' O ' ' N ' ' A' ' 78' ' ' GLY . 1.1 ptpp? -76.77 41.57 0.27 Allowed 'General case' 0 C--N 1.287 -2.115 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.593 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.422 ' OG ' ' O ' ' A' ' 74' ' ' LYS . 11.4 p 55.9 -146.54 0.56 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.123 -0.985 . . . . 0.0 109.502 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.403 ' N ' ' OG ' ' A' ' 75' ' ' SER . 71.9 mt-10 -69.71 -35.17 74.82 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.249 -0.907 . . . . 0.0 109.286 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -171.46 34.98 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.299 -0.875 . . . . 0.0 109.086 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.491 ' N ' ' O ' ' A' ' 74' ' ' LYS . . . 54.6 67.64 2.08 Favored Glycine 0 N--CA 1.489 2.205 0 N-CA-C 109.327 -1.509 . . . . 0.0 109.327 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 71.8 m -47.88 -90.6 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.28 -1.129 . . . . 0.0 109.561 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 38.4 t0 -83.62 27.16 0.63 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.244 -0.91 . . . . 0.0 109.542 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 66.0 m -150.76 32.29 0.62 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.24 -0.912 . . . . 0.0 109.833 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.522 ' O ' ' N ' ' A' ' 84' ' ' ALA . . . -169.2 -59.41 0.03 OUTLIER Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.81 -1.316 . . . . 0.0 109.81 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 6.9 t70 66.5 -41.21 0.38 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.485 -1.009 . . . . 0.0 109.635 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.522 ' N ' ' O ' ' A' ' 82' ' ' GLY . . . -159.36 173.91 15.54 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.094 -1.004 . . . . 0.0 109.471 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.53 ' O ' ' N ' ' A' ' 87' ' ' ASP . 26.6 t70 -167.07 6.29 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.304 -0.873 . . . . 0.0 109.516 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.487 ' O ' ' N ' ' A' ' 88' ' ' TRP . 2.8 m-85 64.73 -67.64 0.11 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.369 -0.832 . . . . 0.0 109.567 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.53 ' N ' ' O ' ' A' ' 85' ' ' ASP . 2.9 p30 42.44 22.23 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.564 -0.71 . . . . 0.0 110.311 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . 0.487 ' N ' ' O ' ' A' ' 86' ' ' PHE . 6.7 m0 -91.73 -52.93 4.51 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.143 -0.973 . . . . 0.0 109.307 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 61.7 t60 -81.97 138.19 34.99 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.243 -0.911 . . . . 0.0 109.453 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.582 ' ND1' ' N ' ' A' ' 91' ' ' THR . 11.1 p80 -173.53 -52.44 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.293 -0.88 . . . . 0.0 109.536 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.582 ' N ' ' ND1' ' A' ' 90' ' ' HIS . 5.6 t -80.24 -130.23 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.267 -0.896 . . . . 0.0 109.657 -179.751 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.494 ' N ' HG23 ' A' ' 91' ' ' THR . 95.7 m-85 -155.14 77.06 5.04 Favored Pre-proline 0 N--CA 1.494 1.727 0 O-C-N 121.195 -0.941 . . . . 0.0 109.609 -179.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -64.87 -50.1 2.5 Favored 'Trans proline' 0 C--N 1.319 -1.007 0 C-N-CA 121.337 1.358 . . . . 0.0 109.746 -179.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 23.1 p 53.97 -153.43 0.28 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.347 -0.845 . . . . 0.0 109.535 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 52.4 mtp180 -151.32 -46.08 0.11 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.226 -0.921 . . . . 0.0 109.329 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -179.7 120.96 0.71 Allowed Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.452 -1.459 . . . . 0.0 109.452 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -170.83 51.45 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.29 -1.124 . . . . 0.0 109.478 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.575 ' N ' HD12 ' A' ' 98' ' ' LEU . 7.8 mp -71.11 -111.47 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.33 -0.856 . . . . 0.0 109.251 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.436 ' O ' ' O ' ' A' ' 100' ' ' ASP . 73.1 m-20 -80.03 -108.12 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.219 -0.926 . . . . 0.0 109.406 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.436 ' O ' ' O ' ' A' ' 99' ' ' ASP . 7.8 m-20 58.12 111.26 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.298 -0.876 . . . . 0.0 109.603 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -59.42 -20.38 54.58 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.247 -0.908 . . . . 0.0 109.359 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -143.91 125.71 15.17 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.277 -0.89 . . . . 0.0 109.391 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.435 ' CD2' ' H ' ' A' ' 103' ' ' HIS . 46.0 m-70 -58.85 -46.57 87.43 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.269 -0.894 . . . . 0.0 109.407 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 78.9 mtm180 -64.4 176.5 1.06 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.302 -0.874 . . . . 0.0 109.511 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -169.58 121.91 0.72 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.319 -0.863 . . . . 0.0 109.319 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.466 ' CB ' ' NZ ' ' A' ' 106' ' ' LYS . 0.3 OUTLIER -65.92 133.25 50.48 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.246 -0.909 . . . . 0.0 109.414 179.952 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -78.95 86.38 4.83 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.207 -0.933 . . . . 0.0 109.443 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -167.35 65.61 0.08 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.198 -0.939 . . . . 0.0 109.529 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -65.16 -49.27 70.5 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.223 -0.923 . . . . 0.0 109.432 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . 0.49 ' CG ' ' N ' ' A' ' 111' ' ' THR . 37.5 t80 -127.81 -170.82 2.3 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.516 -0.74 . . . . 0.0 109.221 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . 0.49 ' N ' ' CG ' ' A' ' 110' ' ' PHE . 78.0 p -48.43 113.87 0.84 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.156 -0.965 . . . . 0.0 109.542 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -69.75 -165.45 0.09 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.238 -0.914 . . . . 0.0 109.483 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 68.5 m -64.72 -83.57 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.219 -0.925 . . . . 0.0 109.44 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 13.5 t 52.63 51.55 15.83 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.238 -0.914 . . . . 0.0 109.468 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 63.5 t60 -64.4 148.19 51.0 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.335 -0.853 . . . . 0.0 109.412 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -167.28 -126.59 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.218 -0.926 . . . . 0.0 109.292 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 30.2 p90 -173.11 154.06 2.67 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.185 -0.947 . . . . 0.0 109.513 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -157.79 -88.27 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.259 -0.901 . . . . 0.0 109.392 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -46.23 148.53 2.25 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.865 -1.294 . . . . 0.0 109.865 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -160.84 -38.56 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.279 -1.13 . . . . 0.0 109.569 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 7.1 p 54.31 -169.34 0.06 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.187 -0.946 . . . . 0.0 109.511 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -161.16 -38.18 0.02 OUTLIER Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.582 ' N ' HD12 ' A' ' 123' ' ' LEU . 7.7 mp -80.57 147.37 30.81 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.179 -1.189 . . . . 0.0 109.221 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.534 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -68.44 162.15 64.09 Favored Pre-proline 0 N--CA 1.49 1.571 0 O-C-N 121.294 -0.879 . . . . 0.0 108.836 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.534 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 1.9 Cg_endo -57.11 -61.23 0.33 Allowed 'Trans proline' 0 C--N 1.319 -0.99 0 C-N-CA 121.372 1.381 . . . . 0.0 109.726 179.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.597 ' H ' ' CD ' ' A' ' 126' ' ' GLU . 13.4 mp0 -52.01 127.9 22.79 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.374 -0.829 . . . . 0.0 109.621 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . 0.522 ' O ' ' N ' ' A' ' 129' ' ' ALA . 95.6 m-85 -79.12 135.62 36.89 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.295 -0.878 . . . . 0.0 109.419 179.9 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.15 71.76 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.186 -0.946 . . . . 0.0 109.468 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.522 ' N ' ' O ' ' A' ' 127' ' ' PHE . . . -79.43 0.68 28.39 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.317 -0.865 . . . . 0.0 109.448 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 11.0 tp -56.22 -48.39 76.56 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.266 -0.896 . . . . 0.0 109.314 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -176.59 177.34 48.02 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -166.08 -77.21 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.333 -1.098 . . . . 0.0 109.364 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 98.7 p -57.0 125.96 25.0 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.161 -0.962 . . . . 0.0 109.422 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -67.79 -148.9 0.16 Allowed Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.509 -1.437 . . . . 0.0 109.509 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 46.6 t -64.51 -30.88 71.91 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.235 -1.156 . . . . 0.0 109.515 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.458 ' C ' ' H ' ' A' ' 138' ' ' SER . 12.3 m 53.13 70.61 0.57 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.253 -0.904 . . . . 0.0 109.431 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 49.2 m -75.27 34.3 0.11 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.226 -0.921 . . . . 0.0 109.535 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.458 ' H ' ' C ' ' A' ' 136' ' ' SER . 30.0 t -171.36 142.65 1.72 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.203 -0.936 . . . . 0.0 109.482 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -168.09 -43.98 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.3 -0.875 . . . . 0.0 109.438 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . 0.429 ' O ' ' O ' ' A' ' 141' ' ' SER . 34.6 m -62.92 -28.91 70.38 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.226 -0.921 . . . . 0.0 109.402 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . 0.429 ' O ' ' O ' ' A' ' 140' ' ' THR . 2.5 m 59.83 151.74 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.362 -0.836 . . . . 0.0 109.568 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . 0.419 ' OG1' ' O ' ' A' ' 141' ' ' SER . 5.5 m -166.7 48.48 0.07 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.27 -0.894 . . . . 0.0 109.306 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . 0.481 ' N ' ' ND1' ' A' ' 143' ' ' HIS . 0.0 OUTLIER -80.73 85.38 6.1 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.175 -0.953 . . . . 0.0 109.476 -179.961 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 45.8 m -62.51 -60.96 2.8 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.309 -0.869 . . . . 0.0 109.431 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 11.6 ttmm -170.09 -53.84 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.129 -0.982 . . . . 0.0 109.469 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 36.7 tp60 -170.77 -76.78 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.237 -0.914 . . . . 0.0 109.484 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -82.03 107.0 14.39 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.177 -0.952 . . . . 0.0 109.419 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 39.6 t -75.75 -18.83 15.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.291 -0.88 . . . . 0.0 109.418 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 55.1 m -55.16 -52.99 61.53 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.251 -0.906 . . . . 0.0 109.474 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . 0.423 ' OG ' ' N ' ' A' ' 151' ' ' SER . 32.0 t -168.43 -171.11 1.38 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.186 -0.946 . . . . 0.0 109.501 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . 0.423 ' N ' ' OG ' ' A' ' 150' ' ' SER . 66.6 m -165.69 59.77 0.11 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.347 -0.846 . . . . 0.0 109.378 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . 0.437 ' OG1' ' N ' ' A' ' 153' ' ' THR . 2.0 t -58.97 -174.49 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.239 -0.913 . . . . 0.0 109.352 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . 0.437 ' N ' ' OG1' ' A' ' 152' ' ' THR . 81.9 p -61.61 150.18 37.0 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.197 -0.94 . . . . 0.0 109.472 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 30.4 m -63.27 -10.95 7.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.279 -0.888 . . . . 0.0 109.443 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -56.7 115.72 2.72 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.251 -0.906 . . . . 0.0 109.482 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . 0.576 ' CG ' HH11 ' A' ' 156' ' ' ARG . 3.4 mtt-85 -66.03 -55.74 15.09 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.231 -0.918 . . . . 0.0 109.366 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -175.59 89.85 0.08 OUTLIER Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.511 -1.435 . . . . 0.0 109.511 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . 0.489 ' C ' ' H ' ' A' ' 160' ' ' ALA . . . -164.08 135.57 3.83 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.514 -1.435 . . . . 0.0 109.514 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 4.9 m 56.58 4.63 0.16 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.255 -1.144 . . . . 0.0 109.533 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.489 ' H ' ' C ' ' A' ' 158' ' ' GLY . . . -86.86 -7.75 57.93 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.194 -0.941 . . . . 0.0 109.549 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 3.5 tp -160.16 -32.15 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.209 -0.932 . . . . 0.0 109.335 -179.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -65.43 -34.1 77.5 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.178 -0.951 . . . . 0.0 109.611 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 45.0 t -64.7 170.0 4.52 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.226 -0.921 . . . . 0.0 109.546 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -63.95 141.49 58.75 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.261 -0.899 . . . . 0.0 109.444 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 47.8 m80 -65.51 103.43 0.84 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.206 -0.934 . . . . 0.0 109.456 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 . . . . . 0 N--CA 1.489 1.514 0 CA-C-O 118.036 -0.983 . . . . 0.0 109.509 179.982 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.575 ' N ' ' SD ' ' A' ' 1' ' ' MET . 2.0 mpt? . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 65.81 43.29 94.25 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.524 -1.431 . . . . 0.0 109.524 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 40.5 m -71.15 -21.59 62.16 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.236 -1.156 . . . . 0.0 109.514 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 -61.51 -160.26 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.192 -0.943 . . . . 0.0 109.47 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -168.91 33.35 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.171 -0.956 . . . . 0.0 109.541 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 48.4 tt0 -153.64 -38.14 0.1 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.238 -0.914 . . . . 0.0 109.353 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -69.42 -147.08 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.182 -0.949 . . . . 0.0 109.414 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -173.79 176.05 46.35 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 51.4 m -60.79 113.9 2.74 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.231 -1.158 . . . . 0.0 109.426 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.9 p -65.8 -32.56 58.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.279 -0.888 . . . . 0.0 109.485 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.7 t -171.56 152.81 3.28 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.268 -0.895 . . . . 0.0 109.43 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 91.2 p -66.63 -165.6 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.199 -0.938 . . . . 0.0 109.459 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 65.82 49.7 57.64 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.533 ' O ' ' N ' ' A' ' 16' ' ' GLN . 69.1 p -58.94 160.45 5.93 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.211 -1.17 . . . . 0.0 109.454 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 9.8 ttmm 60.25 -75.4 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.479 -0.763 . . . . 0.0 109.746 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.533 ' N ' ' O ' ' A' ' 14' ' ' THR . 4.7 tp-100 57.21 53.89 7.32 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.278 -0.889 . . . . 0.0 109.46 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -74.64 -28.68 60.97 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.274 -0.891 . . . . 0.0 109.398 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.591 ' CD2' ' N ' ' A' ' 19' ' ' HIS . 54.9 t80 -165.85 170.49 13.78 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.223 -0.923 . . . . 0.0 109.469 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.591 ' N ' ' CD2' ' A' ' 18' ' ' PHE . 41.3 t60 -166.98 124.9 1.3 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.27 -0.894 . . . . 0.0 109.547 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 48.3 m -72.63 153.19 41.36 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.294 -0.879 . . . . 0.0 109.479 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -170.7 125.4 1.22 Allowed Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.45 ' C ' ' H ' ' A' ' 24' ' ' VAL . 15.6 ptpt -172.88 -2.49 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.196 -1.179 . . . . 0.0 109.493 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.46 ' C ' ' H ' ' A' ' 25' ' ' THR . 21.2 mt -72.51 39.75 0.08 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.228 -0.92 . . . . 0.0 109.416 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.461 ' O ' ' N ' ' A' ' 26' ' ' THR . 29.8 m -71.72 40.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.223 -0.923 . . . . 0.0 109.462 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.46 ' H ' ' C ' ' A' ' 23' ' ' LEU . 1.2 t -69.23 62.32 0.13 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.23 -0.919 . . . . 0.0 109.46 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.461 ' N ' ' O ' ' A' ' 24' ' ' VAL . 37.2 m -57.61 -50.31 73.56 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.241 -0.912 . . . . 0.0 109.398 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -72.77 80.68 1.14 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.28 -0.887 . . . . 0.0 109.391 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.06 76.49 0.06 OUTLIER Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -71.24 -16.47 62.49 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.317 -1.108 . . . . 0.0 109.328 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.489 ' CB ' ' NZ ' ' A' ' 30' ' ' LYS . 9.1 mtmp? -152.97 83.14 1.21 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.326 -0.859 . . . . 0.0 109.18 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 63.4 mt-10 -151.05 39.82 0.7 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.292 -0.88 . . . . 0.0 109.472 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.588 ' H ' HD23 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -83.68 -3.5 57.81 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.192 -0.943 . . . . 0.0 108.997 179.94 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 26.1 mt 55.65 77.37 0.23 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.311 -0.868 . . . . 0.0 109.547 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 25.0 pt -66.17 -155.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.266 -0.896 . . . . 0.0 109.18 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -61.23 167.26 3.23 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.934 -1.104 . . . . 0.0 109.417 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 32.7 m120 -66.86 143.04 57.1 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.239 -0.913 . . . . 0.0 109.463 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.437 ' N ' ' CD ' ' A' ' 37' ' ' GLU . 3.3 mp0 -71.69 152.47 42.77 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.374 -0.829 . . . . 0.0 109.508 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 45.9 mtmt -72.95 166.72 22.49 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.252 -0.905 . . . . 0.0 109.486 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.0 p -69.79 143.68 14.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.205 -0.934 . . . . 0.0 109.439 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 25.8 m 53.13 95.94 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.26 -0.9 . . . . 0.0 109.413 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 47.8 t -61.45 -170.29 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.28 -0.887 . . . . 0.0 109.474 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 70.19 147.63 0.36 Allowed Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 22.7 t-160 -59.67 106.03 0.43 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.241 -1.153 . . . . 0.0 109.298 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.533 ' OG1' ' N ' ' A' ' 45' ' ' THR . 2.2 t -64.33 -130.87 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.169 -0.957 . . . . 0.0 109.529 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.533 ' N ' ' OG1' ' A' ' 44' ' ' THR . 1.8 t -173.91 -26.94 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.11 -0.994 . . . . 0.0 109.433 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.403 ' C ' ' H ' ' A' ' 48' ' ' ARG . 5.4 t -72.92 39.83 0.09 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.295 -0.878 . . . . 0.0 109.346 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.45 ' H ' ' C ' ' A' ' 45' ' ' THR . 2.6 t -62.55 -3.52 1.5 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.351 -0.843 . . . . 0.0 109.477 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.403 ' H ' ' C ' ' A' ' 46' ' ' THR . 33.6 ptt180 -145.99 143.18 29.31 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.14 -0.975 . . . . 0.0 109.471 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.568 ' CG ' HH11 ' A' ' 49' ' ' ARG . 3.6 mtt-85 -93.41 144.58 25.2 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.299 -0.876 . . . . 0.0 109.806 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.4 m 54.42 175.42 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.286 -0.884 . . . . 0.0 110.151 179.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 32.3 t -62.35 -73.27 0.11 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.375 -0.828 . . . . 0.0 109.398 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 76.6 p -47.59 144.66 3.04 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.207 -0.933 . . . . 0.0 108.912 179.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.415 ' O ' ' O ' ' A' ' 73' ' ' VAL . 24.9 mtpp -75.19 102.65 5.06 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 120.895 -1.128 . . . . 0.0 109.794 -178.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.578 HG13 ' O ' ' A' ' 54' ' ' VAL . 11.4 p -124.67 120.51 59.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.429 HG23 ' O ' ' A' ' 55' ' ' ILE . 15.8 tt -126.29 130.52 71.98 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 24.4 m -128.57 117.89 22.04 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.546 -0.721 . . . . 0.0 109.483 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.544 ' H ' ' HB ' ' A' ' 69' ' ' THR . 26.4 ttpt -126.52 114.33 17.98 Favored 'General case' 0 N--CA 1.519 3.015 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 177.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 54.7 m -119.13 137.51 53.54 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.547 -0.721 . . . . 0.0 109.902 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 59' ' ' VAL . 2.8 m -132.25 120.79 44.4 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.78 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 33.9 p -109.66 133.5 53.04 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.739 -0.6 . . . . 0.0 109.555 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 18.2 t30 -134.65 169.59 17.08 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 121.352 -0.843 . . . . 0.0 109.424 179.463 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.13 -42.78 99.15 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.811 -1.18 . . . . 0.0 112.552 -177.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -68.8 2.65 2.41 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.393 -1.442 . . . . 0.0 110.457 -177.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.537 ' O ' ' N ' ' A' ' 66' ' ' THR . . . 95.01 10.89 57.08 Favored Glycine 0 N--CA 1.494 2.511 0 N-CA-C 110.059 -1.217 . . . . 0.0 110.059 179.123 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.582 ' CG ' HH11 ' A' ' 65' ' ' ARG . 0.1 OUTLIER -64.34 78.64 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.42 0 O-C-N 120.785 -1.421 . . . . 0.0 107.926 179.133 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.537 ' N ' ' O ' ' A' ' 64' ' ' GLY . 71.0 p -109.68 75.85 0.96 Allowed 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 -179.209 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -93.3 115.89 28.46 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.439 -0.788 . . . . 0.0 109.097 -179.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.7 m -97.74 109.99 22.64 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.186 -0.946 . . . . 0.0 109.703 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.544 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 3.6 m -85.27 35.09 0.58 Allowed 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 178.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 40.4 pttt -64.45 61.53 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.536 ' N ' ' O ' ' A' ' 69' ' ' THR . 13.2 mm-40 -88.09 150.21 23.5 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.061 -1.025 . . . . 0.0 109.547 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 15.8 t -129.0 116.24 39.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.415 ' O ' ' O ' ' A' ' 53' ' ' LYS . 98.7 t -109.71 129.82 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 CA-C-O 122.142 0.973 . . . . 0.0 109.151 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -86.54 163.56 17.41 Favored 'General case' 0 C--N 1.29 -2.018 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.527 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 70.0 m -63.6 112.09 2.66 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.303 -0.873 . . . . 0.0 109.53 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -85.33 -11.19 55.22 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.217 -0.927 . . . . 0.0 109.58 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -158.04 36.93 0.25 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.237 -0.914 . . . . 0.0 109.635 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -83.94 -28.65 33.9 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.308 -1.517 . . . . 0.0 109.308 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 11.3 t 53.83 13.19 0.5 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.341 -1.094 . . . . 0.0 109.526 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -171.06 25.68 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.198 -0.939 . . . . 0.0 109.575 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 51.2 t -158.97 67.61 0.43 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.292 -0.88 . . . . 0.0 109.532 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 167.87 -64.43 0.19 Allowed Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -78.61 114.98 18.0 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.232 -1.158 . . . . 0.0 109.438 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.418 ' O ' ' O ' ' A' ' 85' ' ' ASP . . . -63.63 -25.24 68.13 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.261 -0.899 . . . . 0.0 109.438 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.418 ' O ' ' O ' ' A' ' 84' ' ' ALA . 20.4 t70 55.96 167.23 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.21 -0.931 . . . . 0.0 109.508 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -81.64 148.81 28.86 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.23 -0.919 . . . . 0.0 109.471 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -69.15 104.4 2.16 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.171 -0.956 . . . . 0.0 109.402 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . 0.492 ' CD1' ' N ' ' A' ' 89' ' ' HIS . 76.7 t-105 -61.39 -101.12 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.308 -0.87 . . . . 0.0 109.46 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.492 ' N ' ' CD1' ' A' ' 88' ' ' TRP . 52.4 t-80 52.2 10.71 0.13 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.212 -0.93 . . . . 0.0 109.471 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.451 ' N ' ' C ' ' A' ' 88' ' ' TRP . 64.1 t60 -63.95 134.87 55.89 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.29 -0.882 . . . . 0.0 109.54 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.411 HG22 ' N ' ' A' ' 92' ' ' PHE . 41.8 m -156.79 157.79 35.66 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.256 -0.902 . . . . 0.0 109.366 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.411 ' N ' HG22 ' A' ' 91' ' ' THR . 97.3 m-85 -57.92 148.64 58.63 Favored Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.211 -0.931 . . . . 0.0 108.981 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -57.08 -58.23 1.0 Allowed 'Trans proline' 0 C--N 1.323 -0.772 0 C-N-CA 120.893 1.062 . . . . 0.0 109.788 179.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 23.1 t -57.27 178.36 0.07 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.29 -0.882 . . . . 0.0 109.539 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -165.88 -15.89 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.339 -0.851 . . . . 0.0 109.4 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -163.22 46.15 0.32 Allowed Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -57.97 133.04 55.15 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.304 -1.115 . . . . 0.0 109.437 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 16.7 mt -69.31 -169.15 0.19 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.347 -0.846 . . . . 0.0 109.451 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -157.84 140.97 15.16 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.277 -0.889 . . . . 0.0 109.396 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -62.56 119.97 10.24 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.218 -0.926 . . . . 0.0 109.424 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 31.5 p90 -65.44 -18.79 65.59 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.321 -0.862 . . . . 0.0 109.45 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 83.0 t80 43.04 82.81 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.555 -0.716 . . . . 0.0 110.103 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -71.62 -47.96 51.12 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.164 -0.96 . . . . 0.0 109.484 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.583 HH11 ' CG ' ' A' ' 104' ' ' ARG . 0.3 OUTLIER -171.25 -60.25 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.263 -0.898 . . . . 0.0 109.355 179.959 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -158.22 142.04 15.54 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.276 -0.89 . . . . 0.0 109.365 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.469 ' O ' ' N ' ' A' ' 108' ' ' ASP . 86.3 tttt -65.76 90.12 0.12 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.222 -0.924 . . . . 0.0 109.455 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 17.7 t70 50.69 -93.93 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.244 -0.91 . . . . 0.0 109.495 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.469 ' N ' ' O ' ' A' ' 106' ' ' LYS . 25.2 t70 -169.97 133.28 1.17 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.335 -0.853 . . . . 0.0 109.471 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 69.1 m-85 -67.93 -47.1 69.66 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.255 -0.903 . . . . 0.0 109.442 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . 0.462 ' CD2' ' N ' ' A' ' 111' ' ' THR . 70.0 t80 51.47 -101.27 0.1 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.319 -0.863 . . . . 0.0 109.553 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . 0.462 ' N ' ' CD2' ' A' ' 110' ' ' PHE . 93.0 m -74.53 156.56 36.73 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.132 -0.98 . . . . 0.0 109.47 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.424 ' N ' HG22 ' A' ' 111' ' ' THR . 71.6 ttt180 -168.4 -36.56 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.272 -0.893 . . . . 0.0 109.44 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 66.1 m -165.85 48.16 0.08 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.322 -0.861 . . . . 0.0 109.479 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 88.7 p -71.25 89.06 0.86 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.192 -0.943 . . . . 0.0 109.497 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -71.12 167.18 19.86 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.164 -0.96 . . . . 0.0 109.484 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 51.3 tt0 53.27 73.0 0.39 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.319 -0.863 . . . . 0.0 109.459 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -72.77 147.41 45.57 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.228 -0.92 . . . . 0.0 109.447 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -171.03 -166.49 0.48 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.162 -0.961 . . . . 0.0 109.554 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.416 ' O ' ' N ' ' A' ' 121' ' ' THR . . . -179.11 40.27 0.08 OUTLIER Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.409 -1.476 . . . . 0.0 109.409 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -70.03 66.73 0.27 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.257 -1.143 . . . . 0.0 109.528 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.416 ' N ' ' O ' ' A' ' 119' ' ' GLY . 73.8 p -55.85 179.27 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.184 -0.947 . . . . 0.0 109.483 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -69.33 150.48 49.98 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.43 -1.468 . . . . 0.0 109.43 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 14.8 mt -68.59 148.42 50.52 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.123 -1.222 . . . . 0.0 109.681 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.54 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -66.7 162.31 52.63 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.33 -0.856 . . . . 0.0 108.844 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.54 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 2.1 Cg_endo -56.56 -45.14 39.31 Favored 'Trans proline' 0 C--N 1.32 -0.968 0 C-N-CA 121.436 1.424 . . . . 0.0 110.009 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 58.36 169.98 0.05 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.258 -0.901 . . . . 0.0 109.311 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . 0.474 ' CD1' ' O ' ' A' ' 127' ' ' PHE . 52.3 p90 -75.27 133.22 41.38 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.251 -0.906 . . . . 0.0 109.478 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -169.14 -88.77 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.199 -0.938 . . . . 0.0 109.407 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -162.94 -168.84 1.87 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.266 -0.896 . . . . 0.0 109.47 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 44.6 tp -166.61 75.88 0.18 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.222 -0.924 . . . . 0.0 109.415 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 65.08 -126.93 32.2 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.753 -1.339 . . . . 0.0 109.753 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -66.83 86.99 0.13 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.26 -1.141 . . . . 0.0 109.694 -179.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 71.7 m -84.51 158.4 20.99 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.223 -0.923 . . . . 0.0 109.335 179.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 177.0 -166.5 37.23 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 31.4 t -166.96 -11.25 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.279 -1.13 . . . . 0.0 109.4 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.2 t 53.62 -119.64 1.53 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.305 -0.872 . . . . 0.0 109.44 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 93.5 p -167.62 139.06 3.03 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.282 -0.886 . . . . 0.0 109.49 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.47 ' OG ' ' N ' ' A' ' 139' ' ' LYS . 30.9 t -171.73 -168.55 0.6 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.273 -0.892 . . . . 0.0 109.438 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.47 ' N ' ' OG ' ' A' ' 138' ' ' SER . 7.5 mtpm? 50.99 -179.64 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.251 -0.905 . . . . 0.0 109.498 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 35.0 m -72.56 137.12 46.02 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.266 -0.896 . . . . 0.0 109.503 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 28.6 t -172.97 -63.81 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.248 -0.908 . . . . 0.0 109.404 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 77.0 p -64.87 114.76 4.73 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.236 -0.915 . . . . 0.0 109.521 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.09 -143.76 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.231 -0.918 . . . . 0.0 109.445 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 43.8 t -62.42 176.55 0.61 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.206 -0.934 . . . . 0.0 109.542 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm 54.3 80.08 0.13 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.287 -0.883 . . . . 0.0 109.429 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -72.42 -80.4 0.06 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.263 -0.898 . . . . 0.0 109.374 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -171.29 -29.21 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.233 -0.917 . . . . 0.0 109.414 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 38.7 t -58.8 -75.38 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.275 -0.891 . . . . 0.0 109.473 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 33.3 t -70.16 116.96 11.13 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.221 -0.924 . . . . 0.0 109.436 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 30.7 t -170.07 30.11 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.271 -0.893 . . . . 0.0 109.404 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 50.6 m -79.84 -64.53 1.16 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.264 -0.898 . . . . 0.0 109.368 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 80.5 p -70.12 -30.85 68.14 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.296 -0.877 . . . . 0.0 109.543 -179.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 16.3 m -69.0 102.4 1.6 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.196 -0.94 . . . . 0.0 109.494 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 11.1 p -170.97 -34.15 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.272 -0.892 . . . . 0.0 109.391 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . 0.502 ' C ' ' H ' ' A' ' 157' ' ' GLY . 77.2 m-20 51.48 -105.61 0.22 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.281 -0.887 . . . . 0.0 109.545 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . 0.565 ' CG ' HH11 ' A' ' 156' ' ' ARG . 0.2 OUTLIER 60.99 -1.47 0.25 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.347 -0.846 . . . . 0.0 109.588 -179.867 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . 0.502 ' H ' ' C ' ' A' ' 155' ' ' ASN . . . -179.07 -166.14 34.52 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 46.89 -139.6 7.64 Favored Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.675 -1.37 . . . . 0.0 109.675 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 13.0 t 51.05 -137.96 1.1 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.263 -1.139 . . . . 0.0 109.53 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . 57.19 45.39 20.63 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.334 -0.854 . . . . 0.0 109.455 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 74.7 mt -67.65 101.23 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.268 -0.895 . . . . 0.0 109.472 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -73.05 158.03 36.19 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.304 -0.872 . . . . 0.0 109.515 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 41.6 t -162.43 0.45 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.186 -0.946 . . . . 0.0 109.439 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 59.8 mttm 52.95 -151.2 0.32 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.319 -0.863 . . . . 0.0 109.476 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 76.1 t60 -59.75 127.66 33.05 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.237 -0.915 . . . . 0.0 109.463 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 57.3 t80 . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 118.016 -0.992 . . . . 0.0 109.441 179.966 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.0 mtt . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -68.11 136.0 30.32 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 77.3 p -68.79 89.47 0.39 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.207 -1.173 . . . . 0.0 109.502 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -49.59 -54.49 17.96 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.26 -0.9 . . . . 0.0 109.498 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -169.92 -28.03 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.252 -0.905 . . . . 0.0 109.548 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.427 ' CD ' ' N ' ' A' ' 6' ' ' GLU . 20.7 mp0 -66.5 156.87 33.65 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.294 -0.879 . . . . 0.0 109.54 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 56.61 41.14 28.88 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.342 -0.849 . . . . 0.0 109.408 -179.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 62.83 141.78 0.01 OUTLIER Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.415 ' O ' ' O ' ' A' ' 10' ' ' VAL . 40.9 t -71.55 -42.08 68.31 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.328 -1.101 . . . . 0.0 109.386 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.415 ' O ' ' O ' ' A' ' 9' ' ' SER . 16.9 t 53.53 99.73 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.25 -0.906 . . . . 0.0 109.436 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.2 m -163.97 125.38 2.3 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.288 -0.882 . . . . 0.0 109.434 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.5 t -168.68 -52.52 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.198 -0.939 . . . . 0.0 109.435 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -69.56 70.49 0.52 Allowed Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.4 ' OG1' ' N ' ' A' ' 15' ' ' LYS . 82.6 p -66.41 -105.49 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.214 -1.168 . . . . 0.0 109.485 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.4 ' N ' ' OG1' ' A' ' 14' ' ' THR . 22.8 pttm -173.0 -24.31 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.283 -0.885 . . . . 0.0 109.514 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 54.2 tt0 -62.1 98.96 0.11 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.28 -0.887 . . . . 0.0 109.532 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.646 ' CD ' ' H ' ' A' ' 17' ' ' GLU . 1.7 pm0 -73.29 -28.06 61.9 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.294 -0.879 . . . . 0.0 109.437 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.48 ' CD2' ' N ' ' A' ' 19' ' ' HIS . 80.2 t80 -170.3 -97.51 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.184 -0.947 . . . . 0.0 109.532 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.505 ' O ' ' N ' ' A' ' 21' ' ' GLY . 56.4 t-80 51.1 59.39 4.64 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.207 -0.933 . . . . 0.0 109.525 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.1 m 66.25 -46.26 0.42 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.605 -0.684 . . . . 0.0 109.764 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.505 ' N ' ' O ' ' A' ' 19' ' ' HIS . . . 72.17 46.38 35.39 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 94.2 mttt 52.55 -174.1 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.254 -1.145 . . . . 0.0 109.48 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 15.4 tp -71.27 -78.51 0.08 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.232 -0.917 . . . . 0.0 109.165 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 8.3 p -67.65 140.36 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.254 -0.904 . . . . 0.0 109.411 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.402 ' O ' ' OG1' ' A' ' 26' ' ' THR . 61.6 p -77.47 -167.59 0.97 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.257 -0.902 . . . . 0.0 109.494 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.402 ' OG1' ' O ' ' A' ' 25' ' ' THR . 54.6 m -166.29 109.71 0.77 Allowed 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.241 -0.912 . . . . 0.0 109.486 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.1 pttm -170.53 12.16 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.284 -0.885 . . . . 0.0 109.489 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 176.01 -159.28 26.59 Favored Glycine 0 N--CA 1.49 2.261 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.3 m-20 -104.47 -64.99 1.06 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.437 -1.037 . . . . 0.0 109.36 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -71.01 114.01 8.63 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.335 -0.853 . . . . 0.0 109.473 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.411 ' C ' ' H ' ' A' ' 33' ' ' LEU . 46.5 mt-10 -65.17 126.01 26.79 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.173 -0.954 . . . . 0.0 109.458 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.562 ' N ' HD12 ' A' ' 32' ' ' LEU . 8.2 mp -64.79 -0.14 1.37 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.238 -0.914 . . . . 0.0 109.162 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.426 ' O ' ' O ' ' A' ' 32' ' ' LEU . 10.7 tp 53.88 100.33 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.338 -0.851 . . . . 0.0 109.456 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 15.6 mm -58.0 160.52 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.296 -0.878 . . . . 0.0 109.463 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -160.84 -44.09 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.32 -0.863 . . . . 0.0 109.32 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -157.51 84.05 0.9 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.379 -0.826 . . . . 0.0 109.388 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.0 tt0 -73.48 -68.45 0.5 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.255 -0.903 . . . . 0.0 109.709 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -95.36 -171.72 2.47 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.202 -0.936 . . . . 0.0 109.354 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 19.2 m -77.67 -13.62 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.27 -0.894 . . . . 0.0 109.376 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 20.5 p 50.1 40.61 22.05 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.231 -0.918 . . . . 0.0 109.474 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 41.4 t -75.51 -8.9 57.95 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.264 -0.897 . . . . 0.0 109.481 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 68.93 -135.0 27.8 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 53.35 -172.41 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.267 -1.137 . . . . 0.0 109.436 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 55.9 m -85.61 146.81 26.7 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.265 -0.897 . . . . 0.0 109.398 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.439 ' O ' ' O ' ' A' ' 46' ' ' THR . 74.4 p -65.86 136.17 55.79 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.175 -0.953 . . . . 0.0 109.429 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.557 ' C ' ' H ' ' A' ' 48' ' ' ARG . 1.3 m -60.24 -146.16 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.398 -0.814 . . . . 0.0 109.595 -179.538 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.551 ' H ' HG22 ' A' ' 46' ' ' THR . 2.6 m 65.05 -14.3 0.11 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.286 -0.884 . . . . 0.0 110.007 -179.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.557 ' H ' ' C ' ' A' ' 46' ' ' THR . 37.9 ttm180 -146.69 143.59 28.86 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 120.983 -1.073 . . . . 0.0 109.076 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 12.7 tpt180 -87.71 142.42 27.84 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.256 -0.902 . . . . 0.0 109.403 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.425 ' O ' ' O ' ' A' ' 51' ' ' CYS . 87.8 p -66.72 163.0 20.07 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.244 -0.91 . . . . 0.0 109.308 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.425 ' O ' ' O ' ' A' ' 50' ' ' SER . 4.3 t 62.3 139.17 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.324 -0.86 . . . . 0.0 109.395 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.583 ' N ' ' SG ' ' A' ' 81' ' ' CYS . 10.1 t 51.61 178.25 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.283 -0.886 . . . . 0.0 109.425 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.435 ' N ' ' OG ' ' A' ' 52' ' ' SER . 56.7 mttp -113.86 111.64 22.06 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.527 -0.733 . . . . 0.0 109.536 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 91.7 t -126.68 117.17 47.34 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.452 -0.78 . . . . 0.0 109.565 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 29.1 mm -111.3 116.04 51.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.945 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 179.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.6 m -129.27 113.49 15.07 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.423 -0.798 . . . . 0.0 109.593 -179.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.516 ' N ' ' OG1' ' A' ' 69' ' ' THR . 1.5 mtmm -122.73 111.64 16.96 Favored 'General case' 0 N--CA 1.511 2.587 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 178.294 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 63.4 m -119.36 135.37 54.75 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.477 -0.765 . . . . 0.0 109.446 -179.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.523 HG23 ' O ' ' A' ' 59' ' ' VAL . 2.9 m -131.81 118.93 39.99 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.212 0 O-C-N 121.544 -0.722 . . . . 0.0 109.571 179.123 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 81.2 p -112.8 136.46 52.39 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 179.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.521 ' OD1' ' N ' ' A' ' 62' ' ' ALA . 7.0 t30 -163.91 163.88 23.49 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 120.586 -1.322 . . . . 0.0 110.095 179.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.521 ' N ' ' OD1' ' A' ' 61' ' ' ASN . . . -74.68 -10.45 59.54 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.013 -1.055 . . . . 0.0 110.898 -179.346 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.408 ' CB ' ' ND2' ' A' ' 61' ' ' ASN . 26.7 t70 -75.25 6.25 4.61 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.187 -0.946 . . . . 0.0 109.752 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.19 10.89 79.54 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 108.91 -1.676 . . . . 0.0 108.91 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -92.61 97.56 10.88 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.936 -1.332 . . . . 0.0 108.779 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 54.1 p -127.41 68.77 1.29 Allowed 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 179.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -94.24 129.46 40.86 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.523 -0.736 . . . . 0.0 111.053 -178.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -111.28 111.76 23.05 Favored 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 178.712 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.516 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 22.4 p -109.91 37.22 2.73 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 107.511 -1.292 . . . . 0.0 107.511 179.167 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 45.4 pttt -65.72 61.39 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.906 0 C-N-CA 120.252 -0.579 . . . . 0.0 109.46 179.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.514 ' N ' ' O ' ' A' ' 69' ' ' THR . 50.0 mt-10 -84.92 146.78 27.08 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.169 -0.957 . . . . 0.0 109.609 -179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 22.4 m -127.44 143.23 41.31 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 12.3 t -128.55 119.17 49.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.027 0 CA-C-O 122.029 0.918 . . . . 0.0 109.064 179.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -69.76 162.3 28.09 Favored 'General case' 0 C--N 1.291 -1.954 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.542 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 13.2 m -75.52 144.32 42.03 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.314 -0.866 . . . . 0.0 109.483 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -85.3 -13.92 48.2 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.312 -0.867 . . . . 0.0 109.271 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -172.27 46.62 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.345 -0.847 . . . . 0.0 109.364 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.498 ' C ' ' H ' ' A' ' 80' ' ' ASP . . . -81.44 -28.45 43.84 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.667 -1.373 . . . . 0.0 109.667 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 6.3 t 58.03 3.31 0.23 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.329 -1.1 . . . . 0.0 109.327 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.498 ' H ' ' C ' ' A' ' 78' ' ' GLY . 23.6 m-20 -160.38 27.21 0.16 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.319 -0.863 . . . . 0.0 108.922 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.583 ' SG ' ' N ' ' A' ' 52' ' ' SER . 4.5 t -165.62 38.16 0.06 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.471 -0.768 . . . . 0.0 109.607 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 175.59 -75.12 0.08 OUTLIER Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.455 ' O ' ' HB3' ' A' ' 84' ' ' ALA . 6.6 m-20 -73.46 -28.71 62.09 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.233 -1.157 . . . . 0.0 109.595 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.455 ' HB3' ' O ' ' A' ' 83' ' ' ASP . . . 64.26 165.17 0.14 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.312 -0.868 . . . . 0.0 109.398 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 54.03 -159.34 0.16 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.205 -0.935 . . . . 0.0 109.289 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 34.0 p90 -165.49 26.22 0.05 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.148 -0.97 . . . . 0.0 109.419 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -170.55 171.19 6.5 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.226 -0.921 . . . . 0.0 109.493 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . 0.441 ' O ' ' NE2' ' A' ' 90' ' ' HIS . 5.4 m0 -88.86 99.58 12.5 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.17 -0.956 . . . . 0.0 109.354 179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.524 ' O ' ' CG ' ' A' ' 90' ' ' HIS . 12.7 p80 -55.22 -170.08 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.246 -0.908 . . . . 0.0 109.475 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.524 ' CG ' ' O ' ' A' ' 89' ' ' HIS . 91.4 m-70 -157.18 111.71 2.71 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.295 -0.878 . . . . 0.0 109.503 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 29.3 m -51.87 114.27 1.24 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.275 -0.89 . . . . 0.0 109.413 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -61.03 149.2 82.57 Favored Pre-proline 0 N--CA 1.49 1.542 0 O-C-N 121.297 -0.877 . . . . 0.0 109.032 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -56.66 -166.94 0.02 OUTLIER 'Trans proline' 0 C--N 1.323 -0.804 0 C-N-CA 120.965 1.11 . . . . 0.0 109.724 179.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 74.8 m -167.79 -165.26 0.63 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.249 -0.907 . . . . 0.0 109.359 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 43.6 ttp180 -168.93 115.26 0.61 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.246 -0.909 . . . . 0.0 109.52 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 175.17 -53.16 0.13 Allowed Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.597 HD22 ' N ' ' A' ' 98' ' ' LEU . 0.4 OUTLIER -173.6 -13.23 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.33 -1.1 . . . . 0.0 109.525 -179.97 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.597 ' N ' HD22 ' A' ' 97' ' ' ASN . 36.8 mt -72.13 -72.69 0.22 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.276 -0.89 . . . . 0.0 109.383 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -76.57 79.18 3.25 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.181 -0.949 . . . . 0.0 109.565 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -71.6 82.79 0.84 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.271 -0.893 . . . . 0.0 109.216 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -71.49 -56.75 5.3 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.296 -0.877 . . . . 0.0 109.585 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -87.86 117.61 26.82 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.13 -0.981 . . . . 0.0 109.114 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 10.3 m80 -58.68 -38.73 78.84 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.267 -0.896 . . . . 0.0 109.813 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 62.4 ttt180 56.39 60.83 2.95 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.269 -0.895 . . . . 0.0 109.464 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -161.41 -33.95 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.235 -0.916 . . . . 0.0 109.542 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 18.2 tptm -59.54 135.78 57.78 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.172 -0.955 . . . . 0.0 109.414 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.405 ' OD1' ' N ' ' A' ' 107' ' ' ASP . 16.5 p-10 -171.19 156.17 4.62 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.328 -0.858 . . . . 0.0 109.458 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.48 ' CG ' ' H ' ' A' ' 109' ' ' PHE . 25.5 t70 -68.61 -168.64 0.13 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.288 -0.882 . . . . 0.0 109.4 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.48 ' H ' ' CG ' ' A' ' 108' ' ' ASP . 69.5 t80 -59.55 -29.45 67.93 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.245 -0.909 . . . . 0.0 109.242 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . 0.515 ' O ' ' CD2' ' A' ' 110' ' ' PHE . 64.1 t80 -154.79 13.52 0.4 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.245 -0.909 . . . . 0.0 109.438 -179.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 7.5 m 57.32 103.12 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.317 -0.864 . . . . 0.0 109.559 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 14.9 ptm180 -55.86 165.2 0.97 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.282 -0.887 . . . . 0.0 109.502 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 57.3 p -172.07 -102.24 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.257 -0.902 . . . . 0.0 109.448 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 57.4 m -75.39 119.94 20.16 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.293 -0.879 . . . . 0.0 109.485 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -74.29 -135.97 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.293 -0.88 . . . . 0.0 109.502 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.474 ' CD ' ' N ' ' A' ' 116' ' ' GLU . 1.4 pm0 -165.11 41.95 0.08 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.236 -0.915 . . . . 0.0 109.487 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -71.49 145.23 49.33 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.206 -0.934 . . . . 0.0 109.43 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.475 ' CG ' ' H ' ' A' ' 119' ' ' GLY . 3.8 p-10 -73.68 -104.55 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.267 -0.896 . . . . 0.0 109.508 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.475 ' H ' ' CG ' ' A' ' 118' ' ' ASP . . . -67.79 -92.89 0.05 OUTLIER Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.574 -1.411 . . . . 0.0 109.574 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 37.7 ttm180 -165.93 125.26 1.65 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.321 -1.106 . . . . 0.0 109.474 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 52.9 m -73.87 121.45 20.93 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.251 -0.905 . . . . 0.0 109.446 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 158.56 107.57 0.24 Allowed Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.365 -1.494 . . . . 0.0 109.365 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.59 ' N ' HD12 ' A' ' 123' ' ' LEU . 7.5 mp -88.01 147.92 24.77 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.233 -1.157 . . . . 0.0 109.195 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.513 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -70.95 162.14 73.95 Favored Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 121.161 -0.962 . . . . 0.0 108.784 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.513 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 2.1 Cg_endo -56.5 -178.78 0.08 OUTLIER 'Trans proline' 0 C--N 1.318 -1.051 0 C-N-CA 121.369 1.379 . . . . 0.0 109.765 179.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.423 ' O ' ' O ' ' A' ' 127' ' ' PHE . 46.8 mt-10 49.18 39.73 16.13 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.271 -0.893 . . . . 0.0 109.437 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . 0.423 ' O ' ' O ' ' A' ' 126' ' ' GLU . 45.8 m-85 49.72 -176.76 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.265 -0.897 . . . . 0.0 109.494 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -78.33 -51.73 9.67 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.342 -0.849 . . . . 0.0 109.348 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -64.73 110.99 2.57 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.287 -0.883 . . . . 0.0 109.406 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.475 ' O ' ' N ' ' A' ' 132' ' ' GLU . 16.5 mt -70.36 -38.64 74.83 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.24 -0.912 . . . . 0.0 109.42 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . 0.425 ' O ' ' O ' ' A' ' 132' ' ' GLU . . . 67.84 -63.39 0.33 Allowed Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.475 ' N ' ' O ' ' A' ' 130' ' ' LEU . 12.8 tp10 59.07 155.13 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.385 -1.068 . . . . 0.0 109.572 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 40.7 t -53.89 132.15 41.31 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.224 -0.923 . . . . 0.0 109.5 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 68.99 159.55 1.84 Allowed Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 98.8 p -169.93 27.84 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.186 -1.184 . . . . 0.0 109.409 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 30.1 t -170.46 -46.85 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.323 -0.861 . . . . 0.0 109.522 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 40.5 t -67.98 -8.16 34.97 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.252 -0.905 . . . . 0.0 109.439 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 60.8 m -59.53 -80.93 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.27 -0.894 . . . . 0.0 109.415 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -61.97 155.25 24.19 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.215 -0.928 . . . . 0.0 109.534 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . 0.479 ' OG1' ' N ' ' A' ' 141' ' ' SER . 3.1 t -167.42 -167.02 0.83 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.242 -0.911 . . . . 0.0 109.475 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . 0.479 ' N ' ' OG1' ' A' ' 140' ' ' THR . 85.6 p -167.42 17.91 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.348 -0.845 . . . . 0.0 109.413 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . 0.409 ' O ' ' O ' ' A' ' 143' ' ' HIS . 2.8 m 57.58 20.89 6.6 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.297 -0.877 . . . . 0.0 109.332 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . 0.409 ' O ' ' O ' ' A' ' 142' ' ' THR . 11.5 m170 54.29 173.95 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.255 -0.903 . . . . 0.0 109.524 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . 0.412 ' O ' ' OG ' ' A' ' 144' ' ' SER . 53.5 p 50.48 79.3 0.09 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.231 -0.918 . . . . 0.0 109.508 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . 0.453 ' C ' ' H ' ' A' ' 147' ' ' PHE . 60.7 mttp -65.16 168.14 7.16 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.29 -0.881 . . . . 0.0 109.471 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . 0.453 ' C ' ' H ' ' A' ' 148' ' ' VAL . 22.4 mt-30 -75.35 21.23 0.14 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.256 -0.902 . . . . 0.0 109.42 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . 0.515 ' CD2' ' O ' ' A' ' 147' ' ' PHE . 65.6 t80 -74.19 16.6 0.23 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.282 -0.886 . . . . 0.0 109.48 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . 0.453 ' H ' ' C ' ' A' ' 146' ' ' GLN . 21.6 t 53.1 89.94 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.275 -0.89 . . . . 0.0 109.431 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 14.7 m 52.03 -173.45 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.25 -0.906 . . . . 0.0 109.489 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 29.4 t -168.72 -64.92 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.274 -0.891 . . . . 0.0 109.465 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 53.4 m -68.8 124.36 23.46 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.276 -0.89 . . . . 0.0 109.495 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 80.4 p -68.51 104.67 1.99 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.297 -0.877 . . . . 0.0 109.551 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 31.7 m -69.91 -30.7 68.18 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.259 -0.9 . . . . 0.0 109.431 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 23.6 t 53.36 80.69 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.305 -0.872 . . . . 0.0 109.471 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 20.8 p30 -73.72 -27.64 61.3 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.214 -0.929 . . . . 0.0 109.366 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 59.9 ttt180 -48.85 169.13 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.261 -0.899 . . . . 0.0 109.42 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -154.76 133.5 3.86 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.546 -1.421 . . . . 0.0 109.546 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -56.16 -33.69 61.5 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 61.6 m -162.55 85.5 0.56 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.178 -1.19 . . . . 0.0 109.511 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -170.35 45.68 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.255 -0.903 . . . . 0.0 109.368 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 20.1 pt -152.29 42.11 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.336 -0.852 . . . . 0.0 109.275 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -169.04 16.95 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.308 -0.87 . . . . 0.0 109.479 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . 0.434 ' O ' ' O ' ' A' ' 164' ' ' LYS . 66.8 m -165.13 97.63 0.72 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.207 -0.933 . . . . 0.0 109.426 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.434 ' O ' ' O ' ' A' ' 163' ' ' SER . 35.6 mttp 60.66 139.54 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.421 -0.799 . . . . 0.0 109.731 -179.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -76.69 138.21 39.87 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.11 -0.994 . . . . 0.0 109.411 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 57.7 t80 . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 117.998 -1.001 . . . . 0.0 109.525 179.976 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.3 mtt . . . . . 0 N--CA 1.491 1.598 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 175.76 41.56 0.05 OUTLIER Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.421 ' H ' ' H ' ' A' ' 4' ' ' PHE . 1.5 t -170.42 -16.42 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.296 -1.12 . . . . 0.0 109.369 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.475 ' O ' ' N ' ' A' ' 6' ' ' GLU . 55.6 m-85 53.06 -144.96 0.61 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.229 -0.919 . . . . 0.0 109.465 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 52.2 -91.48 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.358 -0.839 . . . . 0.0 109.473 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.475 ' N ' ' O ' ' A' ' 4' ' ' PHE . 28.5 tt0 -83.95 120.97 26.74 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.075 -1.016 . . . . 0.0 109.373 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -56.85 -10.71 1.14 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.239 -0.913 . . . . 0.0 109.448 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.427 ' H ' ' HG2' ' A' ' 6' ' ' GLU . . . -50.59 146.34 9.2 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.423 ' OG ' ' N ' ' A' ' 10' ' ' VAL . 47.8 t -72.22 -136.94 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.299 -1.118 . . . . 0.0 109.419 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.425 HG13 ' N ' ' A' ' 11' ' ' SER . 9.1 p -163.12 -36.0 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.222 -0.924 . . . . 0.0 109.519 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.425 ' N ' HG13 ' A' ' 10' ' ' VAL . 87.4 p -71.27 -153.45 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.159 -0.963 . . . . 0.0 109.487 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 39.0 t -169.22 50.6 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.209 -0.932 . . . . 0.0 109.52 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 65.51 114.59 0.01 OUTLIER Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.426 ' OG1' ' N ' ' A' ' 15' ' ' LYS . 60.0 p -53.39 -74.28 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.225 -1.161 . . . . 0.0 109.448 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.426 ' N ' ' OG1' ' A' ' 14' ' ' THR . 32.9 ttmt -170.73 44.34 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.209 -0.932 . . . . 0.0 109.424 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -81.06 127.05 32.18 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.201 -0.937 . . . . 0.0 109.368 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.499 ' O ' ' N ' ' A' ' 19' ' ' HIS . 68.3 mt-10 -69.12 -49.31 58.14 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.173 -0.955 . . . . 0.0 109.599 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -44.01 92.73 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.405 -0.809 . . . . 0.0 110.044 -179.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.537 ' H ' ' CD2' ' A' ' 19' ' ' HIS . 9.4 p80 -82.66 -128.47 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.374 -0.829 . . . . 0.0 109.403 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.476 ' N ' ' CG ' ' A' ' 19' ' ' HIS . 1.6 t -174.85 157.6 2.45 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.195 -0.941 . . . . 0.0 109.561 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.448 ' O ' ' N ' ' A' ' 23' ' ' LEU . . . 65.78 171.28 3.54 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -68.83 66.4 0.13 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.222 -1.164 . . . . 0.0 109.421 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.448 ' N ' ' O ' ' A' ' 21' ' ' GLY . 9.7 tp 49.2 -118.95 1.16 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.266 -0.896 . . . . 0.0 109.372 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 46.3 t -144.31 115.76 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.115 -0.991 . . . . 0.0 109.31 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 59.3 p -60.38 -61.23 2.75 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.288 -0.883 . . . . 0.0 109.437 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.4 t -166.73 173.25 9.76 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.275 -0.89 . . . . 0.0 109.475 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.1 ptmm? -171.49 33.93 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.257 -0.902 . . . . 0.0 109.44 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -66.62 163.0 44.1 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -70.43 126.69 30.35 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.247 -1.149 . . . . 0.0 109.439 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.489 ' CB ' ' NZ ' ' A' ' 30' ' ' LYS . 2.6 ttmp? -73.08 50.01 0.26 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.221 -0.924 . . . . 0.0 109.348 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -172.62 88.01 0.08 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.253 -0.904 . . . . 0.0 109.181 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 11.1 tp -56.99 -29.77 63.58 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.291 -0.88 . . . . 0.0 109.444 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.412 ' CG ' ' H ' ' A' ' 34' ' ' ILE . 6.6 tp -165.49 -132.59 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.157 -0.965 . . . . 0.0 109.513 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.412 ' H ' ' CG ' ' A' ' 33' ' ' LEU . 38.2 mt -139.22 -55.54 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.356 -0.84 . . . . 0.0 109.252 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.16 63.04 2.34 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.207 -0.933 . . . . 0.0 109.439 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -168.29 -84.02 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.228 -0.92 . . . . 0.0 109.469 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -71.96 100.36 2.44 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.283 -0.886 . . . . 0.0 109.439 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.4 ' H ' ' H ' ' A' ' 39' ' ' VAL . 58.4 tttp -167.9 -20.23 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.258 -0.901 . . . . 0.0 109.451 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.4 ' H ' ' H ' ' A' ' 38' ' ' LYS . 31.4 m -57.78 146.78 7.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.267 -0.895 . . . . 0.0 109.495 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.8 t -65.35 174.78 1.96 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.363 -0.835 . . . . 0.0 109.429 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 71.8 p -170.43 176.65 4.34 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.333 -0.854 . . . . 0.0 109.367 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 179.76 165.43 33.73 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -167.96 19.69 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.235 -1.156 . . . . 0.0 109.423 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 30.5 m -78.8 74.74 5.32 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.302 -0.874 . . . . 0.0 109.42 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 72.8 p -77.19 104.2 7.56 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.154 -0.966 . . . . 0.0 109.42 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.409 ' O ' HG23 ' A' ' 47' ' ' THR . 66.1 p -73.22 -133.94 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.268 -0.895 . . . . 0.0 109.452 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.409 HG23 ' O ' ' A' ' 46' ' ' THR . 33.7 p -155.24 41.46 0.43 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.268 -0.895 . . . . 0.0 109.061 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.569 ' CG ' HH11 ' A' ' 48' ' ' ARG . 0.0 OUTLIER -145.84 167.63 22.75 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.301 -0.874 . . . . 0.0 109.374 -179.802 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.428 ' O ' ' O ' ' A' ' 50' ' ' SER . 95.5 mtt180 -87.8 126.14 34.84 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.217 -0.927 . . . . 0.0 109.614 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.428 ' O ' ' O ' ' A' ' 49' ' ' ARG . 47.1 t -59.07 -156.65 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.234 -0.916 . . . . 0.0 109.494 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.502 ' SG ' ' O ' ' A' ' 81' ' ' CYS . 4.8 t 50.74 -118.24 1.2 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.101 -0.999 . . . . 0.0 108.716 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.6 ' N ' ' SG ' ' A' ' 81' ' ' CYS . 26.6 t -56.97 -167.11 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.502 0 O-C-N 120.712 -1.242 . . . . 0.0 108.966 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.491 ' N ' ' OG ' ' A' ' 52' ' ' SER . 50.5 mttp -126.4 103.65 7.75 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.326 -0.858 . . . . 0.0 109.45 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 51.0 t -127.66 116.15 42.28 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.569 -0.707 . . . . 0.0 109.192 179.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.473 HG23 ' O ' ' A' ' 55' ' ' ILE . 14.8 tt -128.66 125.25 63.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.564 -0.71 . . . . 0.0 109.415 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 81.0 p -127.85 113.33 15.78 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.402 -0.811 . . . . 0.0 109.323 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.505 ' H ' ' HB ' ' A' ' 69' ' ' THR . 41.7 tttm -127.59 113.64 16.36 Favored 'General case' 0 N--CA 1.519 3.022 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.314 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 91.5 m -108.94 125.22 51.79 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.496 -0.752 . . . . 0.0 109.436 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.5 m -132.56 119.92 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.178 0 O-C-N 121.45 -0.781 . . . . 0.0 109.071 178.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 60.8 m -109.65 134.44 51.96 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.753 -0.592 . . . . 0.0 109.655 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -127.19 162.29 26.51 Favored 'General case' 0 N--CA 1.516 2.85 0 O-C-N 121.385 -0.822 . . . . 0.0 109.347 179.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.44 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -71.59 -33.37 68.99 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.538 -1.351 . . . . 0.0 112.6 -177.531 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -69.48 7.26 0.85 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.453 -1.405 . . . . 0.0 109.813 -178.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.44 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 87.84 5.02 78.29 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.412 HH11 ' CG ' ' A' ' 65' ' ' ARG . 1.9 ttt-85 -81.15 96.55 7.24 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 120.705 -1.468 . . . . 0.0 107.865 178.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.6 p -122.08 94.89 4.45 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.607 -0.683 . . . . 0.0 109.196 -179.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -94.66 119.64 33.62 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.228 -0.92 . . . . 0.0 109.864 -179.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.487 ' OG1' ' NZ ' ' A' ' 70' ' ' LYS . 40.7 p -102.36 108.53 19.91 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.377 -0.827 . . . . 0.0 109.631 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.545 ' O ' ' N ' ' A' ' 71' ' ' GLU . 3.2 m -87.87 31.38 0.78 Allowed 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 178.693 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.487 ' NZ ' ' OG1' ' A' ' 68' ' ' THR . 22.0 pttm -65.13 56.7 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 179.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.545 ' N ' ' O ' ' A' ' 69' ' ' THR . 75.0 mt-10 -93.8 135.94 34.59 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.962 -1.086 . . . . 0.0 109.943 -179.621 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 47.8 t -128.03 129.17 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 179.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.422 ' O ' ' OG ' ' A' ' 52' ' ' SER . 16.6 t -128.61 116.2 40.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 CA-C-O 121.946 0.879 . . . . 0.0 109.236 179.677 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 45.9 mtmt -83.99 51.52 2.08 Favored 'General case' 0 C--N 1.289 -2.052 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 6.0 m 55.6 -153.3 0.34 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.235 -0.916 . . . . 0.0 109.463 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.432 ' N ' ' CD ' ' A' ' 76' ' ' GLU . 4.5 mp0 -85.22 -65.9 0.96 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.321 -0.862 . . . . 0.0 109.22 179.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 20.2 p-10 -162.0 82.05 0.56 Allowed 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.304 -0.872 . . . . 0.0 109.211 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.522 ' O ' ' N ' ' A' ' 80' ' ' ASP . . . 50.89 45.73 49.68 Favored Glycine 0 N--CA 1.489 2.233 0 N-CA-C 109.395 -1.482 . . . . 0.0 109.395 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 42.9 t -68.31 50.33 0.07 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.271 -1.135 . . . . 0.0 109.513 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.522 ' N ' ' O ' ' A' ' 78' ' ' GLY . 0.8 OUTLIER 54.16 44.75 28.71 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.299 -0.876 . . . . 0.0 109.614 179.948 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.6 ' SG ' ' N ' ' A' ' 52' ' ' SER . 3.0 t -95.64 53.28 1.43 Allowed 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.189 -0.944 . . . . 0.0 109.072 179.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 48.83 22.77 3.06 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.711 -1.355 . . . . 0.0 109.711 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -171.03 96.62 0.2 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.208 -1.172 . . . . 0.0 109.646 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -79.19 -141.3 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.184 -0.947 . . . . 0.0 109.265 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.462 ' CG ' ' H ' ' A' ' 86' ' ' PHE . 5.8 p-10 -69.54 -107.46 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.202 -0.936 . . . . 0.0 109.404 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.534 ' O ' ' N ' ' A' ' 88' ' ' TRP . 96.3 m-85 50.01 -161.74 0.06 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.273 -0.892 . . . . 0.0 109.437 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 9.2 t70 60.76 -75.27 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.413 -0.805 . . . . 0.0 109.73 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . 0.534 ' N ' ' O ' ' A' ' 86' ' ' PHE . 73.8 m95 53.59 -172.57 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.221 -0.924 . . . . 0.0 109.465 -179.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.409 ' O ' ' CG ' ' A' ' 89' ' ' HIS . 79.2 t60 -163.29 4.09 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.256 -0.902 . . . . 0.0 109.232 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -168.82 98.85 0.39 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.314 -0.866 . . . . 0.0 109.342 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.518 ' OG1' ' CD2' ' A' ' 92' ' ' PHE . 80.3 p -83.02 -159.04 0.31 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.339 -0.85 . . . . 0.0 109.428 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.518 ' CD2' ' OG1' ' A' ' 91' ' ' THR . 62.9 m-85 51.63 67.74 3.88 Favored Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.246 -0.909 . . . . 0.0 109.671 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -61.45 -3.21 3.1 Favored 'Trans proline' 0 C--N 1.318 -1.067 0 C-N-CA 121.361 1.374 . . . . 0.0 109.724 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.402 ' H ' ' C ' ' A' ' 92' ' ' PHE . 29.1 t -165.49 120.03 1.25 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.288 -0.883 . . . . 0.0 109.437 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -70.53 -45.68 65.09 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.214 -0.929 . . . . 0.0 109.352 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 73.02 85.03 0.23 Allowed Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.62 ' ND2' ' H ' ' A' ' 98' ' ' LEU . 4.2 p-10 -55.7 -70.63 0.11 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.212 -1.169 . . . . 0.0 109.51 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.62 ' H ' ' ND2' ' A' ' 97' ' ' ASN . 1.4 tt -76.94 41.4 0.28 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.19 -0.944 . . . . 0.0 109.003 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 49.82 -163.07 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.242 -0.911 . . . . 0.0 109.529 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 57.0 m-20 -157.89 -17.91 0.08 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.252 -0.905 . . . . 0.0 109.362 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -61.93 -53.05 61.13 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.206 -0.934 . . . . 0.0 109.447 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -72.46 66.87 0.71 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.303 -0.873 . . . . 0.0 109.435 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -65.59 -47.67 74.96 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.273 -0.892 . . . . 0.0 109.409 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -79.85 -153.68 0.08 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.226 -0.921 . . . . 0.0 109.439 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -157.96 100.49 1.73 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.317 -0.864 . . . . 0.0 109.426 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.4 tttm 51.5 86.68 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.315 -0.865 . . . . 0.0 109.517 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -61.19 177.53 0.34 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.238 -0.913 . . . . 0.0 109.5 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -167.2 108.44 0.63 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.327 -0.858 . . . . 0.0 109.391 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -68.84 -0.53 5.58 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.233 -0.917 . . . . 0.0 109.612 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 48.7 t80 58.43 67.51 0.93 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.307 -0.87 . . . . 0.0 109.541 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 68.5 p -57.44 127.1 30.28 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.303 -0.873 . . . . 0.0 109.355 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 84.7 mtm180 -73.41 -5.44 39.88 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.26 -0.9 . . . . 0.0 109.558 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 78.6 p -171.77 161.97 6.08 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.214 -0.929 . . . . 0.0 109.549 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 13.0 t 52.57 -146.43 0.51 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.263 -0.898 . . . . 0.0 109.519 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 41.7 p-80 -165.8 -40.22 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.224 -0.922 . . . . 0.0 109.491 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -170.16 -54.99 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.314 -0.866 . . . . 0.0 109.517 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -61.75 -61.08 2.76 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.234 -0.916 . . . . 0.0 109.426 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 33.6 t70 54.05 89.83 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.24 -0.913 . . . . 0.0 109.457 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 168.05 36.66 0.02 OUTLIER Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.541 -1.424 . . . . 0.0 109.541 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.55 ' CG ' HH11 ' A' ' 120' ' ' ARG . 0.0 OUTLIER -73.72 -35.69 65.12 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.256 -1.144 . . . . 0.0 109.515 179.988 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 1.7 t -61.57 164.71 5.62 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.25 -0.906 . . . . 0.0 109.556 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -178.79 -92.73 0.08 OUTLIER Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.43 -1.468 . . . . 0.0 109.43 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 15.3 mt -69.84 127.2 32.06 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.275 -1.132 . . . . 0.0 109.294 179.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.521 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -72.23 161.94 76.3 Favored Pre-proline 0 N--CA 1.489 1.524 0 O-C-N 121.148 -0.97 . . . . 0.0 108.908 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.521 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 1.8 Cg_endo -57.08 -157.88 0.01 OUTLIER 'Trans proline' 0 C--N 1.32 -0.952 0 C-N-CA 121.346 1.364 . . . . 0.0 109.709 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.439 ' O ' ' O ' ' A' ' 127' ' ' PHE . 66.6 mm-40 -76.92 120.29 21.84 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.244 -0.91 . . . . 0.0 109.372 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . 0.541 ' CD2' ' N ' ' A' ' 128' ' ' ALA . 60.6 t80 -51.62 -176.39 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.306 -0.871 . . . . 0.0 109.775 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.541 ' N ' ' CD2' ' A' ' 127' ' ' PHE . . . -76.24 136.85 39.68 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.288 -0.883 . . . . 0.0 109.411 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -167.93 174.0 7.76 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.227 -0.921 . . . . 0.0 109.489 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.559 ' N ' HD12 ' A' ' 130' ' ' LEU . 9.7 mp -52.94 135.89 35.69 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.247 -0.908 . . . . 0.0 109.274 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 62.28 168.2 0.73 Allowed Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -63.1 -27.4 69.37 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.203 -1.175 . . . . 0.0 109.475 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 28.0 t -171.16 12.22 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.34 -0.85 . . . . 0.0 109.482 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -62.71 179.67 4.92 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.443 -1.463 . . . . 0.0 109.443 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 66.0 m -166.16 -37.59 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.209 -1.171 . . . . 0.0 109.437 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 30.6 t -171.09 73.55 0.06 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.279 -0.888 . . . . 0.0 109.374 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 38.9 t -66.66 -19.8 65.84 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.303 -0.873 . . . . 0.0 109.416 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 49.7 m -64.49 100.25 0.36 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.258 -0.901 . . . . 0.0 109.467 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.539 ' C ' ' HG1' ' A' ' 140' ' ' THR . 68.4 mttm -64.47 124.34 21.56 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.251 -0.906 . . . . 0.0 109.447 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . 0.539 ' HG1' ' C ' ' A' ' 139' ' ' LYS . 58.7 p 48.07 -93.89 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.257 -0.902 . . . . 0.0 109.589 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . 0.524 ' N ' ' OG1' ' A' ' 140' ' ' THR . 40.5 t -166.24 56.85 0.1 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.205 -0.935 . . . . 0.0 109.463 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 2.5 t -61.48 146.5 48.35 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.208 -0.932 . . . . 0.0 109.46 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 16.6 t60 -68.76 145.41 53.83 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.207 -0.933 . . . . 0.0 109.498 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 41.4 t -61.55 139.17 58.29 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.233 -0.917 . . . . 0.0 109.436 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 23.7 mtpp -66.05 98.91 0.46 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.193 -0.942 . . . . 0.0 109.58 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 41.3 tp60 -167.48 129.61 1.6 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.199 -0.938 . . . . 0.0 109.358 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 50.72 87.78 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.214 -0.929 . . . . 0.0 109.396 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 35.8 m -59.45 139.07 19.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.254 -0.904 . . . . 0.0 109.425 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 92.0 p -78.4 159.2 28.44 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.33 -0.856 . . . . 0.0 109.459 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 52.5 m -71.03 99.22 1.77 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.262 -0.899 . . . . 0.0 109.395 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . 0.415 ' O ' ' O ' ' A' ' 152' ' ' THR . 49.6 m -63.39 -41.94 98.79 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.237 -0.915 . . . . 0.0 109.471 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . 0.497 ' OG1' ' N ' ' A' ' 153' ' ' THR . 1.9 t -56.26 -166.87 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.291 -0.881 . . . . 0.0 109.485 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . 0.497 ' N ' ' OG1' ' A' ' 152' ' ' THR . 69.1 p -74.06 150.07 40.81 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.315 -0.866 . . . . 0.0 109.492 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 8.7 p -167.39 145.31 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.191 -0.943 . . . . 0.0 109.553 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -171.6 137.8 1.07 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.278 -0.889 . . . . 0.0 109.491 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 56.3 mtp180 -59.22 -19.64 47.27 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.258 -0.901 . . . . 0.0 109.5 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -65.69 -167.2 1.98 Allowed Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 177.18 -21.98 0.05 OUTLIER Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 91.9 p -64.28 98.44 0.23 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.263 -1.14 . . . . 0.0 109.499 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -64.7 -178.39 0.4 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.221 -0.924 . . . . 0.0 109.391 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 18.5 pt -60.72 -177.98 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.226 -0.921 . . . . 0.0 109.475 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -66.07 138.07 57.5 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.162 -0.961 . . . . 0.0 109.455 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 50.1 m -77.6 165.04 24.79 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.151 -0.968 . . . . 0.0 109.508 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 58.3 pttt -69.08 146.06 52.92 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.235 -0.915 . . . . 0.0 109.468 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 12.1 m80 -67.14 -70.45 0.25 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.299 -0.876 . . . . 0.0 109.487 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 64.4 t80 . . . . . 0 N--CA 1.49 1.563 0 CA-C-O 118.045 -0.979 . . . . 0.0 109.532 179.975 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 73.9 mtp . . . . . 0 N--CA 1.489 1.508 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -178.62 124.92 0.95 Allowed Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 64.7 p -67.74 156.99 35.71 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.222 -1.163 . . . . 0.0 109.437 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -66.32 141.94 57.82 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.296 -0.877 . . . . 0.0 109.508 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -70.07 137.5 51.28 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.228 -0.92 . . . . 0.0 109.416 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -148.55 -144.86 0.16 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.254 -0.904 . . . . 0.0 109.294 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.468 ' CD ' ' N ' ' A' ' 7' ' ' GLU . 1.4 pm0 -166.61 153.81 9.36 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.152 -0.968 . . . . 0.0 109.456 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -60.74 134.45 49.57 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.432 ' O ' ' O ' ' A' ' 10' ' ' VAL . 77.5 p -68.4 -89.75 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.288 -1.125 . . . . 0.0 109.547 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.432 ' O ' ' O ' ' A' ' 9' ' ' SER . 4.1 t 58.73 154.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.43 -0.794 . . . . 0.0 109.645 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.6 t 48.61 26.49 1.22 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.198 -0.939 . . . . 0.0 109.615 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.9 t -69.12 -134.4 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.236 -0.915 . . . . 0.0 109.46 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.426 ' O ' ' NE2' ' A' ' 16' ' ' GLN . . . -168.59 36.38 0.2 Allowed Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.463 ' C ' ' H ' ' A' ' 16' ' ' GLN . 64.2 p -81.74 -23.61 36.57 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.265 -1.138 . . . . 0.0 109.419 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -75.48 32.89 0.11 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.272 -0.893 . . . . 0.0 109.505 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.463 ' H ' ' C ' ' A' ' 14' ' ' THR . 1.9 pp0? -171.47 4.44 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.25 -0.906 . . . . 0.0 109.515 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -70.3 -28.5 65.23 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.221 -0.925 . . . . 0.0 109.493 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 31.3 p90 -163.3 -172.76 3.09 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.203 -0.936 . . . . 0.0 109.453 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.408 ' O ' ' O ' ' A' ' 20' ' ' THR . 61.2 t-80 -165.15 -11.02 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.255 -0.903 . . . . 0.0 109.481 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.408 ' O ' ' O ' ' A' ' 19' ' ' HIS . 22.7 m 53.29 97.76 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.258 -0.901 . . . . 0.0 109.431 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -168.27 -105.24 0.18 Allowed Glycine 0 N--CA 1.489 2.232 0 N-CA-C 109.452 -1.459 . . . . 0.0 109.452 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -67.77 101.7 1.1 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.282 -1.128 . . . . 0.0 109.468 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.9 tp -73.22 75.44 1.3 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.233 -0.917 . . . . 0.0 109.371 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 34.4 m -75.72 1.74 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.214 -0.928 . . . . 0.0 109.53 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.416 ' O ' ' OG1' ' A' ' 26' ' ' THR . 30.4 p -64.08 -31.18 72.28 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.215 -0.928 . . . . 0.0 109.493 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.416 ' OG1' ' O ' ' A' ' 25' ' ' THR . 56.9 m -166.34 145.71 5.88 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.265 -0.897 . . . . 0.0 109.384 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 15.2 pttp -169.3 122.99 0.79 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.253 -0.904 . . . . 0.0 109.433 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 55.26 175.26 0.13 Allowed Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.556 -1.417 . . . . 0.0 109.556 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 48.1 m-20 -154.34 130.36 10.25 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.371 -1.076 . . . . 0.0 109.363 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.428 ' O ' ' O ' ' A' ' 31' ' ' GLU . 0.4 OUTLIER -65.99 -136.4 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.259 -0.901 . . . . 0.0 109.481 -179.982 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.428 ' O ' ' O ' ' A' ' 30' ' ' LYS . 15.6 mm-40 52.13 97.14 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.906 -1.121 . . . . 0.0 109.113 -179.704 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.574 ' N ' HD12 ' A' ' 32' ' ' LEU . 8.3 mp -64.5 -40.99 96.68 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.229 -0.92 . . . . 0.0 109.265 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 15.5 mt -79.23 89.99 4.91 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.277 -0.889 . . . . 0.0 109.373 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 21.2 pt -70.06 159.53 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.142 -0.974 . . . . 0.0 109.468 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 53.23 82.82 0.07 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.218 -0.927 . . . . 0.0 109.472 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -71.85 104.18 3.38 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.289 -0.882 . . . . 0.0 109.416 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -70.45 111.11 5.76 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.274 -0.891 . . . . 0.0 109.43 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 68.2 mttm 50.78 -101.29 0.1 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.286 -0.884 . . . . 0.0 109.41 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.45 ' O ' ' N ' ' A' ' 41' ' ' SER . 8.6 p -169.41 -32.85 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.364 -0.835 . . . . 0.0 109.446 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 81.2 p -62.83 80.58 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.219 -0.925 . . . . 0.0 109.464 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.45 ' N ' ' O ' ' A' ' 39' ' ' VAL . 44.4 t -73.35 6.96 2.52 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.26 -0.9 . . . . 0.0 109.476 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 68.72 63.4 3.53 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.692 ' H ' ' CD2' ' A' ' 43' ' ' HIS . 5.1 p80 -69.71 -104.16 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.25 -1.147 . . . . 0.0 109.429 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.524 ' H ' ' CG ' ' A' ' 43' ' ' HIS . 4.8 m 57.46 45.53 19.53 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.21 -0.931 . . . . 0.0 109.316 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 52.6 m -89.13 111.2 21.91 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.272 -0.892 . . . . 0.0 109.358 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.7 t -60.16 144.71 49.28 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.228 -0.92 . . . . 0.0 109.543 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -167.87 66.63 0.08 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.18 -0.95 . . . . 0.0 109.588 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.587 ' CG ' HH11 ' A' ' 48' ' ' ARG . 3.2 mtt-85 -145.54 142.89 29.59 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.207 -0.933 . . . . 0.0 109.328 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 53.6 mtp180 -88.62 137.6 32.17 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.346 -0.846 . . . . 0.0 110.059 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.9 m 58.22 169.99 0.05 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.383 -0.823 . . . . 0.0 110.149 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.44 ' SG ' ' N ' ' A' ' 52' ' ' SER . 31.2 p -66.83 -38.08 85.74 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.436 -0.79 . . . . 0.0 109.397 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.527 ' OG ' ' N ' ' A' ' 53' ' ' LYS . 15.0 t -58.09 -161.36 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.371 -0.831 . . . . 0.0 108.984 179.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.527 ' N ' ' OG ' ' A' ' 52' ' ' SER . 36.1 ttpt -121.83 102.01 7.93 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.263 -0.898 . . . . 0.0 109.252 179.393 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 74.5 t -129.33 117.81 44.14 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.6 ' O ' HD12 ' A' ' 55' ' ' ILE . 1.0 OUTLIER -127.28 132.0 69.99 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 O-C-N 121.431 -0.793 . . . . 0.0 109.077 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 69.4 p -129.22 114.9 16.85 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.381 -0.824 . . . . 0.0 109.185 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.584 ' H ' ' HB ' ' A' ' 69' ' ' THR . 9.1 ttmm -127.19 113.99 17.08 Favored 'General case' 0 N--CA 1.52 3.056 0 N-CA-C 109.3 -0.629 . . . . 0.0 109.3 178.671 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 33.7 p -119.76 132.06 55.53 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.494 -0.754 . . . . 0.0 109.429 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 59' ' ' VAL . 2.8 m -132.54 120.25 41.63 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.177 0 O-C-N 121.383 -0.823 . . . . 0.0 109.534 179.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 35.9 p -109.77 133.01 53.62 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.781 -0.574 . . . . 0.0 109.523 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -136.3 170.23 16.37 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.263 -0.898 . . . . 0.0 109.674 179.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.42 -40.78 98.1 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.88 -1.138 . . . . 0.0 112.766 -177.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.425 ' OD1' ' N ' ' A' ' 63' ' ' ASP . 18.6 p-10 -68.54 5.24 1.09 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.38 -1.45 . . . . 0.0 110.065 -178.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.528 ' O ' ' N ' ' A' ' 66' ' ' THR . . . 90.51 8.9 65.38 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.978 -1.249 . . . . 0.0 109.978 179.098 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 36.4 ttp180 -65.21 78.77 0.05 Allowed 'General case' 0 N--CA 1.486 1.343 0 O-C-N 120.689 -1.477 . . . . 0.0 107.915 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.528 ' N ' ' O ' ' A' ' 64' ' ' GLY . 70.3 p -110.03 77.65 1.07 Allowed 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 -179.356 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.0 tm-20 -92.78 119.81 32.52 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.418 -0.801 . . . . 0.0 109.214 -179.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 12.7 p -99.31 109.71 22.31 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.353 -0.842 . . . . 0.0 109.677 -179.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.584 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 4.2 m -97.02 25.41 5.41 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 107.173 -1.418 . . . . 0.0 107.173 178.561 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -65.76 70.13 0.05 Allowed 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 179.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.504 ' N ' ' O ' ' A' ' 69' ' ' THR . 81.2 mt-10 -110.13 155.04 22.46 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.538 -0.726 . . . . 0.0 110.043 -179.052 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.418 ' O ' HG23 ' A' ' 72' ' ' VAL . 21.9 m -127.78 134.85 64.54 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 179.251 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 16.4 t -128.91 116.32 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 CA-C-O 121.996 0.903 . . . . 0.0 109.382 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.4 ptmm? -52.69 178.56 0.02 OUTLIER 'General case' 0 C--N 1.289 -2.023 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 85.2 p -66.02 -112.88 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.239 -0.913 . . . . 0.0 109.311 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.411 ' OE1' ' OD2' ' A' ' 77' ' ' ASP . 0.4 OUTLIER -168.2 -56.27 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.187 -0.945 . . . . 0.0 109.155 179.834 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.411 ' OD2' ' OE1' ' A' ' 76' ' ' GLU . 79.0 m-20 -125.08 -6.31 7.24 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.589 -0.694 . . . . 0.0 109.409 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 82.38 43.36 8.0 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 109.292 -1.523 . . . . 0.0 109.292 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 90.7 p -68.07 -20.75 64.98 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.329 -1.101 . . . . 0.0 109.7 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -164.84 27.3 0.06 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.105 -0.997 . . . . 0.0 109.651 -179.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.466 ' C ' ' H ' ' A' ' 83' ' ' ASP . 11.7 m -146.08 -75.04 0.21 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.211 -0.931 . . . . 0.0 109.601 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -68.15 7.67 2.38 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.466 ' H ' ' C ' ' A' ' 81' ' ' CYS . 47.9 m-20 49.92 -164.77 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.211 -1.17 . . . . 0.0 109.369 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -171.23 37.16 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.221 -0.924 . . . . 0.0 109.493 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -65.88 -16.83 64.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.242 -0.911 . . . . 0.0 109.472 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -70.5 -174.59 0.89 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.184 -0.948 . . . . 0.0 109.498 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 26.0 t70 53.12 42.54 32.18 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.253 -0.904 . . . . 0.0 109.599 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 29.8 t90 -66.04 -75.98 0.08 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.264 -0.898 . . . . 0.0 109.445 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.616 ' CG ' ' H ' ' A' ' 90' ' ' HIS . 13.1 t60 -70.81 -171.38 0.52 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.284 -0.885 . . . . 0.0 109.405 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.616 ' H ' ' CG ' ' A' ' 89' ' ' HIS . 13.7 p80 -158.0 54.25 0.46 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.208 -0.932 . . . . 0.0 109.421 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.43 ' O ' ' O ' ' A' ' 92' ' ' PHE . 17.5 m -165.3 66.68 0.13 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.308 -0.87 . . . . 0.0 109.378 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.43 ' O ' ' O ' ' A' ' 91' ' ' THR . 3.9 m-85 62.11 149.59 0.1 OUTLIER Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 121.406 -0.809 . . . . 0.0 108.853 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -56.54 153.99 32.68 Favored 'Trans proline' 0 C--N 1.323 -0.798 0 C-N-CA 120.887 1.058 . . . . 0.0 109.634 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 30.7 t -74.07 125.59 28.66 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.246 -0.909 . . . . 0.0 109.28 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.723 ' H ' ' NE ' ' A' ' 95' ' ' ARG . 0.1 OUTLIER -65.32 -166.72 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.198 -0.939 . . . . 0.0 109.159 -179.922 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -156.5 -57.05 0.01 OUTLIER Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.441 -1.463 . . . . 0.0 109.441 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -68.98 91.99 0.5 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.258 -1.142 . . . . 0.0 109.405 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.409 ' C ' ' H ' ' A' ' 100' ' ' ASP . 15.0 mt -68.51 -147.4 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.235 -0.915 . . . . 0.0 109.524 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.522 ' O ' ' N ' ' A' ' 101' ' ' PHE . 0.8 OUTLIER -55.98 -8.83 0.49 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.213 -0.929 . . . . 0.0 109.502 -179.923 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.409 ' H ' ' C ' ' A' ' 98' ' ' LEU . 65.1 t0 -68.29 45.71 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.264 -0.897 . . . . 0.0 109.413 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.522 ' N ' ' O ' ' A' ' 99' ' ' ASP . 52.9 t80 -77.43 -22.39 51.56 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.3 -0.875 . . . . 0.0 109.457 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -87.22 142.82 27.62 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.246 -0.908 . . . . 0.0 109.447 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 24.7 m80 -73.33 -22.7 60.26 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.232 -0.917 . . . . 0.0 109.477 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.571 HH11 ' CG ' ' A' ' 104' ' ' ARG . 3.4 mtt-85 50.93 -100.57 0.09 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.181 -0.949 . . . . 0.0 109.445 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.468 ' CG ' ' H ' ' A' ' 106' ' ' LYS . 31.5 t70 53.35 -176.74 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.221 -0.924 . . . . 0.0 109.394 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.468 ' H ' ' CG ' ' A' ' 105' ' ' ASP . 40.3 tptt -68.78 68.34 0.15 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.231 -0.918 . . . . 0.0 109.414 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.444 ' C ' ' H ' ' A' ' 109' ' ' PHE . 27.8 p30 -75.07 -6.19 48.17 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.287 -0.883 . . . . 0.0 109.5 -179.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -62.56 0.11 0.53 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.262 -0.899 . . . . 0.0 109.474 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.444 ' H ' ' C ' ' A' ' 107' ' ' ASP . 84.1 t80 -68.26 -12.35 60.87 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.242 -0.911 . . . . 0.0 109.494 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -70.9 -21.02 62.43 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.313 -0.867 . . . . 0.0 109.452 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 69.8 p -63.38 -75.91 0.07 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.273 -0.892 . . . . 0.0 109.498 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.584 ' CG ' HH11 ' A' ' 112' ' ' ARG . 0.3 OUTLIER 52.93 76.67 0.19 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.242 -0.911 . . . . 0.0 109.493 -179.984 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.503 ' O ' ' N ' ' A' ' 115' ' ' HIS . 46.2 t -170.35 -144.09 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.249 -0.907 . . . . 0.0 109.495 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.447 ' N ' ' OG ' ' A' ' 113' ' ' SER . 41.5 t -66.53 64.6 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.28 -0.888 . . . . 0.0 109.438 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . 0.503 ' N ' ' O ' ' A' ' 113' ' ' SER . 52.4 t-80 -166.26 63.37 0.1 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.232 -0.918 . . . . 0.0 109.458 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -151.5 -56.43 0.15 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.235 -0.916 . . . . 0.0 109.347 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.518 ' O ' ' N ' ' A' ' 119' ' ' GLY . 72.3 t80 -65.68 -11.19 42.94 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.25 -0.907 . . . . 0.0 109.459 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 20.0 t70 50.99 -90.59 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.229 -0.92 . . . . 0.0 109.578 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' A' ' 117' ' ' PHE . . . -162.17 -179.72 36.98 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.449 -1.461 . . . . 0.0 109.449 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.466 ' C ' ' H ' ' A' ' 122' ' ' GLY . 51.3 mtp180 -57.31 160.79 3.71 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.264 -1.139 . . . . 0.0 109.52 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 76.5 p -72.18 13.84 0.28 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.291 -0.881 . . . . 0.0 109.444 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . 0.466 ' H ' ' C ' ' A' ' 120' ' ' ARG . . . -165.53 105.75 0.25 Allowed Glycine 0 N--CA 1.49 2.261 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 15.9 mt -67.56 127.56 33.2 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.24 -1.153 . . . . 0.0 109.212 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.531 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -73.32 162.15 75.75 Favored Pre-proline 0 N--CA 1.489 1.482 0 O-C-N 121.229 -0.919 . . . . 0.0 108.814 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.531 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 2.3 Cg_endo -55.99 177.79 0.13 Allowed 'Trans proline' 0 C--N 1.319 -1.021 0 C-N-CA 121.354 1.37 . . . . 0.0 109.69 179.625 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -78.43 29.22 0.19 Allowed 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.215 -0.928 . . . . 0.0 109.443 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . 0.514 ' CG ' ' N ' ' A' ' 128' ' ' ALA . 68.7 t80 -76.06 176.39 8.01 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.219 -0.926 . . . . 0.0 109.381 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.514 ' N ' ' CG ' ' A' ' 127' ' ' PHE . . . -161.17 -136.36 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.319 -0.863 . . . . 0.0 109.528 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -169.16 -69.82 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.185 -0.947 . . . . 0.0 109.449 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.464 HD23 ' C ' ' A' ' 130' ' ' LEU . 1.8 tt -62.26 -73.67 0.1 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.167 -0.958 . . . . 0.0 109.026 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . 0.421 ' O ' ' O ' ' A' ' 130' ' ' LEU . . . 61.17 146.66 0.01 OUTLIER Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.674 -1.37 . . . . 0.0 109.674 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.621 ' CD ' ' H ' ' A' ' 132' ' ' GLU . 1.4 pm0 -54.59 -26.42 32.35 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.25 -1.147 . . . . 0.0 109.39 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 69.0 m -83.36 96.01 8.39 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.317 -0.864 . . . . 0.0 109.477 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -67.45 -14.05 63.9 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . 0.485 ' OG ' ' N ' ' A' ' 136' ' ' SER . 28.8 t -172.52 -130.59 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.307 -1.114 . . . . 0.0 109.439 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.485 ' N ' ' OG ' ' A' ' 135' ' ' SER . 18.4 p 54.77 13.6 0.74 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.242 -0.911 . . . . 0.0 109.479 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 42.9 t -72.71 151.27 42.28 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.341 -0.849 . . . . 0.0 109.499 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 10.7 m 53.88 -121.73 1.88 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.241 -0.912 . . . . 0.0 109.438 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 56.4 mttp -61.75 -153.17 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.202 -0.936 . . . . 0.0 109.432 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . 0.421 ' O ' ' O ' ' A' ' 141' ' ' SER . 1.3 t -164.99 -22.45 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.264 -0.898 . . . . 0.0 109.407 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . 0.421 ' O ' ' O ' ' A' ' 140' ' ' THR . 5.4 p 61.17 149.22 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.372 -0.83 . . . . 0.0 109.447 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 69.5 p -78.89 52.59 1.26 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.312 -0.867 . . . . 0.0 109.52 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 13.3 m-70 51.79 -158.57 0.11 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.234 -0.917 . . . . 0.0 109.453 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . 0.438 ' O ' ' N ' ' A' ' 146' ' ' GLN . 74.6 m -166.6 48.65 0.07 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.174 -0.954 . . . . 0.0 109.461 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -69.65 65.02 0.2 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.282 -0.886 . . . . 0.0 109.462 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . 0.438 ' N ' ' O ' ' A' ' 144' ' ' SER . 11.2 tt0 -73.02 75.86 1.2 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.234 -0.916 . . . . 0.0 109.55 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -71.1 154.39 41.79 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.273 -0.892 . . . . 0.0 109.471 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . 0.516 HG22 ' N ' ' A' ' 149' ' ' SER . 8.2 p -170.12 161.66 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.292 -0.88 . . . . 0.0 109.474 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . 0.516 ' N ' HG22 ' A' ' 148' ' ' VAL . 73.6 m -158.07 -95.59 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.233 -0.917 . . . . 0.0 109.469 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . 0.417 ' H ' ' H ' ' A' ' 151' ' ' SER . 18.0 t -172.41 -2.73 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.253 -0.904 . . . . 0.0 109.487 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . 0.417 ' H ' ' H ' ' A' ' 150' ' ' SER . 44.0 t -62.47 111.35 2.0 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.183 -0.948 . . . . 0.0 109.511 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 24.8 m 53.26 94.49 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.259 -0.901 . . . . 0.0 109.482 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . 0.447 HG22 ' H ' ' A' ' 153' ' ' THR . 0.1 OUTLIER -67.67 79.84 0.19 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.295 -0.878 . . . . 0.0 109.499 -179.999 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 27.4 m -61.62 -17.7 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.232 -0.918 . . . . 0.0 109.485 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . 0.534 ' ND2' ' H ' ' A' ' 157' ' ' GLY . 15.9 t30 -61.31 178.69 0.26 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.195 -0.941 . . . . 0.0 109.424 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . 0.431 ' H ' ' ND2' ' A' ' 155' ' ' ASN . 28.7 ptt180 -168.66 52.53 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.304 -0.873 . . . . 0.0 109.505 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . 0.534 ' H ' ' ND2' ' A' ' 155' ' ' ASN . . . -70.89 -65.82 2.36 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 170.57 150.65 7.06 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 27.4 m -165.08 154.74 13.07 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.254 -1.144 . . . . 0.0 109.478 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -82.58 33.67 0.42 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.222 -0.923 . . . . 0.0 109.498 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 95.8 mt -67.22 -71.26 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.202 -0.936 . . . . 0.0 109.488 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -78.86 109.59 13.27 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.285 -0.884 . . . . 0.0 109.45 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 89.8 p -163.95 126.16 2.42 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.231 -0.918 . . . . 0.0 109.473 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 4.8 tmtp? 56.7 34.61 24.87 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.253 -0.904 . . . . 0.0 109.129 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 75.8 m-70 48.04 -168.48 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.189 -0.944 . . . . 0.0 109.72 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 63.8 t80 . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 117.954 -1.022 . . . . 0.0 109.489 -179.918 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.6 mmt . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -61.92 -60.71 7.62 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 24.4 m 52.94 96.8 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.254 -1.145 . . . . 0.0 109.45 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.516 ' CD2' ' O ' ' A' ' 4' ' ' PHE . 70.9 t80 -169.22 36.44 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.242 -0.911 . . . . 0.0 109.475 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 52.94 70.39 0.59 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.184 -0.948 . . . . 0.0 109.524 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -170.36 135.18 1.23 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.317 -0.864 . . . . 0.0 109.439 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -170.01 -163.09 0.34 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.133 -0.979 . . . . 0.0 109.472 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -166.34 89.6 0.1 Allowed Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 84.8 p -170.47 120.75 0.59 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.346 -1.09 . . . . 0.0 109.379 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 28.7 m -64.13 166.05 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.272 -0.893 . . . . 0.0 109.482 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 68.2 m -166.85 87.24 0.3 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.334 -0.854 . . . . 0.0 109.418 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.6 m -72.7 -134.61 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.216 -0.928 . . . . 0.0 109.392 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -52.55 118.17 7.42 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 80.8 p -64.09 104.23 0.7 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.271 -1.135 . . . . 0.0 109.476 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.528 ' O ' ' N ' ' A' ' 17' ' ' GLU . 59.7 mttm 52.57 -133.04 1.87 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.35 -0.844 . . . . 0.0 109.498 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 52.25 -88.52 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.285 -0.884 . . . . 0.0 109.562 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.528 ' N ' ' O ' ' A' ' 15' ' ' LYS . 43.3 tt0 -64.73 -48.65 73.81 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.227 -0.921 . . . . 0.0 109.528 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -82.59 50.72 1.71 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.286 -0.884 . . . . 0.0 109.549 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -171.47 -69.22 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.229 -0.919 . . . . 0.0 109.646 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 82.7 p -63.15 176.15 0.8 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.348 -0.845 . . . . 0.0 109.701 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -158.01 -149.35 5.43 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.14 -1.584 . . . . 0.0 109.14 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 75.3 mttt 58.56 -152.55 0.4 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.143 -1.21 . . . . 0.0 109.579 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.9 tp 68.71 172.21 0.29 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.226 -0.921 . . . . 0.0 108.991 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.549 ' C ' ' HG1' ' A' ' 25' ' ' THR . 13.1 p -69.51 -5.95 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.119 -0.988 . . . . 0.0 109.472 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.549 ' HG1' ' C ' ' A' ' 24' ' ' VAL . 69.1 p 48.39 -92.02 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.255 -0.903 . . . . 0.0 109.667 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.506 ' N ' ' O ' ' A' ' 24' ' ' VAL . 29.9 m -162.34 -0.71 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.195 -0.941 . . . . 0.0 109.462 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -80.85 46.95 0.93 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.105 -0.997 . . . . 0.0 109.496 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -160.5 -152.45 6.57 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.514 -1.435 . . . . 0.0 109.514 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.405 ' H ' ' H ' ' A' ' 30' ' ' LYS . 22.9 t70 -164.15 -0.17 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.248 -1.148 . . . . 0.0 109.385 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.405 ' H ' ' H ' ' A' ' 29' ' ' ASP . 24.2 ttpp -60.66 99.03 0.07 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.242 -0.911 . . . . 0.0 109.427 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.404 ' HG3' ' H ' ' A' ' 33' ' ' LEU . 9.6 tp10 -68.62 143.29 54.87 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.226 -0.921 . . . . 0.0 109.318 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.4 tp -66.76 -22.07 66.05 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.229 -0.919 . . . . 0.0 109.439 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.585 ' N ' HD12 ' A' ' 33' ' ' LEU . 8.5 mp -78.08 120.49 22.98 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.325 -0.86 . . . . 0.0 109.291 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.426 ' O ' ' O ' ' A' ' 33' ' ' LEU . 67.3 mt 52.63 99.69 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.295 -0.878 . . . . 0.0 109.598 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.416 ' OD1' ' N ' ' A' ' 35' ' ' ASP . 15.3 p-10 -75.18 122.83 24.23 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.239 -0.913 . . . . 0.0 109.395 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 -67.86 94.74 0.48 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.223 -0.923 . . . . 0.0 109.509 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 50.15 -148.72 0.29 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.261 -0.9 . . . . 0.0 109.535 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 19.7 pttp -163.92 57.19 0.16 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.212 -0.93 . . . . 0.0 109.436 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 20.8 t 53.35 72.68 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.242 -0.911 . . . . 0.0 109.479 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 62.2 m -78.17 155.75 30.23 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.244 -0.91 . . . . 0.0 109.436 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 90.8 p -60.9 104.88 0.4 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.292 -0.88 . . . . 0.0 109.533 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 173.48 144.65 4.79 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.441 ' ND1' ' N ' ' A' ' 44' ' ' THR . 3.0 p80 -170.06 -16.55 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.331 -1.099 . . . . 0.0 109.439 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.441 ' N ' ' ND1' ' A' ' 43' ' ' HIS . 37.3 m -62.74 -72.82 0.12 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.271 -0.893 . . . . 0.0 109.481 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 81.6 p -68.77 101.14 1.27 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.28 -0.887 . . . . 0.0 109.429 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 41.1 p -152.86 -39.33 0.1 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.269 -0.894 . . . . 0.0 109.441 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.9 m -165.85 31.08 0.05 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.289 -0.882 . . . . 0.0 109.382 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 10.1 ptp180 -146.12 143.37 29.3 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.121 -0.987 . . . . 0.0 109.214 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.467 ' CD ' ' N ' ' A' ' 49' ' ' ARG . 11.1 mpt_? -88.14 127.4 35.43 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.068 -1.02 . . . . 0.0 109.448 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.413 ' O ' ' O ' ' A' ' 51' ' ' CYS . 98.6 p -58.24 -62.48 1.8 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.292 -0.88 . . . . 0.0 109.663 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.415 ' SG ' ' N ' ' A' ' 52' ' ' SER . 36.8 t -50.81 -97.14 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.213 -0.929 . . . . 0.0 109.703 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.415 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 30.8 t -51.1 150.12 3.36 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.294 -0.879 . . . . 0.0 109.721 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -85.2 105.01 15.59 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.28 -0.888 . . . . 0.0 109.106 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.41 ' HB ' ' H ' ' A' ' 49' ' ' ARG . 99.4 t -126.55 119.68 54.3 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.961 0 O-C-N 121.517 -0.739 . . . . 0.0 110.021 -179.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.453 HG23 ' O ' ' A' ' 55' ' ' ILE . 19.3 tt -127.13 128.74 70.73 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 179.204 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 48.7 p -130.42 120.71 24.64 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.247 -0.908 . . . . 0.0 110.357 -179.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.481 ' H ' ' HB ' ' A' ' 69' ' ' THR . 9.6 mttp -121.04 111.34 17.34 Favored 'General case' 0 N--CA 1.509 2.506 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 177.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 52.0 p -119.26 139.43 51.9 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.377 -0.827 . . . . 0.0 109.498 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.8 m -132.48 121.12 44.74 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 O-C-N 121.542 -0.724 . . . . 0.0 109.184 178.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -109.49 135.55 50.32 Favored 'General case' 0 N--CA 1.497 1.909 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 179.607 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.869 HD22 ' H ' ' A' ' 63' ' ' ASP . 0.2 OUTLIER -153.11 153.49 32.92 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 120.661 -1.274 . . . . 0.0 109.536 -179.814 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.733 ' N ' HD22 ' A' ' 61' ' ' ASN . . . -74.36 -11.9 60.38 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 120.498 -1.376 . . . . 0.0 112.091 -178.556 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.869 ' H ' HD22 ' A' ' 61' ' ' ASN . 11.7 p30 -74.32 2.19 9.87 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.043 -1.036 . . . . 0.0 109.743 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.78 11.16 62.24 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 36.9 ttm180 -96.08 99.09 10.88 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.011 -1.288 . . . . 0.0 109.123 179.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 68.4 p -125.8 83.4 2.16 Favored 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -94.99 129.76 41.92 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.348 -0.845 . . . . 0.0 111.065 -178.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.1 p -108.45 112.43 24.83 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 179.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.522 ' O ' ' N ' ' A' ' 71' ' ' GLU . 3.6 m -106.47 31.06 5.47 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 179.106 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.9 mttm -64.13 70.79 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 119.808 -0.757 . . . . 0.0 109.388 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.522 ' N ' ' O ' ' A' ' 69' ' ' THR . 51.7 mt-10 -89.55 140.18 29.8 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.242 -0.911 . . . . 0.0 109.274 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.409 ' O ' HG23 ' A' ' 72' ' ' VAL . 23.6 m -127.39 136.31 60.94 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 17.2 t -128.2 117.38 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.976 0 CA-C-O 122.186 0.993 . . . . 0.0 109.122 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.412 ' O ' ' O ' ' A' ' 75' ' ' SER . 94.1 mttt -94.08 -2.95 52.05 Favored 'General case' 0 C--N 1.291 -1.949 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.561 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.412 ' O ' ' O ' ' A' ' 74' ' ' LYS . 8.4 m 51.34 -178.89 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.252 -0.905 . . . . 0.0 109.235 -179.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.466 ' N ' ' CD ' ' A' ' 76' ' ' GLU . 1.4 pm0 -157.94 44.84 0.33 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.213 -0.929 . . . . 0.0 109.604 -179.812 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -153.5 17.85 0.54 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.278 -0.889 . . . . 0.0 109.722 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 70.42 63.91 3.06 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 109.614 -1.395 . . . . 0.0 109.614 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 49.5 m -52.88 -53.94 41.75 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.216 -1.167 . . . . 0.0 109.293 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -155.45 9.61 0.29 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.248 -0.908 . . . . 0.0 109.158 179.684 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 85.6 m -131.72 -89.72 0.44 Allowed 'General case' 0 N--CA 1.498 1.952 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.459 ' C ' ' H ' ' A' ' 84' ' ' ALA . . . -179.44 31.13 0.06 OUTLIER Glycine 0 N--CA 1.489 2.203 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 68.6 m-20 -64.02 1.34 0.7 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.233 -1.157 . . . . 0.0 109.446 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.459 ' H ' ' C ' ' A' ' 82' ' ' GLY . . . -65.11 -144.29 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.266 -0.896 . . . . 0.0 109.422 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.522 ' O ' ' CG ' ' A' ' 86' ' ' PHE . 6.1 p-10 -168.86 -115.71 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.288 -0.883 . . . . 0.0 109.423 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.522 ' CG ' ' O ' ' A' ' 85' ' ' ASP . 90.7 m-85 -158.91 78.12 0.76 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.294 -0.879 . . . . 0.0 109.456 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -157.71 46.46 0.37 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.284 -0.885 . . . . 0.0 109.348 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 26.4 t-105 -57.24 150.15 18.44 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.229 -0.919 . . . . 0.0 109.476 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.522 ' O ' ' CG ' ' A' ' 90' ' ' HIS . 29.4 t-80 -166.19 93.38 0.52 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.246 -0.909 . . . . 0.0 109.472 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.522 ' CG ' ' O ' ' A' ' 89' ' ' HIS . 61.5 m80 -157.27 176.67 12.4 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.247 -0.908 . . . . 0.0 109.313 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.539 HG22 ' H ' ' A' ' 92' ' ' PHE . 1.4 m -69.13 -145.09 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.215 -0.928 . . . . 0.0 109.245 -179.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.539 ' H ' HG22 ' A' ' 91' ' ' THR . 52.1 t80 45.42 67.25 4.38 Favored Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 121.222 -0.924 . . . . 0.0 109.922 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -61.95 -163.9 0.04 OUTLIER 'Trans proline' 0 C--N 1.317 -1.095 0 C-N-CA 121.371 1.381 . . . . 0.0 109.768 -179.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 62.4 m -163.1 109.22 1.15 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.296 -0.877 . . . . 0.0 109.385 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 36.0 ttp180 -64.96 134.1 53.18 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.239 -0.913 . . . . 0.0 109.499 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -73.81 107.71 2.32 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -78.72 48.3 0.8 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.213 -1.169 . . . . 0.0 109.464 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 17.0 mt -69.46 172.93 6.48 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.163 -0.96 . . . . 0.0 109.392 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.501 ' O ' ' N ' ' A' ' 101' ' ' PHE . 34.9 t70 -168.58 -75.06 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.204 -0.935 . . . . 0.0 109.461 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -65.5 68.68 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.302 -0.873 . . . . 0.0 109.522 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.501 ' N ' ' O ' ' A' ' 99' ' ' ASP . 81.5 t80 -77.81 -28.21 50.3 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.214 -0.929 . . . . 0.0 109.421 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.521 ' CD2' ' O ' ' A' ' 102' ' ' PHE . 81.2 t80 -169.54 7.58 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.193 -0.942 . . . . 0.0 109.555 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -63.5 -42.62 98.5 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.18 -0.95 . . . . 0.0 109.533 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -65.75 169.03 6.9 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.336 -0.852 . . . . 0.0 109.523 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 52.57 75.05 0.25 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.222 -0.924 . . . . 0.0 109.515 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 18.8 ttpp -63.74 124.19 20.81 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.222 -0.924 . . . . 0.0 109.459 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -167.13 102.42 0.53 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.237 -0.914 . . . . 0.0 109.497 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.451 ' C ' ' H ' ' A' ' 110' ' ' PHE . 13.4 p-10 -170.05 -4.09 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.218 -0.926 . . . . 0.0 109.478 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.51 ' O ' ' CD2' ' A' ' 109' ' ' PHE . 78.5 t80 -65.64 3.06 0.8 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.196 -0.94 . . . . 0.0 109.484 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . 0.519 ' O ' ' CD2' ' A' ' 110' ' ' PHE . 37.8 p90 -162.28 114.07 1.64 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.241 -0.912 . . . . 0.0 109.415 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 78.7 p -67.15 -171.1 0.14 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.29 -0.881 . . . . 0.0 109.501 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.539 ' CG ' HH11 ' A' ' 112' ' ' ARG . 0.2 OUTLIER -71.21 -36.27 71.83 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.311 -0.868 . . . . 0.0 109.496 -179.948 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 24.3 t -173.09 -16.7 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.312 -0.867 . . . . 0.0 109.419 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 92.6 p -63.24 94.7 0.08 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.213 -0.93 . . . . 0.0 109.388 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . 0.494 ' CG ' ' N ' ' A' ' 116' ' ' GLU . 0.4 OUTLIER -72.79 -116.39 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.215 -0.928 . . . . 0.0 109.481 -179.995 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.494 ' N ' ' CG ' ' A' ' 115' ' ' HIS . 37.2 mt-10 -152.56 127.01 9.31 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.134 -0.979 . . . . 0.0 109.284 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -74.21 -104.24 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.314 -0.867 . . . . 0.0 109.566 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.429 ' OD1' ' N ' ' A' ' 119' ' ' GLY . 18.4 p30 -70.23 -116.78 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.292 -0.88 . . . . 0.0 109.546 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.429 ' N ' ' OD1' ' A' ' 118' ' ' ASP . . . 72.06 -158.79 53.52 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.427 ' O ' ' O ' ' A' ' 119' ' ' GLY . 32.8 ptt180 -56.56 -166.45 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.259 -1.142 . . . . 0.0 109.303 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 71.8 p -148.64 -75.94 0.17 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.129 -0.982 . . . . 0.0 109.408 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -171.48 -149.14 6.4 Favored Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 10.7 tp -65.24 136.19 56.31 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.231 -1.158 . . . . 0.0 109.287 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.539 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -72.04 162.43 73.57 Favored Pre-proline 0 N--CA 1.491 1.596 0 O-C-N 121.256 -0.903 . . . . 0.0 108.814 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.539 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 2.3 Cg_endo -56.18 143.82 83.25 Favored 'Trans proline' 0 C--N 1.32 -0.947 0 C-N-CA 121.3 1.333 . . . . 0.0 109.73 179.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -72.11 -21.71 61.44 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.216 -0.928 . . . . 0.0 109.344 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -140.64 115.87 9.92 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.334 -0.853 . . . . 0.0 109.295 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -72.55 -63.61 1.12 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.235 -0.916 . . . . 0.0 109.502 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -168.67 142.95 3.18 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.219 -0.925 . . . . 0.0 109.568 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.46 ' C ' ' H ' ' A' ' 132' ' ' GLU . 14.3 mt -71.61 51.62 0.19 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.314 -0.866 . . . . 0.0 109.353 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -74.25 35.88 0.94 Allowed Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.46 ' H ' ' C ' ' A' ' 130' ' ' LEU . 44.7 mm-40 -72.0 121.35 19.01 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.286 -1.126 . . . . 0.0 109.51 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . 0.451 ' OG ' ' N ' ' A' ' 134' ' ' GLY . 47.9 t -71.0 -151.75 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.25 -0.906 . . . . 0.0 109.493 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . 0.521 ' O ' ' N ' ' A' ' 136' ' ' SER . . . -61.59 -146.84 0.01 OUTLIER Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.485 -1.446 . . . . 0.0 109.485 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 3.8 t 62.35 -73.04 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.393 -1.063 . . . . 0.0 109.643 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.521 ' N ' ' O ' ' A' ' 134' ' ' GLY . 29.9 t -48.5 -85.34 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.266 -0.896 . . . . 0.0 109.512 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 69.6 m -165.31 72.6 0.19 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.25 -0.906 . . . . 0.0 109.474 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 77.4 p -170.58 37.94 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.254 -0.904 . . . . 0.0 109.511 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -70.67 -28.24 64.64 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.199 -0.938 . . . . 0.0 109.43 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 32.7 p 48.93 56.95 6.98 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.214 -0.929 . . . . 0.0 109.57 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 39.3 t -68.97 -125.93 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.23 -0.919 . . . . 0.0 109.393 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 80.6 p -67.81 -174.79 0.48 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.203 -0.936 . . . . 0.0 109.447 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 46.2 m170 -68.89 -57.47 5.49 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.214 -0.929 . . . . 0.0 109.421 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 31.7 t -169.79 106.79 0.36 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.228 -0.92 . . . . 0.0 109.504 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -69.92 -100.03 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.21 -0.931 . . . . 0.0 109.446 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -170.24 89.25 0.15 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.281 -0.887 . . . . 0.0 109.512 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . 0.441 ' C ' ' H ' ' A' ' 149' ' ' SER . 70.0 m-85 -71.31 152.73 42.96 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.195 -0.941 . . . . 0.0 109.451 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . 0.455 ' O ' ' N ' ' A' ' 150' ' ' SER . 33.5 m -69.5 7.7 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.226 -0.922 . . . . 0.0 109.491 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . 0.441 ' H ' ' C ' ' A' ' 147' ' ' PHE . 66.3 m -69.96 49.12 0.1 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.237 -0.914 . . . . 0.0 109.49 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . 0.455 ' N ' ' O ' ' A' ' 148' ' ' VAL . 75.6 m -166.84 28.85 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.257 -0.902 . . . . 0.0 109.467 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . 0.43 ' O ' ' N ' ' A' ' 153' ' ' THR . 12.2 t 52.8 53.79 11.56 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.214 -0.929 . . . . 0.0 109.451 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 46.5 p -70.81 48.28 0.11 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.258 -0.901 . . . . 0.0 109.458 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . 0.54 HG22 ' N ' ' A' ' 154' ' ' VAL . 54.0 m -55.49 165.92 0.73 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.218 -0.927 . . . . 0.0 109.416 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.54 ' N ' HG22 ' A' ' 153' ' ' THR . 28.3 t -48.2 -32.53 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.246 -0.909 . . . . 0.0 109.558 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 9.5 m120 52.62 95.44 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.249 -0.907 . . . . 0.0 109.601 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 70.4 ttt180 -62.14 112.04 2.21 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.238 -0.914 . . . . 0.0 109.445 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 73.34 -147.58 39.34 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 174.04 -147.37 9.28 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.621 -1.391 . . . . 0.0 109.621 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 90.1 p -59.66 -19.48 49.72 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.244 -1.151 . . . . 0.0 109.436 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -60.67 168.39 2.26 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.221 -0.924 . . . . 0.0 109.45 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 20.6 pt -69.32 167.63 1.74 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.286 -0.884 . . . . 0.0 109.459 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.415 ' O ' ' O ' ' A' ' 163' ' ' SER . 52.4 mt-10 -67.55 -25.76 65.97 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.29 -0.881 . . . . 0.0 109.428 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . 0.415 ' O ' ' O ' ' A' ' 162' ' ' GLU . 12.5 t 52.85 176.95 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.21 -0.931 . . . . 0.0 109.475 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -73.22 -76.64 0.12 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.137 -0.977 . . . . 0.0 109.491 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . 0.442 ' CG ' ' O ' ' A' ' 165' ' ' HIS . 53.9 t-80 -169.49 13.52 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.221 -0.924 . . . . 0.0 109.492 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 57.3 t80 . . . . . 0 N--CA 1.489 1.515 0 CA-C-O 117.992 -1.004 . . . . 0.0 109.488 -179.97 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.1 ptt? . . . . . 0 N--CA 1.49 1.559 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 177.51 33.16 0.05 OUTLIER Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -162.53 72.89 0.36 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.253 -1.145 . . . . 0.0 109.45 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -66.15 -21.32 66.33 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.231 -0.918 . . . . 0.0 109.527 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.418 ' HG2' ' H ' ' A' ' 5' ' ' ARG . 3.0 ptp180 -63.23 -112.77 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.269 -0.894 . . . . 0.0 109.447 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 50.73 36.47 14.35 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.119 -0.988 . . . . 0.0 109.296 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -80.67 -69.05 0.63 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.306 -0.871 . . . . 0.0 109.464 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 178.44 -67.02 0.08 OUTLIER Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.424 ' O ' ' O ' ' A' ' 10' ' ' VAL . 13.0 m 52.19 38.23 23.97 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.225 -1.162 . . . . 0.0 109.458 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.447 ' C ' ' H ' ' A' ' 12' ' ' SER . 32.9 m -61.92 -146.61 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.192 -0.943 . . . . 0.0 109.376 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 87.9 p -58.2 -4.92 0.4 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.196 -0.94 . . . . 0.0 109.491 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.447 ' H ' ' C ' ' A' ' 10' ' ' VAL . 32.6 t -53.01 -86.83 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.157 -0.964 . . . . 0.0 109.496 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 67.03 144.27 0.07 OUTLIER Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.446 ' O ' ' O ' ' A' ' 15' ' ' LYS . 40.0 m -62.65 141.22 58.61 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.223 -1.163 . . . . 0.0 109.493 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.446 ' O ' ' O ' ' A' ' 14' ' ' THR . 18.4 mmmt 54.5 164.37 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.584 -0.698 . . . . 0.0 109.954 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -90.42 73.6 6.95 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.041 -1.037 . . . . 0.0 109.227 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -65.13 -46.44 80.93 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.265 -0.897 . . . . 0.0 109.733 -179.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.51 ' O ' ' CD2' ' A' ' 18' ' ' PHE . 52.6 t80 51.89 29.49 6.1 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.111 -0.993 . . . . 0.0 109.462 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.432 ' O ' ' CG ' ' A' ' 19' ' ' HIS . 46.1 t-80 -170.0 17.18 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.229 -0.919 . . . . 0.0 109.523 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.1 m -69.25 -48.6 61.36 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.266 -0.897 . . . . 0.0 109.467 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 71.62 41.39 57.29 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 32.6 tptt -71.63 1.87 6.04 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.276 -1.132 . . . . 0.0 109.175 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 16.4 mt -63.07 120.91 12.35 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.334 -0.854 . . . . 0.0 109.439 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.9 t -75.47 -28.13 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.282 -0.886 . . . . 0.0 109.444 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.418 ' O ' ' OG1' ' A' ' 26' ' ' THR . 40.9 m -164.02 144.96 8.58 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.245 -0.909 . . . . 0.0 109.518 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.505 HG22 ' N ' ' A' ' 27' ' ' LYS . 49.7 m -166.51 163.88 17.13 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.384 -0.823 . . . . 0.0 109.24 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.505 ' N ' HG22 ' A' ' 26' ' ' THR . 2.5 tmtm? -158.13 73.93 0.69 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.203 -0.936 . . . . 0.0 109.159 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -155.93 -172.42 23.4 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.457 ' O ' ' N ' ' A' ' 31' ' ' GLU . 15.2 t70 -164.68 -74.54 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.215 -1.167 . . . . 0.0 109.482 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.472 ' N ' ' CD ' ' A' ' 30' ' ' LYS . 11.9 mptt 50.82 -95.01 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.228 -0.92 . . . . 0.0 109.189 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.457 ' N ' ' O ' ' A' ' 29' ' ' ASP . 34.0 tt0 55.17 58.61 4.56 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.311 -0.868 . . . . 0.0 109.475 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 15.5 mt -76.68 2.16 14.99 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.213 -0.93 . . . . 0.0 109.387 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.477 HD23 ' N ' ' A' ' 34' ' ' ILE . 1.6 tt -78.75 111.62 15.05 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.267 -0.895 . . . . 0.0 109.11 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.477 ' N ' HD23 ' A' ' 33' ' ' LEU . 16.2 tt -162.08 152.22 3.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.229 -0.919 . . . . 0.0 109.427 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -64.25 108.98 1.73 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.304 -0.872 . . . . 0.0 109.434 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -170.15 111.88 0.43 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.275 -0.89 . . . . 0.0 109.483 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.631 ' CD ' ' H ' ' A' ' 37' ' ' GLU . 9.0 pm0 -63.06 139.49 58.78 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.207 -0.933 . . . . 0.0 109.524 -179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -93.55 80.25 4.32 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.186 -0.946 . . . . 0.0 109.48 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 9.6 p -170.56 142.17 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.206 -0.934 . . . . 0.0 109.551 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.5 t -174.38 -27.87 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.249 -0.907 . . . . 0.0 109.436 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 24.2 t -171.78 161.55 5.96 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.289 -0.882 . . . . 0.0 109.521 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 178.74 -79.46 0.06 OUTLIER Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 15.6 p-80 -52.8 173.96 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.224 -1.163 . . . . 0.0 109.441 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.9 p -149.36 -134.95 0.07 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.291 -0.881 . . . . 0.0 109.421 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.445 ' O ' ' O ' ' A' ' 46' ' ' THR . 67.8 p -79.38 -30.19 42.4 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.187 -0.945 . . . . 0.0 109.488 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.521 ' O ' ' N ' ' A' ' 48' ' ' ARG . 4.3 p 57.0 109.76 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.402 -0.811 . . . . 0.0 109.727 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 70.7 p -66.68 49.46 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.311 -0.868 . . . . 0.0 110.026 -179.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.521 ' N ' ' O ' ' A' ' 46' ' ' THR . 84.8 mtt180 -146.0 142.51 28.72 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.174 -0.954 . . . . 0.0 108.946 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 11.3 tpp180 -96.73 121.77 38.95 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.082 -1.011 . . . . 0.0 109.538 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 89.3 p -60.28 -166.33 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.162 -0.961 . . . . 0.0 109.171 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 4.4 t 48.87 -125.67 1.99 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.104 -0.997 . . . . 0.0 109.048 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.442 ' N ' ' SG ' ' A' ' 81' ' ' CYS . 25.0 t -50.18 132.08 23.75 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.802 -1.186 . . . . 0.0 109.059 179.517 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.443 ' O ' ' O ' ' A' ' 73' ' ' VAL . 59.3 tttm -76.9 105.3 7.88 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.86 -1.15 . . . . 0.0 109.558 -179.489 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 47.5 t -123.88 116.08 46.98 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.926 0 O-C-N 121.484 -0.76 . . . . 0.0 109.454 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 43.7 mm -122.91 115.97 47.39 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 75.4 p -128.6 111.6 13.39 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.328 -0.858 . . . . 0.0 109.243 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.498 ' N ' ' OG1' ' A' ' 69' ' ' THR . 7.3 mtmt -124.67 113.46 18.03 Favored 'General case' 0 N--CA 1.515 2.775 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 58.9 p -119.4 131.84 55.73 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.549 -0.719 . . . . 0.0 109.117 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.406 ' CG2' ' OE1' ' A' ' 67' ' ' GLU . 2.8 m -133.47 126.79 52.58 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.2 0 O-C-N 121.476 -0.765 . . . . 0.0 109.605 179.421 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.404 HG23 ' O ' ' A' ' 60' ' ' THR . 8.6 t -108.13 134.16 51.39 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.429 -0.795 . . . . 0.0 109.34 179.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -125.89 162.02 26.13 Favored 'General case' 0 N--CA 1.516 2.875 0 O-C-N 121.503 -0.748 . . . . 0.0 109.304 179.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.05 -36.4 66.88 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.648 -1.283 . . . . 0.0 111.895 -178.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -72.83 7.05 2.17 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.571 -1.33 . . . . 0.0 109.874 -179.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.19 7.49 83.1 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.334 -1.506 . . . . 0.0 109.334 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 18.0 tpt180 -82.8 109.32 16.84 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 120.949 -1.324 . . . . 0.0 107.818 178.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.9 p -140.42 151.42 44.9 Favored 'General case' 0 C--N 1.306 -1.301 0 O-C-N 121.217 -0.927 . . . . 0.0 108.678 -178.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.406 ' OE1' ' CG2' ' A' ' 59' ' ' VAL . 24.4 mp0 -131.43 117.43 18.84 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 179.428 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.8 p -100.89 105.97 17.28 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.189 -0.944 . . . . 0.0 110.16 -179.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.504 ' O ' ' N ' ' A' ' 71' ' ' GLU . 78.3 p -109.82 30.51 6.62 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 178.626 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.0 ptpt -66.74 66.0 0.06 Allowed 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 179.663 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.504 ' N ' ' O ' ' A' ' 69' ' ' THR . 63.2 mm-40 -108.17 151.59 25.71 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.425 -0.797 . . . . 0.0 110.147 -179.152 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 72' ' ' VAL . 12.7 m -127.97 135.11 63.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 179.368 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.443 ' O ' ' O ' ' A' ' 53' ' ' LYS . 16.4 t -129.34 115.64 36.22 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 CA-C-O 122.235 1.017 . . . . 0.0 109.625 179.662 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 45.5 mttp -74.02 150.06 40.88 Favored 'General case' 0 C--N 1.289 -2.027 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.428 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 32.2 t -74.92 111.65 10.34 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.238 -0.914 . . . . 0.0 109.489 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 -71.37 -10.84 60.41 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.25 -0.906 . . . . 0.0 109.237 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -105.78 -18.19 14.14 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.49 -0.756 . . . . 0.0 109.522 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.34 -37.93 90.96 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.399 -1.481 . . . . 0.0 109.399 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 6.2 m 55.83 11.44 0.69 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.34 -1.094 . . . . 0.0 109.719 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -163.69 20.22 0.07 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.087 -1.008 . . . . 0.0 109.628 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.442 ' SG ' ' N ' ' A' ' 52' ' ' SER . 6.2 t -136.39 115.07 12.01 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.527 -0.733 . . . . 0.0 109.313 -179.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.47 -46.36 3.55 Favored Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.4 -1.48 . . . . 0.0 109.4 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -81.45 122.99 28.21 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.29 -1.123 . . . . 0.0 109.386 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -169.0 33.01 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.301 -0.874 . . . . 0.0 109.384 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -76.38 41.26 0.24 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.194 -0.941 . . . . 0.0 109.215 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 85.0 m-85 -64.38 -179.43 0.46 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.411 -0.806 . . . . 0.0 109.297 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.424 ' O ' ' N ' ' A' ' 89' ' ' HIS . 59.5 m-20 -157.55 -66.95 0.1 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.274 -0.891 . . . . 0.0 109.38 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . 0.5 ' C ' ' H ' ' A' ' 90' ' ' HIS . 96.9 m95 51.49 -95.27 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.25 -0.906 . . . . 0.0 109.57 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.424 ' N ' ' O ' ' A' ' 87' ' ' ASP . 0.8 OUTLIER 61.54 -4.18 0.18 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.507 -0.746 . . . . 0.0 109.98 -179.886 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.5 ' H ' ' C ' ' A' ' 88' ' ' TRP . 30.2 m-70 45.4 58.95 3.83 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.121 -0.987 . . . . 0.0 109.904 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.43 ' O ' ' O ' ' A' ' 90' ' ' HIS . 5.5 m 56.88 165.29 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.247 -0.908 . . . . 0.0 109.337 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -59.56 149.97 68.13 Favored Pre-proline 0 N--CA 1.49 1.573 0 O-C-N 121.214 -0.929 . . . . 0.0 108.936 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -57.17 -42.74 59.94 Favored 'Trans proline' 0 C--N 1.323 -0.805 0 C-N-CA 121.006 1.137 . . . . 0.0 109.719 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 8.6 t 55.81 63.58 2.0 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.297 -0.877 . . . . 0.0 109.451 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 55.1 mtp180 -74.09 -144.23 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.29 -0.881 . . . . 0.0 109.48 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -175.29 9.76 0.03 OUTLIER Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -70.12 -21.5 63.1 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.287 -1.125 . . . . 0.0 109.495 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 59.5 tp -59.25 131.74 51.91 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.282 -0.886 . . . . 0.0 109.233 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.412 ' O ' ' O ' ' A' ' 100' ' ' ASP . 26.3 t0 -168.18 68.51 0.08 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.249 -0.907 . . . . 0.0 109.556 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.412 ' O ' ' O ' ' A' ' 99' ' ' ASP . 29.6 m-20 50.72 -177.9 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.213 -0.929 . . . . 0.0 109.516 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -76.83 -53.8 7.44 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.249 -0.907 . . . . 0.0 109.467 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 51.8 91.61 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.222 -0.924 . . . . 0.0 109.0 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 -76.59 -22.64 53.95 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.236 -0.915 . . . . 0.0 109.274 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.583 HH11 ' CG ' ' A' ' 104' ' ' ARG . 0.0 OUTLIER -167.55 137.27 2.75 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.246 -0.909 . . . . 0.0 109.4 179.974 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.51 ' O ' ' N ' ' A' ' 107' ' ' ASP . 3.8 p30 -73.83 122.36 22.35 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.233 -0.917 . . . . 0.0 109.48 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 19.8 mtpp -62.6 77.25 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.262 -0.899 . . . . 0.0 109.347 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.51 ' N ' ' O ' ' A' ' 105' ' ' ASP . 5.6 p-10 -57.83 167.89 1.05 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.341 -0.849 . . . . 0.0 109.628 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.413 ' OD1' ' N ' ' A' ' 108' ' ' ASP . 19.3 p-10 -167.24 65.68 0.09 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.312 -0.868 . . . . 0.0 109.173 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 46.6 m-85 -59.93 -46.22 90.09 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.272 -0.892 . . . . 0.0 109.858 -179.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 -51.55 151.36 3.21 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.023 -1.048 . . . . 0.0 109.822 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 81.6 p -135.94 -62.44 0.68 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.547 -0.721 . . . . 0.0 109.12 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 17.3 tpt180 -75.02 122.65 23.84 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.295 -0.878 . . . . 0.0 109.288 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 72.4 m -165.73 -99.68 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.225 -0.922 . . . . 0.0 109.493 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.407 ' H ' ' H ' ' A' ' 115' ' ' HIS . 23.8 t -170.34 2.56 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.301 -0.874 . . . . 0.0 109.498 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . 0.407 ' H ' ' H ' ' A' ' 114' ' ' SER . 31.6 m80 -59.73 -22.16 61.67 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.166 -0.959 . . . . 0.0 109.462 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -70.87 135.19 47.88 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.249 -0.907 . . . . 0.0 109.422 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -70.71 102.59 2.34 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.194 -0.941 . . . . 0.0 109.46 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -169.11 59.38 0.05 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.251 -0.906 . . . . 0.0 109.486 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 161.98 -0.13 0.06 OUTLIER Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.54 ' CG ' HH11 ' A' ' 120' ' ' ARG . 0.3 OUTLIER -75.32 -103.89 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.274 -1.133 . . . . 0.0 109.451 -179.92 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 4.3 m 57.71 -127.08 1.67 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.12 -0.988 . . . . 0.0 109.419 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 169.39 160.96 18.85 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 10.7 tp -73.36 146.89 44.85 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.277 -1.131 . . . . 0.0 109.318 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -67.61 153.63 94.66 Favored Pre-proline 0 N--CA 1.489 1.518 0 O-C-N 121.102 -0.999 . . . . 0.0 108.82 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -57.08 -24.63 59.21 Favored 'Trans proline' 0 C--N 1.323 -0.808 0 C-N-CA 121.02 1.147 . . . . 0.0 109.683 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 23.9 tp10 -159.48 -124.85 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.329 -0.857 . . . . 0.0 109.458 -179.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -102.37 -168.2 1.5 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.285 -0.884 . . . . 0.0 109.405 179.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -76.89 -84.52 0.06 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.237 -0.915 . . . . 0.0 109.341 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -75.88 -135.01 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.324 -0.86 . . . . 0.0 109.404 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.435 HD23 ' C ' ' A' ' 130' ' ' LEU . 1.6 tt -169.31 101.79 0.35 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.252 -0.905 . . . . 0.0 109.218 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . 0.426 ' O ' ' N ' ' A' ' 133' ' ' SER . . . 169.31 2.15 0.03 OUTLIER Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 73.0 mt-10 -70.35 58.43 0.18 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.327 -1.102 . . . . 0.0 109.484 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . 0.426 ' N ' ' O ' ' A' ' 131' ' ' GLY . 89.8 p -64.42 157.02 27.57 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.261 -0.899 . . . . 0.0 109.427 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -62.65 -81.07 0.1 OUTLIER Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.521 -1.431 . . . . 0.0 109.521 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 20.4 m -64.92 -153.77 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.23 -1.159 . . . . 0.0 109.464 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.431 ' H ' ' H ' ' A' ' 137' ' ' SER . 89.1 p -169.12 -2.52 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.209 -0.932 . . . . 0.0 109.422 179.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . 0.431 ' H ' ' H ' ' A' ' 136' ' ' SER . 79.2 p -170.3 136.72 1.4 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.235 -0.915 . . . . 0.0 109.383 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 30.1 t -170.9 84.29 0.09 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.222 -0.924 . . . . 0.0 109.554 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -65.67 143.91 57.26 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.23 -0.918 . . . . 0.0 109.313 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 67.4 p -87.09 -131.19 0.06 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.231 -0.918 . . . . 0.0 109.359 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 99.3 p -62.85 115.25 4.2 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.236 -0.915 . . . . 0.0 109.412 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 39.4 m -69.14 141.52 54.61 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.339 -0.85 . . . . 0.0 109.495 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 54.0 m-70 -68.84 -75.73 0.1 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.307 -0.871 . . . . 0.0 109.445 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 14.7 t 51.85 63.42 2.25 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.203 -0.936 . . . . 0.0 109.407 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -69.92 5.19 1.65 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.251 -0.906 . . . . 0.0 109.548 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -63.6 -62.49 1.63 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.27 -0.894 . . . . 0.0 109.443 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -63.65 88.83 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.325 -0.86 . . . . 0.0 109.487 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 26.9 m -69.15 143.48 14.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.197 -0.939 . . . . 0.0 109.412 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 43.8 t -69.87 -39.22 76.46 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.317 -0.865 . . . . 0.0 109.52 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 27.2 m -65.84 -157.25 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.271 -0.893 . . . . 0.0 109.513 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 49.4 m -61.97 143.81 55.97 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.329 -0.857 . . . . 0.0 109.459 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . 0.518 ' O ' ' N ' ' A' ' 154' ' ' VAL . 24.4 m -71.16 72.27 0.61 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.259 -0.901 . . . . 0.0 109.464 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 98.1 m 51.71 -89.25 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.295 -0.878 . . . . 0.0 109.52 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.518 ' N ' ' O ' ' A' ' 152' ' ' THR . 30.0 m -64.52 160.94 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.224 -0.923 . . . . 0.0 109.437 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . 0.515 ' ND2' ' H ' ' A' ' 156' ' ' ARG . 12.6 p-10 -169.05 -112.69 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.305 -0.872 . . . . 0.0 109.56 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . 0.515 ' H ' ' ND2' ' A' ' 155' ' ' ASN . 11.6 tpp180 -68.07 -56.0 10.47 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.161 -0.962 . . . . 0.0 109.413 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -171.91 -43.57 0.04 OUTLIER Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -171.67 -118.78 0.49 Allowed Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 31.3 t -172.93 159.74 4.13 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.173 -1.192 . . . . 0.0 109.453 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -68.1 94.82 0.52 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.251 -0.906 . . . . 0.0 109.334 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . 0.498 HG23 ' O ' ' A' ' 161' ' ' ILE . 13.6 tt -70.83 117.33 13.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.182 -0.948 . . . . 0.0 109.552 -179.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -168.36 -58.1 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.154 -0.967 . . . . 0.0 109.422 -179.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 66.1 m -166.59 140.04 3.93 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.321 -0.862 . . . . 0.0 109.445 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 62.2 tttp -167.62 -15.02 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.222 -0.924 . . . . 0.0 109.545 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -162.78 165.3 25.61 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.311 -0.868 . . . . 0.0 109.438 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 . . . . . 0 N--CA 1.489 1.507 0 CA-C-O 118.002 -0.999 . . . . 0.0 109.451 -179.939 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.7 ttp . . . . . 0 N--CA 1.491 1.592 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -176.81 131.07 1.76 Allowed Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 65.9 p -64.18 -45.34 88.79 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.236 -1.155 . . . . 0.0 109.32 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 66.3 t80 -66.73 130.96 44.88 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.205 -0.934 . . . . 0.0 109.482 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.584 ' CG ' HH11 ' A' ' 5' ' ' ARG . 0.2 OUTLIER -170.39 -80.95 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.255 -0.903 . . . . 0.0 109.343 179.953 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.401 ' O ' ' O ' ' A' ' 5' ' ' ARG . 36.5 mt-10 -63.64 -134.37 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.173 -0.954 . . . . 0.0 109.493 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 58.01 100.83 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.24 -0.913 . . . . 0.0 109.268 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.423 ' C ' ' H ' ' A' ' 10' ' ' VAL . . . -172.61 133.65 2.73 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 90.2 p -73.08 11.83 0.64 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.209 -1.171 . . . . 0.0 109.468 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.423 ' H ' ' C ' ' A' ' 8' ' ' GLY . 34.0 t -60.85 128.83 22.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.262 -0.899 . . . . 0.0 109.565 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 92.9 p -62.16 174.47 0.9 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.335 -0.853 . . . . 0.0 109.506 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.3 t -174.1 68.33 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.231 -0.918 . . . . 0.0 109.515 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -179.5 50.07 0.09 OUTLIER Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.479 -1.449 . . . . 0.0 109.479 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 73.1 p -64.45 -11.85 37.64 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.296 -1.12 . . . . 0.0 109.447 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.449 ' C ' ' H ' ' A' ' 17' ' ' GLU . 18.8 tptm -70.39 53.93 0.14 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.189 -0.944 . . . . 0.0 109.406 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 36.1 mm-40 -75.68 34.26 0.12 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.268 -0.895 . . . . 0.0 109.456 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.449 ' H ' ' C ' ' A' ' 15' ' ' LYS . 25.0 mm-40 -73.47 -43.85 59.31 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.263 -0.898 . . . . 0.0 109.463 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -73.92 -69.06 0.46 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.21 -0.932 . . . . 0.0 109.498 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 69.0 t60 -76.13 121.07 22.3 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.225 -0.922 . . . . 0.0 109.466 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.6 t -174.08 -31.21 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.241 -0.912 . . . . 0.0 109.494 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -75.47 -117.65 0.11 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.458 ' CB ' ' NZ ' ' A' ' 22' ' ' LYS . 0.1 OUTLIER -167.99 63.2 0.07 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.287 -1.125 . . . . 0.0 109.449 -179.921 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 16.5 mt -66.15 -50.7 63.04 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.211 -0.931 . . . . 0.0 109.547 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.415 ' C ' ' HG1' ' A' ' 25' ' ' THR . 13.2 t 55.48 -113.32 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.258 -0.901 . . . . 0.0 109.218 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.491 HG22 ' H ' ' A' ' 26' ' ' THR . 0.2 OUTLIER -164.75 -166.49 1.07 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.882 -1.137 . . . . 0.0 109.222 -179.996 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.491 ' H ' HG22 ' A' ' 25' ' ' THR . 59.5 p -45.44 -38.25 5.91 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.219 -0.926 . . . . 0.0 109.892 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 46.8 mtmt -148.94 -133.93 0.06 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.228 -0.92 . . . . 0.0 109.436 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 76.07 -8.26 24.65 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.443 ' CG ' ' H ' ' A' ' 30' ' ' LYS . 15.6 t70 -169.72 -135.83 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.251 -1.147 . . . . 0.0 109.474 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.443 ' H ' ' CG ' ' A' ' 29' ' ' ASP . 65.1 tttm 50.16 85.32 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.232 -0.918 . . . . 0.0 109.449 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.43 ' OE1' ' O ' ' A' ' 31' ' ' GLU . 1.7 pp20? -172.57 26.03 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.264 -0.897 . . . . 0.0 109.606 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 20.2 mt -67.01 -20.53 65.88 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.25 -0.906 . . . . 0.0 109.425 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.563 ' H ' HD23 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -89.93 28.2 1.42 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.294 -0.879 . . . . 0.0 109.224 -179.982 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.549 HG23 ' N ' ' A' ' 35' ' ' ASP . 16.4 tt -64.62 -45.55 95.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.164 -0.96 . . . . 0.0 109.366 -179.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.549 ' N ' HG23 ' A' ' 34' ' ' ILE . 65.9 m-20 46.75 37.49 4.78 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.202 -0.936 . . . . 0.0 109.683 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 51.9 77.0 0.16 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.189 -0.945 . . . . 0.0 109.381 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.497 ' O ' ' N ' ' A' ' 39' ' ' VAL . 39.1 tt0 -62.91 118.6 8.0 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.25 -0.906 . . . . 0.0 109.564 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt -68.08 53.76 0.07 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.243 -0.911 . . . . 0.0 109.5 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.497 ' N ' ' O ' ' A' ' 37' ' ' GLU . 35.9 m -46.16 146.8 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.232 -0.917 . . . . 0.0 109.798 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.7 t -170.95 174.95 4.57 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.334 -0.854 . . . . 0.0 109.401 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 43.0 t -66.97 -58.34 5.14 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.271 -0.893 . . . . 0.0 109.444 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -173.19 113.16 0.46 Allowed Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.333 -1.507 . . . . 0.0 109.333 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -81.64 -68.01 0.73 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.33 -1.1 . . . . 0.0 109.42 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.9 p -75.95 73.29 2.85 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.231 -0.918 . . . . 0.0 109.308 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 61.3 p -75.45 140.66 43.02 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.182 -0.949 . . . . 0.0 109.447 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 1.6 t -147.44 31.98 0.89 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.247 -0.908 . . . . 0.0 109.42 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 41.9 m -71.06 -71.66 0.25 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.31 -0.869 . . . . 0.0 109.288 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 26.2 ttp180 -146.01 142.8 28.98 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.301 -0.874 . . . . 0.0 109.32 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.4 mmt180 -100.69 134.66 43.33 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.315 -0.865 . . . . 0.0 109.839 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.464 ' O ' ' O ' ' A' ' 51' ' ' CYS . 18.7 m -71.53 -61.22 1.86 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.2 -0.937 . . . . 0.0 110.52 -179.444 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.587 ' SG ' ' N ' ' A' ' 52' ' ' SER . 32.5 t -56.23 -108.74 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.194 -0.942 . . . . 0.0 109.526 -179.542 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.587 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 62.0 m -52.57 113.91 1.21 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 120.944 -1.097 . . . . 0.0 108.2 179.35 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.436 ' O ' ' O ' ' A' ' 73' ' ' VAL . 18.0 tptm -74.2 100.83 3.79 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.75 -1.219 . . . . 0.0 109.553 -178.602 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.62 HG13 ' O ' ' A' ' 54' ' ' VAL . 8.3 p -128.55 116.12 40.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 179.421 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.599 ' O ' HD12 ' A' ' 55' ' ' ILE . 1.0 OUTLIER -127.97 130.87 69.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 179.841 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 16.6 m -128.56 111.96 13.8 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.378 -0.826 . . . . 0.0 108.896 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.532 ' H ' ' HB ' ' A' ' 69' ' ' THR . 14.9 mttm -124.19 113.37 18.22 Favored 'General case' 0 N--CA 1.511 2.583 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 178.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 71.6 p -113.04 134.73 54.39 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.49 -0.756 . . . . 0.0 109.742 -179.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 59' ' ' VAL . 2.8 m -131.49 123.98 53.67 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.047 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 178.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 42.4 p -107.2 120.39 41.98 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.683 -0.635 . . . . 0.0 110.252 -179.026 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.461 ' OD1' ' N ' ' A' ' 61' ' ' ASN . 1.2 m-20 -107.62 143.97 35.33 Favored 'General case' 0 N--CA 1.51 2.544 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 179.209 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.434 ' C ' ' H ' ' A' ' 64' ' ' GLY . . . -69.51 -28.95 66.48 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 119.976 -1.702 . . . . 0.0 112.331 -177.645 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.456 ' N ' ' OD1' ' A' ' 63' ' ' ASP . 0.6 OUTLIER -67.36 4.19 1.06 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.527 -1.358 . . . . 0.0 109.75 -178.969 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.434 ' H ' ' C ' ' A' ' 62' ' ' ALA . . . 96.52 6.16 58.64 Favored Glycine 0 N--CA 1.497 2.706 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 178.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -92.39 110.49 21.89 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.725 -1.456 . . . . 0.0 107.857 179.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 23.8 p -135.16 102.92 5.35 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.418 -0.801 . . . . 0.0 109.32 -179.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -96.91 128.64 44.07 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.21 -0.931 . . . . 0.0 110.185 -179.144 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.525 ' OG1' ' NZ ' ' A' ' 70' ' ' LYS . 40.0 p -106.36 108.96 20.74 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.532 -0.73 . . . . 0.0 109.489 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.532 ' HB ' ' H ' ' A' ' 57' ' ' LYS . 5.6 m -88.43 33.14 0.75 Allowed 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 179.005 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.525 ' NZ ' ' OG1' ' A' ' 68' ' ' THR . 21.0 pttm -66.14 60.99 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.286 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.499 ' N ' ' O ' ' A' ' 69' ' ' THR . 86.9 mt-10 -96.13 141.93 28.92 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 120.968 -1.083 . . . . 0.0 110.079 -179.37 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 72' ' ' VAL . 5.9 m -129.16 122.39 56.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 179.115 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.436 ' O ' ' O ' ' A' ' 53' ' ' LYS . 20.6 t -128.96 115.44 36.58 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.996 0 CA-C-O 122.323 1.058 . . . . 0.0 109.47 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.431 ' NZ ' ' O ' ' A' ' 79' ' ' SER . 66.4 tttm -64.46 154.12 36.76 Favored 'General case' 0 C--N 1.287 -2.129 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.433 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 68.6 m -60.57 112.32 1.94 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.228 -0.92 . . . . 0.0 109.392 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -88.69 36.18 0.79 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.194 -0.941 . . . . 0.0 109.37 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -157.38 -38.12 0.07 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.272 -0.893 . . . . 0.0 109.628 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -84.6 3.49 86.51 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . 0.476 ' C ' ' H ' ' A' ' 81' ' ' CYS . 8.5 m 53.96 -127.22 2.36 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.337 -1.096 . . . . 0.0 109.362 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.517 ' O ' ' N ' ' A' ' 82' ' ' GLY . 28.5 t70 -75.53 25.97 0.11 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.079 -1.013 . . . . 0.0 109.484 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.481 ' C ' ' H ' ' A' ' 83' ' ' ASP . 3.6 t 64.5 -63.58 0.16 Allowed 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.587 -0.696 . . . . 0.0 109.76 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' A' ' 80' ' ' ASP . . . -71.8 36.77 0.61 Allowed Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.655 -1.378 . . . . 0.0 109.655 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.481 ' H ' ' C ' ' A' ' 81' ' ' CYS . 19.0 p30 -61.04 158.64 13.12 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.126 -1.22 . . . . 0.0 109.47 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.72 -41.67 91.37 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.279 -0.888 . . . . 0.0 109.446 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 26.6 t0 53.61 90.12 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.348 -0.845 . . . . 0.0 109.411 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.46 ' CD2' ' N ' ' A' ' 87' ' ' ASP . 70.4 t80 -169.91 -101.69 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.295 -0.878 . . . . 0.0 109.444 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.46 ' N ' ' CD2' ' A' ' 86' ' ' PHE . 24.8 t70 -171.38 15.76 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.208 -0.933 . . . . 0.0 109.481 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 76.2 t90 -81.64 -43.22 18.89 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.266 -0.896 . . . . 0.0 109.375 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.469 ' CG ' ' N ' ' A' ' 90' ' ' HIS . 58.1 t-80 -65.72 168.32 7.93 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.302 -0.874 . . . . 0.0 109.501 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.469 ' N ' ' CG ' ' A' ' 89' ' ' HIS . 81.9 t60 52.3 86.13 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.163 -0.96 . . . . 0.0 109.45 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 11.4 m -143.36 60.53 1.4 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.3 -0.875 . . . . 0.0 109.365 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 49.72 67.24 4.63 Favored Pre-proline 0 N--CA 1.489 1.502 0 O-C-N 121.299 -0.875 . . . . 0.0 109.844 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.58 -43.51 26.73 Favored 'Trans proline' 0 C--N 1.317 -1.123 0 C-N-CA 121.314 1.343 . . . . 0.0 109.54 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.401 ' O ' ' O ' ' A' ' 95' ' ' ARG . 61.8 m -156.24 29.42 0.35 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.284 -0.885 . . . . 0.0 109.399 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.401 ' O ' ' O ' ' A' ' 94' ' ' SER . 39.3 ttp180 51.59 96.58 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.248 -0.908 . . . . 0.0 109.457 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 61.39 -150.96 43.73 Favored Glycine 0 N--CA 1.489 2.208 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -169.21 149.6 4.2 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.275 -1.132 . . . . 0.0 109.437 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 8.3 tp 55.08 -125.12 2.18 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.221 -0.924 . . . . 0.0 109.234 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -62.8 154.27 30.35 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.13 -0.981 . . . . 0.0 109.518 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -68.55 165.2 19.63 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.247 -0.908 . . . . 0.0 109.392 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -69.94 -55.54 9.39 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.18 -0.95 . . . . 0.0 109.494 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -68.9 123.98 22.46 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.25 -0.906 . . . . 0.0 109.516 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 37.2 m-70 -65.79 -31.2 72.03 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.266 -0.896 . . . . 0.0 109.413 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 52.92 73.84 0.33 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.319 -0.863 . . . . 0.0 109.458 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -72.96 166.33 23.26 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.233 -0.917 . . . . 0.0 109.429 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 24.3 ttpp -167.39 120.76 0.96 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.297 -0.877 . . . . 0.0 109.501 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -68.95 146.79 52.47 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.165 -0.959 . . . . 0.0 109.394 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.412 ' OD1' ' N ' ' A' ' 108' ' ' ASP . 12.4 p-10 -167.92 105.65 0.5 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.256 -0.902 . . . . 0.0 109.473 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -68.19 -48.65 64.66 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.25 -0.906 . . . . 0.0 109.454 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . 0.524 ' O ' ' CD2' ' A' ' 110' ' ' PHE . 48.1 p90 -77.41 121.99 24.56 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.279 -0.888 . . . . 0.0 109.459 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 12.3 m -164.13 63.91 0.15 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.245 -0.909 . . . . 0.0 109.31 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.514 ' O ' ' N ' ' A' ' 114' ' ' SER . 26.6 mtm-85 -150.46 71.3 1.05 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.288 -0.883 . . . . 0.0 109.376 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 69.2 m 51.9 -89.24 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.247 -0.908 . . . . 0.0 109.512 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.514 ' N ' ' O ' ' A' ' 112' ' ' ARG . 44.8 t -157.57 -166.19 1.96 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.288 -0.883 . . . . 0.0 109.385 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . 0.412 ' N ' ' OG ' ' A' ' 114' ' ' SER . 40.9 p-80 -166.8 51.04 0.07 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.276 -0.89 . . . . 0.0 109.463 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 51.49 63.88 2.07 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.233 -0.917 . . . . 0.0 109.447 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -77.05 -40.89 44.68 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.237 -0.914 . . . . 0.0 109.538 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -71.55 57.8 0.28 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.253 -0.904 . . . . 0.0 109.653 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -143.78 111.06 0.61 Allowed Glycine 0 N--CA 1.495 2.624 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -171.61 -36.92 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.319 -1.107 . . . . 0.0 109.476 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.426 ' OG1' ' N ' ' A' ' 122' ' ' GLY . 72.7 p -74.53 -87.27 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.227 -0.921 . . . . 0.0 109.515 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . 0.426 ' N ' ' OG1' ' A' ' 121' ' ' THR . . . 58.72 -133.99 52.56 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.621 HD23 ' N ' ' A' ' 123' ' ' LEU . 1.4 pt? -55.16 142.8 29.67 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.169 -1.194 . . . . 0.0 109.502 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.544 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -81.06 162.36 59.73 Favored Pre-proline 0 N--CA 1.493 1.68 0 O-C-N 121.183 -0.948 . . . . 0.0 108.721 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.544 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 2.1 Cg_endo -56.56 -174.33 0.04 OUTLIER 'Trans proline' 0 C--N 1.319 -1.001 0 C-N-CA 121.284 1.323 . . . . 0.0 109.798 179.59 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -171.32 -32.48 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.219 -0.926 . . . . 0.0 109.372 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -61.73 -105.93 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.232 -0.917 . . . . 0.0 109.435 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . 53.68 73.98 0.34 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.197 -0.939 . . . . 0.0 109.446 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.499 ' C ' ' H ' ' A' ' 131' ' ' GLY . . . 52.73 92.59 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.352 -0.842 . . . . 0.0 109.489 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.531 ' N ' HD23 ' A' ' 130' ' ' LEU . 0.7 OUTLIER -62.29 2.94 0.21 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.328 -0.857 . . . . 0.0 109.804 -179.871 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . 0.499 ' H ' ' C ' ' A' ' 129' ' ' ALA . . . -171.03 170.65 43.41 Favored Glycine 0 N--CA 1.489 2.196 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -169.98 80.87 0.11 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.329 -1.1 . . . . 0.0 109.43 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 52.9 p 50.69 90.76 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.252 -0.905 . . . . 0.0 109.507 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -69.56 74.09 0.44 Allowed Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 43.0 t -62.69 91.33 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.252 -1.146 . . . . 0.0 109.48 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 49.9 m -66.8 -55.48 14.7 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.237 -0.915 . . . . 0.0 109.495 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 24.4 p 52.07 -163.37 0.08 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.272 -0.893 . . . . 0.0 109.555 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 89.3 p -65.41 -62.16 1.69 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.26 -0.9 . . . . 0.0 109.448 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.456 ' CB ' ' NZ ' ' A' ' 139' ' ' LYS . 6.4 ttpm? -60.3 139.79 57.43 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.29 -0.881 . . . . 0.0 109.511 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 3.1 t -171.81 173.05 4.65 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.217 -0.927 . . . . 0.0 109.542 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 43.8 t -64.54 -173.17 0.09 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.273 -0.892 . . . . 0.0 109.455 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 74.6 p -64.03 -169.27 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.293 -0.88 . . . . 0.0 109.446 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 12.7 t-80 52.23 96.8 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.18 -0.95 . . . . 0.0 109.516 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 89.9 p -169.59 29.86 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.217 -0.927 . . . . 0.0 109.42 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 54.1 mttp 52.98 19.92 1.51 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.215 -0.928 . . . . 0.0 109.418 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 52.28 -169.64 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.213 -0.929 . . . . 0.0 109.466 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . 0.404 ' C ' ' H ' ' A' ' 149' ' ' SER . 65.8 m-85 -69.51 -173.52 0.58 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.27 -0.894 . . . . 0.0 109.43 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . 0.492 ' O ' ' N ' ' A' ' 150' ' ' SER . 29.1 m -71.29 8.32 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.26 -0.9 . . . . 0.0 109.529 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . 0.404 ' H ' ' C ' ' A' ' 147' ' ' PHE . 40.3 t 50.84 -92.27 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.258 -0.901 . . . . 0.0 109.493 -179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . 0.492 ' N ' ' O ' ' A' ' 148' ' ' VAL . 93.3 p -163.63 105.39 0.95 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.315 -0.866 . . . . 0.0 109.431 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . 0.536 ' C ' ' HG1' ' A' ' 152' ' ' THR . 79.2 p -171.09 -49.81 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.222 -0.924 . . . . 0.0 109.39 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . 0.536 ' HG1' ' C ' ' A' ' 151' ' ' SER . 50.7 p 48.52 -90.89 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.345 -0.847 . . . . 0.0 109.812 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . 0.522 ' N ' ' O ' ' A' ' 151' ' ' SER . 0.0 OUTLIER -47.51 91.04 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.229 -0.919 . . . . 0.0 109.923 -179.699 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.521 ' N ' ' O ' ' A' ' 152' ' ' THR . 5.5 t 57.46 113.01 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.339 -0.85 . . . . 0.0 109.907 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -69.85 82.31 0.46 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.229 -0.92 . . . . 0.0 109.323 179.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 34.7 ttm180 -61.82 -64.63 0.88 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.271 -0.893 . . . . 0.0 109.464 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 75.88 149.65 2.64 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 163.55 135.45 1.82 Allowed Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 96.5 p -75.02 132.73 41.55 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.213 -1.169 . . . . 0.0 109.457 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -151.34 148.57 28.31 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.238 -0.914 . . . . 0.0 109.396 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 15.8 tt -165.83 -18.15 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.213 -0.93 . . . . 0.0 109.481 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.439 ' CD ' ' N ' ' A' ' 162' ' ' GLU . 3.4 mp0 51.3 82.97 0.05 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.318 -0.863 . . . . 0.0 109.452 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . 0.433 ' C ' ' H ' ' A' ' 165' ' ' HIS . 45.5 t -67.99 -168.22 0.1 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.247 -0.908 . . . . 0.0 109.457 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . 0.4 ' N ' ' OG ' ' A' ' 163' ' ' SER . 48.9 tttm -73.53 40.35 0.11 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.221 -0.924 . . . . 0.0 109.33 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . 0.433 ' H ' ' C ' ' A' ' 163' ' ' SER . 73.4 t60 -171.26 94.57 0.18 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.248 -0.907 . . . . 0.0 109.429 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 61.1 t80 . . . . . 0 N--CA 1.489 1.517 0 CA-C-O 118.022 -0.989 . . . . 0.0 109.471 179.991 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.564 ' N ' ' SD ' ' A' ' 1' ' ' MET . 1.8 mpt? . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 61.78 51.02 60.15 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 33.4 m -164.34 111.08 1.05 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.277 -1.131 . . . . 0.0 109.379 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 -74.25 -160.85 0.11 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.241 -0.912 . . . . 0.0 109.412 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -160.6 92.42 0.96 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.128 -0.982 . . . . 0.0 109.381 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -58.62 -30.73 67.48 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.183 -0.948 . . . . 0.0 109.416 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 tm-20 -168.61 139.62 2.57 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.288 -0.882 . . . . 0.0 109.286 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.402 ' O ' ' OG ' ' A' ' 9' ' ' SER . . . 178.75 -58.85 0.09 OUTLIER Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.402 ' OG ' ' O ' ' A' ' 8' ' ' GLY . 24.2 p 53.13 -165.13 0.08 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.269 -1.136 . . . . 0.0 109.471 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.451 ' C ' ' H ' ' A' ' 12' ' ' SER . 29.1 m -61.97 -32.33 53.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.163 -0.961 . . . . 0.0 109.482 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.0 m -68.6 44.49 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.25 -0.906 . . . . 0.0 109.458 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.451 ' H ' ' C ' ' A' ' 10' ' ' VAL . 99.1 p -63.54 113.4 3.28 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.283 -0.886 . . . . 0.0 109.454 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 174.59 178.47 44.51 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 63.7 p -150.89 62.42 0.92 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.228 -1.16 . . . . 0.0 109.346 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.483 ' O ' ' N ' ' A' ' 17' ' ' GLU . 64.5 mttm -150.84 14.01 0.72 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.2 -0.938 . . . . 0.0 109.367 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 63.3 mt-30 -68.36 50.55 0.07 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.253 -0.904 . . . . 0.0 109.489 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.483 ' N ' ' O ' ' A' ' 15' ' ' LYS . 64.1 mt-10 -61.73 -31.66 71.84 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.204 -0.935 . . . . 0.0 109.467 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -66.87 -178.06 0.7 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.249 -0.907 . . . . 0.0 109.472 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.4 t-160 -169.56 -86.64 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.18 -0.95 . . . . 0.0 109.566 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.411 ' O ' ' O ' ' A' ' 21' ' ' GLY . 93.8 m -71.05 -82.53 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.295 -0.878 . . . . 0.0 109.495 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.411 ' O ' ' O ' ' A' ' 20' ' ' THR . . . 63.09 125.2 0.01 OUTLIER Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.448 ' CB ' ' NZ ' ' A' ' 22' ' ' LYS . 6.8 mtpm? -61.35 -9.69 5.8 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.218 -1.166 . . . . 0.0 109.502 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.503 ' N ' HD22 ' A' ' 23' ' ' LEU . 4.0 mm? -50.87 163.9 0.17 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.252 -0.905 . . . . 0.0 109.319 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 33.8 m -149.77 -146.72 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 O-C-N 121.315 -0.865 . . . . 0.0 109.101 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.8 t -155.24 149.47 25.92 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.138 -0.976 . . . . 0.0 109.412 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 22.4 m 54.05 86.95 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.194 -0.941 . . . . 0.0 109.493 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.419 ' O ' ' O ' ' A' ' 28' ' ' GLY . 3.9 mmmm -65.92 88.18 0.11 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.24 -0.913 . . . . 0.0 109.411 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.419 ' O ' ' O ' ' A' ' 27' ' ' LYS . . . -58.89 -109.61 0.01 OUTLIER Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -169.65 162.77 9.94 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.2 -1.177 . . . . 0.0 109.484 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -63.35 140.14 58.84 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.303 -0.873 . . . . 0.0 109.4 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -152.29 -32.96 0.14 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.292 -0.88 . . . . 0.0 109.253 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 60.6 tp -70.78 -40.4 72.62 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.245 -0.909 . . . . 0.0 109.128 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.576 ' N ' HD12 ' A' ' 33' ' ' LEU . 8.3 mp -70.88 78.74 0.63 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.252 -0.905 . . . . 0.0 109.249 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.415 ' C ' ' H ' ' A' ' 36' ' ' ASN . 17.3 pt -91.58 39.1 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.271 -0.893 . . . . 0.0 109.247 179.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -70.99 45.44 0.09 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.248 -0.908 . . . . 0.0 109.489 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.415 ' H ' ' C ' ' A' ' 34' ' ' ILE . 31.0 m120 -73.7 134.57 43.56 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.336 -0.853 . . . . 0.0 109.381 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -71.91 -126.6 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.195 -0.94 . . . . 0.0 109.392 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt -75.19 95.76 3.18 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.056 -1.027 . . . . 0.0 109.533 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.0 m -70.27 155.78 7.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.224 -0.923 . . . . 0.0 109.513 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 41.3 m -66.83 128.9 38.07 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.218 -0.927 . . . . 0.0 109.493 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.408 ' OG ' ' N ' ' A' ' 42' ' ' GLY . 80.8 p -62.73 -84.04 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.229 -0.92 . . . . 0.0 109.457 179.872 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.408 ' N ' ' OG ' ' A' ' 41' ' ' SER . . . 65.71 17.0 64.34 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 25.2 t60 -169.55 53.12 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.247 -1.149 . . . . 0.0 109.436 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 33.6 m -65.54 102.69 0.74 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.236 -0.915 . . . . 0.0 109.428 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 76.1 p -73.78 83.63 1.64 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.262 -0.898 . . . . 0.0 109.48 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.438 HG22 ' H ' ' A' ' 46' ' ' THR . 1.4 t -70.22 59.78 0.18 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.251 -0.905 . . . . 0.0 109.46 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.7 t -60.05 -16.22 29.51 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.291 -0.881 . . . . 0.0 109.435 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 45.4 ttp180 -145.86 142.74 29.1 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.218 -0.926 . . . . 0.0 109.304 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -103.5 144.71 31.05 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.367 -0.833 . . . . 0.0 109.754 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 68.7 m -66.16 -100.08 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.186 -0.946 . . . . 0.0 109.243 179.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 15.3 t -49.63 135.17 19.05 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.1 -1.0 . . . . 0.0 108.826 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.418 ' O ' ' OG ' ' A' ' 52' ' ' SER . 53.0 p 50.43 87.47 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.991 -1.068 . . . . 0.0 108.542 -179.158 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -75.48 104.05 5.87 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.228 -0.92 . . . . 0.0 109.824 -178.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.577 ' C ' HD12 ' A' ' 55' ' ' ILE . 7.1 p -111.43 114.08 46.07 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.872 0 O-C-N 121.526 -0.734 . . . . 0.0 109.569 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.602 ' N ' HD12 ' A' ' 55' ' ' ILE . 1.7 mp -107.82 119.93 58.28 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 179.209 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 5.9 m -129.8 113.9 15.26 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.495 -0.753 . . . . 0.0 109.684 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.521 ' N ' ' OG1' ' A' ' 69' ' ' THR . 21.2 mttt -121.99 112.48 18.33 Favored 'General case' 0 N--CA 1.509 2.519 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 178.175 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 44.1 p -118.8 134.76 54.92 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.445 -0.784 . . . . 0.0 109.754 -179.247 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.3 m -132.17 119.69 41.03 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 178.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 42.7 p -110.93 136.54 49.79 Favored 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.523 ' OD1' ' N ' ' A' ' 62' ' ' ALA . 16.5 t30 -161.59 153.37 19.17 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 120.641 -1.287 . . . . 0.0 109.84 179.331 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.523 ' N ' ' OD1' ' A' ' 61' ' ' ASN . . . -74.3 -8.95 58.01 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.707 -1.246 . . . . 0.0 110.536 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.412 ' HB2' HD21 ' A' ' 61' ' ' ASN . 29.2 t70 -72.95 -1.87 18.69 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.309 -0.869 . . . . 0.0 109.851 -179.732 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 95.67 9.48 57.51 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 108.891 -1.684 . . . . 0.0 108.891 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 47.7 mtp180 -99.82 89.21 4.01 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.196 -1.179 . . . . 0.0 108.404 179.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.8 m -125.28 72.76 1.26 Allowed 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 73.8 mt-10 -100.87 131.82 46.57 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.454 -0.779 . . . . 0.0 111.727 -177.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.6 m -108.19 112.39 24.87 Favored 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 178.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.521 ' OG1' ' N ' ' A' ' 57' ' ' LYS . 22.4 p -104.25 37.85 2.0 Allowed 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 179.369 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.4 pttm -65.46 61.73 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.676 -0.64 . . . . 0.0 109.463 179.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.506 ' N ' ' O ' ' A' ' 69' ' ' THR . 55.9 mt-10 -82.09 147.56 29.03 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.064 -1.022 . . . . 0.0 109.821 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 72' ' ' VAL . 22.9 m -127.81 134.94 64.31 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.584 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 14.7 t -128.69 118.03 46.24 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 CA-C-O 122.217 1.008 . . . . 0.0 109.264 179.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 44.9 mtmt -77.77 161.21 27.86 Favored 'General case' 0 C--N 1.29 -2.007 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.512 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.436 ' C ' ' H ' ' A' ' 77' ' ' ASP . 49.8 m -65.69 139.98 58.43 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.237 -0.914 . . . . 0.0 109.365 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -76.06 36.35 0.14 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.164 -0.96 . . . . 0.0 109.435 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.436 ' H ' ' C ' ' A' ' 75' ' ' SER . 8.3 t0 -159.0 -70.57 0.08 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.341 -0.849 . . . . 0.0 109.35 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 105.99 29.55 4.86 Favored Glycine 0 N--CA 1.497 2.765 0 N-CA-C 109.343 -1.503 . . . . 0.0 109.343 -179.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 43.5 t -75.52 -16.9 60.23 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.325 -1.103 . . . . 0.0 109.276 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.5 ' O ' ' SG ' ' A' ' 81' ' ' CYS . 11.1 p-10 -166.84 39.19 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.418 -0.801 . . . . 0.0 109.079 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.52 ' O ' ' N ' ' A' ' 83' ' ' ASP . 62.5 m -154.64 159.16 40.63 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.455 -0.778 . . . . 0.0 109.457 179.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 45.81 16.06 0.12 Allowed Glycine 0 N--CA 1.493 2.471 0 N-CA-C 109.984 -1.246 . . . . 0.0 109.984 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.52 ' N ' ' O ' ' A' ' 81' ' ' CYS . 25.2 m-20 -157.93 -172.83 4.08 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.139 -1.213 . . . . 0.0 109.568 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -167.92 8.0 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.327 -0.858 . . . . 0.0 109.409 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 63.0 t0 -167.64 113.63 0.72 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.232 -0.917 . . . . 0.0 109.387 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -75.39 -23.38 57.06 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.281 -0.887 . . . . 0.0 109.493 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -60.65 177.99 0.26 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.201 -0.937 . . . . 0.0 109.498 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . 0.474 ' O ' ' CG ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -169.09 -168.26 0.82 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.285 -0.884 . . . . 0.0 109.343 179.969 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.474 ' CG ' ' O ' ' A' ' 88' ' ' TRP . 96.9 m-70 -155.97 114.28 3.39 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.209 -0.932 . . . . 0.0 109.392 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.0 m-70 -64.74 -78.2 0.05 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.234 -0.916 . . . . 0.0 109.551 -179.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 71.5 p -149.87 146.63 27.22 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.324 -0.86 . . . . 0.0 109.237 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -71.53 150.67 93.75 Favored Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 121.182 -0.949 . . . . 0.0 109.039 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -56.4 -71.47 0.04 OUTLIER 'Trans proline' 0 C--N 1.322 -0.832 0 C-N-CA 120.967 1.111 . . . . 0.0 109.765 179.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 89.4 p -69.0 127.85 34.61 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.267 -0.896 . . . . 0.0 109.478 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.58 HH21 HD21 ' A' ' 97' ' ' ASN . 79.2 mtm180 -66.41 -73.56 0.13 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.252 -0.905 . . . . 0.0 109.398 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -177.88 12.62 0.03 OUTLIER Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.58 HD21 HH21 ' A' ' 95' ' ' ARG . 66.0 m-80 -62.43 140.51 58.57 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.28 -1.13 . . . . 0.0 109.479 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.569 HD22 ' N ' ' A' ' 98' ' ' LEU . 3.5 mm? -70.1 98.05 1.27 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.297 -0.877 . . . . 0.0 109.235 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -63.06 148.88 46.51 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.228 -0.92 . . . . 0.0 109.443 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -61.09 161.81 8.08 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.259 -0.901 . . . . 0.0 109.484 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -67.82 -47.11 69.96 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.277 -0.889 . . . . 0.0 109.386 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -69.16 79.08 0.35 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.235 -0.916 . . . . 0.0 109.508 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.429 ' CD2' ' H ' ' A' ' 103' ' ' HIS . 9.0 p80 -62.73 -22.81 66.81 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.199 -0.938 . . . . 0.0 109.495 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 62.6 ttt180 -55.67 158.13 3.7 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.228 -0.92 . . . . 0.0 109.447 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -53.81 -59.96 3.94 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.173 -0.954 . . . . 0.0 109.444 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.416 ' O ' ' O ' ' A' ' 107' ' ' ASP . 21.9 pttm -168.99 -149.84 0.08 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.223 -0.923 . . . . 0.0 109.464 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.416 ' O ' ' O ' ' A' ' 106' ' ' LYS . 13.4 t70 55.52 170.1 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.267 -0.896 . . . . 0.0 109.497 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -166.85 174.1 8.85 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.276 -0.89 . . . . 0.0 109.51 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -77.37 -47.5 19.7 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.278 -0.889 . . . . 0.0 109.47 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . 0.471 ' O ' ' CD2' ' A' ' 110' ' ' PHE . 9.0 p90 -74.53 91.31 2.28 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.293 -0.879 . . . . 0.0 109.464 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 70.2 p -79.52 81.93 5.71 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.238 -0.914 . . . . 0.0 109.468 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.406 ' HG2' ' H ' ' A' ' 114' ' ' SER . 61.4 ttt180 -169.16 -75.15 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.248 -0.907 . . . . 0.0 109.467 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.417 ' O ' ' O ' ' A' ' 114' ' ' SER . 33.5 t 49.92 23.42 1.06 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.308 -0.87 . . . . 0.0 109.447 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.417 ' O ' ' O ' ' A' ' 113' ' ' SER . 4.8 p 62.26 140.07 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.31 -0.869 . . . . 0.0 109.505 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 56.2 m80 -75.71 15.04 0.55 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.311 -0.868 . . . . 0.0 109.48 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.415 ' H ' ' C ' ' A' ' 114' ' ' SER . 37.7 mt-10 52.35 52.75 13.59 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.175 -0.953 . . . . 0.0 109.394 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 51.03 -100.95 0.09 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.225 -0.922 . . . . 0.0 109.44 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.448 ' O ' ' N ' ' A' ' 120' ' ' ARG . 30.1 m-20 53.04 -147.76 0.47 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.141 -0.974 . . . . 0.0 109.453 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -59.16 86.8 0.02 OUTLIER Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.448 ' N ' ' O ' ' A' ' 118' ' ' ASP . 67.5 ttt180 -168.42 126.09 1.09 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.259 -1.142 . . . . 0.0 109.449 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 69.6 p -68.48 139.8 55.69 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.215 -0.928 . . . . 0.0 109.482 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -73.35 -95.44 0.1 OUTLIER Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.577 ' N ' HD12 ' A' ' 123' ' ' LEU . 8.0 mp -65.34 127.22 30.86 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.199 -1.177 . . . . 0.0 109.188 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.551 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -78.91 162.5 64.66 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.328 -0.858 . . . . 0.0 108.84 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.551 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 2.9 Cg_endo -55.64 154.2 26.48 Favored 'Trans proline' 0 C--N 1.318 -1.036 0 C-N-CA 121.315 1.343 . . . . 0.0 109.734 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 67.5 mm-40 -80.71 18.06 1.04 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.293 -0.879 . . . . 0.0 109.582 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -146.15 99.66 3.27 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.18 -0.95 . . . . 0.0 109.441 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -77.78 111.28 13.42 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.312 -0.868 . . . . 0.0 109.459 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -79.67 -68.19 0.69 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.371 -0.831 . . . . 0.0 109.496 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.557 ' N ' HD12 ' A' ' 130' ' ' LEU . 8.5 mp 53.8 -97.16 0.06 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.435 -0.79 . . . . 0.0 109.238 -179.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 176.29 10.63 0.02 OUTLIER Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.513 ' OE1' ' N ' ' A' ' 132' ' ' GLU . 0.6 OUTLIER -60.02 -11.36 5.65 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.228 -1.16 . . . . 0.0 109.337 179.935 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 89.4 p -171.56 137.17 1.03 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.246 -0.909 . . . . 0.0 109.526 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 177.97 84.65 0.06 OUTLIER Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.314 -1.514 . . . . 0.0 109.314 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 90.0 p -66.16 -24.15 66.6 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.267 -1.137 . . . . 0.0 109.517 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 74.4 m -166.58 176.07 7.54 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.232 -0.918 . . . . 0.0 109.375 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 84.4 p -168.94 33.21 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.328 -0.857 . . . . 0.0 109.309 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 44.0 t -60.14 -61.35 2.67 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.338 -0.851 . . . . 0.0 109.485 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt 51.09 86.44 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.265 -0.897 . . . . 0.0 109.306 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 82.7 p -81.48 154.46 26.32 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.219 -0.926 . . . . 0.0 109.408 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 78.1 p -167.17 12.8 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.262 -0.899 . . . . 0.0 109.507 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 53.2 p -62.42 -149.48 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.3 -0.875 . . . . 0.0 109.496 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -61.04 96.64 0.05 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.275 -0.89 . . . . 0.0 109.379 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 55.3 m -62.58 -4.7 2.11 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.208 -0.932 . . . . 0.0 109.413 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 47.3 mtmt -60.2 129.92 44.11 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.245 -0.909 . . . . 0.0 109.41 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -151.81 -87.58 0.07 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.208 -0.933 . . . . 0.0 109.368 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 53.21 -150.91 0.34 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.217 -0.927 . . . . 0.0 109.567 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 26.8 t -59.33 -25.13 29.84 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.291 -0.881 . . . . 0.0 109.433 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 24.1 p 53.23 -168.21 0.06 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.257 -0.902 . . . . 0.0 109.395 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 52.3 m -68.07 110.26 3.87 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.237 -0.914 . . . . 0.0 109.488 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 27.7 t -172.0 141.65 1.36 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.23 -0.919 . . . . 0.0 109.494 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . 0.403 ' O ' ' OG1' ' A' ' 153' ' ' THR . 74.1 p -65.08 127.1 30.22 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.251 -0.906 . . . . 0.0 109.465 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . 0.501 ' O ' ' N ' ' A' ' 155' ' ' ASN . 55.1 m -166.34 -65.6 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.276 -0.89 . . . . 0.0 109.503 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.478 ' O ' ' N ' ' A' ' 156' ' ' ARG . 2.8 m -60.8 80.25 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.294 -0.879 . . . . 0.0 109.503 -179.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . 0.501 ' N ' ' O ' ' A' ' 153' ' ' THR . 50.4 t30 -68.43 54.3 0.08 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.222 -0.924 . . . . 0.0 109.236 179.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . 0.478 ' N ' ' O ' ' A' ' 154' ' ' VAL . 81.8 mtm180 -90.6 145.21 25.04 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.334 -0.854 . . . . 0.0 109.418 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -174.47 -150.21 7.58 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -81.23 106.58 2.6 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . 0.407 ' H ' ' H ' ' A' ' 160' ' ' ALA . 31.9 t -168.54 -8.47 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.293 -1.122 . . . . 0.0 109.455 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.407 ' H ' ' H ' ' A' ' 159' ' ' SER . . . -173.09 165.86 4.96 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.281 -0.887 . . . . 0.0 109.52 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 17.4 mm 55.72 -116.25 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.319 -0.863 . . . . 0.0 109.408 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -81.45 -167.22 1.39 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 120.908 -1.12 . . . . 0.0 109.435 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 29.7 t -172.9 93.78 0.11 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.262 -0.899 . . . . 0.0 109.491 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -67.8 105.22 1.88 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.266 -0.896 . . . . 0.0 109.475 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 12.0 t-80 -66.3 105.69 1.5 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.25 -0.906 . . . . 0.0 109.501 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 118.02 -0.99 . . . . 0.0 109.477 -179.971 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 mmt . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -75.21 97.64 1.06 Allowed Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.444 -1.463 . . . . 0.0 109.444 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 82.8 p -63.21 -35.12 79.25 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.246 -1.15 . . . . 0.0 109.489 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -73.4 -39.09 65.34 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.289 -0.882 . . . . 0.0 109.46 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -149.42 140.69 23.15 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.236 -0.915 . . . . 0.0 109.426 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.6 tp10 -48.87 -27.49 3.09 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.188 -0.945 . . . . 0.0 109.464 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -168.23 -66.38 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.265 -0.897 . . . . 0.0 109.443 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 67.5 131.83 0.03 OUTLIER Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 78.7 p -168.61 151.44 5.26 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.223 -1.163 . . . . 0.0 109.425 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 30.2 m -67.73 -165.49 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.22 -0.925 . . . . 0.0 109.485 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 72.6 m -168.0 -100.5 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.327 -0.858 . . . . 0.0 109.471 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.8 t -173.0 177.5 2.76 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.311 -0.868 . . . . 0.0 109.467 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.446 ' C ' ' H ' ' A' ' 15' ' ' LYS . . . 178.04 70.16 0.06 OUTLIER Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 81.0 p -74.15 36.72 0.1 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.264 -1.139 . . . . 0.0 109.496 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.446 ' H ' ' C ' ' A' ' 13' ' ' GLY . 1.0 OUTLIER -172.55 61.88 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.265 -0.897 . . . . 0.0 109.431 179.967 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -163.94 51.28 0.14 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.217 -0.927 . . . . 0.0 109.328 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.439 ' O ' ' O ' ' A' ' 18' ' ' PHE . 15.4 pt-20 -77.41 -35.18 54.45 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.232 -0.918 . . . . 0.0 109.427 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.439 ' O ' ' O ' ' A' ' 17' ' ' GLU . 63.4 m-85 51.75 99.59 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.377 -0.827 . . . . 0.0 109.583 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.439 ' CG ' ' O ' ' A' ' 19' ' ' HIS . 85.2 t60 -148.95 48.87 0.99 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.304 -0.873 . . . . 0.0 109.357 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' A' ' 19' ' ' HIS . 74.0 m -165.91 90.0 0.44 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.351 -0.843 . . . . 0.0 109.34 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -175.87 128.88 1.44 Allowed Glycine 0 N--CA 1.489 2.232 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -98.2 82.36 2.92 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.29 -1.123 . . . . 0.0 109.305 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.573 ' N ' HD12 ' A' ' 23' ' ' LEU . 9.0 mp -71.26 145.22 49.71 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.204 -0.935 . . . . 0.0 109.456 -179.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.694 HG12 ' H ' ' A' ' 25' ' ' THR . 18.7 t -63.43 178.08 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.337 -0.852 . . . . 0.0 109.141 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.694 ' H ' HG12 ' A' ' 24' ' ' VAL . 71.7 p -138.34 57.17 1.71 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.364 -0.835 . . . . 0.0 109.254 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 33.4 p -62.33 137.78 58.32 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.2 -0.938 . . . . 0.0 109.411 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -79.44 -44.91 20.46 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.17 -0.956 . . . . 0.0 109.385 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 139.32 -117.52 1.38 Allowed Glycine 0 N--CA 1.496 2.681 0 N-CA-C 109.313 -1.515 . . . . 0.0 109.313 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -172.79 154.23 2.89 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.252 -1.146 . . . . 0.0 109.377 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 41.4 mmtm -63.04 -73.75 0.11 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.231 -0.918 . . . . 0.0 109.438 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -169.63 115.16 0.55 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.272 -0.892 . . . . 0.0 109.465 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.584 ' N ' HD12 ' A' ' 32' ' ' LEU . 8.4 mp -77.76 -26.64 50.01 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.21 -0.932 . . . . 0.0 109.321 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 20.7 mt -65.26 120.42 12.72 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.178 -0.951 . . . . 0.0 109.377 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 71.0 mt 52.22 80.19 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.265 -0.897 . . . . 0.0 109.475 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -71.78 171.27 11.94 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.329 -0.857 . . . . 0.0 109.486 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.43 ' O ' ' OE2' ' A' ' 37' ' ' GLU . 10.6 t30 -68.34 75.96 0.25 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.175 -0.953 . . . . 0.0 109.448 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.43 ' OE2' ' O ' ' A' ' 36' ' ' ASN . 66.7 mm-40 -138.67 -156.6 0.7 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.383 -0.823 . . . . 0.0 109.225 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -145.6 -146.3 0.19 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.286 -0.884 . . . . 0.0 109.429 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 33.0 m -91.36 156.23 3.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.203 -0.936 . . . . 0.0 109.531 -179.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 14.2 m -166.48 61.92 0.1 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.322 -0.861 . . . . 0.0 109.347 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 44.9 m -74.29 -161.86 0.13 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.243 -0.911 . . . . 0.0 109.596 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -176.8 151.08 10.85 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.5 m80 -77.25 59.34 1.77 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.214 -1.169 . . . . 0.0 109.471 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.5 t -68.3 -9.34 47.02 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.243 -0.911 . . . . 0.0 109.42 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 40.5 m -62.78 91.78 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.282 -0.886 . . . . 0.0 109.488 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 26.3 m 51.22 79.22 0.1 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.237 -0.915 . . . . 0.0 109.375 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 59.8 p -64.23 129.8 41.37 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.169 -0.957 . . . . 0.0 109.492 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 5.5 ptp180 -145.78 149.61 34.68 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.242 -0.911 . . . . 0.0 109.299 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -93.88 135.09 35.56 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.241 -0.912 . . . . 0.0 109.818 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.4 m -64.54 176.75 1.03 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.215 -0.928 . . . . 0.0 109.507 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.425 ' O ' ' N ' ' A' ' 53' ' ' LYS . 64.6 m 46.84 -122.77 1.31 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.206 -0.934 . . . . 0.0 108.997 -179.724 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 43.5 t -51.87 99.81 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 178.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.425 ' N ' ' O ' ' A' ' 51' ' ' CYS . 93.7 mttt -77.87 101.43 6.79 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.11 -0.994 . . . . 0.0 110.318 -178.612 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.3 t -106.72 114.13 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.498 HG23 ' O ' ' A' ' 55' ' ' ILE . 9.4 tp -127.99 126.98 67.41 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.481 -0.762 . . . . 0.0 108.998 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.474 ' O ' ' CG2' ' A' ' 56' ' ' THR . 0.8 OUTLIER -128.88 117.91 21.81 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.515 -0.741 . . . . 0.0 109.341 179.839 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.513 ' H ' ' HB ' ' A' ' 69' ' ' THR . 26.5 ttmt -127.08 114.53 17.88 Favored 'General case' 0 N--CA 1.521 3.102 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 178.568 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.5 m -115.66 131.42 56.94 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.624 -0.673 . . . . 0.0 109.86 -179.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' ' 59' ' ' VAL . 2.9 m -132.12 119.86 41.78 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.141 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 43.8 p -110.17 134.0 52.65 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -179.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -137.36 172.83 12.4 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.311 -0.868 . . . . 0.0 109.752 179.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.27 -40.33 95.75 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 120.807 -1.183 . . . . 0.0 112.566 -177.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.486 ' N ' ' OD1' ' A' ' 63' ' ' ASP . 2.0 m-20 -69.01 4.37 1.58 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.378 -1.451 . . . . 0.0 110.04 -178.437 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.527 ' O ' ' N ' ' A' ' 66' ' ' THR . . . 91.82 8.92 63.13 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 110.041 -1.224 . . . . 0.0 110.041 179.308 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.441 ' O ' ' O ' ' A' ' 59' ' ' VAL . 23.6 ttm180 -63.94 79.5 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.43 0 O-C-N 120.717 -1.461 . . . . 0.0 108.193 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.527 ' N ' ' O ' ' A' ' 64' ' ' GLY . 73.3 p -111.56 72.58 0.78 Allowed 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 -179.716 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -94.27 130.66 40.45 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.369 -0.832 . . . . 0.0 109.936 -178.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.41 ' C ' ' H ' ' A' ' 70' ' ' LYS . 4.0 m -108.55 109.53 20.79 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.49 -0.756 . . . . 0.0 109.656 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.528 ' O ' ' N ' ' A' ' 71' ' ' GLU . 3.8 m -82.29 39.63 0.6 Allowed 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.087 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.41 ' H ' ' C ' ' A' ' 68' ' ' THR . 13.3 ptpt -65.71 55.27 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.073 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.528 ' N ' ' O ' ' A' ' 69' ' ' THR . 54.2 mt-10 -89.28 131.97 35.12 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.091 -1.005 . . . . 0.0 109.983 -179.441 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.4 p -128.3 136.81 59.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 17.5 t -127.95 117.29 45.61 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 CA-C-O 122.012 0.911 . . . . 0.0 109.283 179.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -82.73 -31.55 28.4 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 6.9 m -81.8 -148.28 0.07 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.078 -1.014 . . . . 0.0 109.328 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.507 ' C ' ' H ' ' A' ' 78' ' ' GLY . 53.9 tt0 57.76 75.95 0.35 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.225 -0.922 . . . . 0.0 109.606 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.6 t70 64.61 -6.49 0.3 Allowed 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.33 -0.856 . . . . 0.0 109.562 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.507 ' H ' ' C ' ' A' ' 76' ' ' GLU . . . -86.25 -48.51 4.55 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 179.65 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 79.6 p -50.55 -35.12 28.25 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.242 -1.151 . . . . 0.0 109.074 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -94.37 27.49 2.92 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.405 -0.81 . . . . 0.0 109.451 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 35.0 t -157.99 -57.27 0.07 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.246 -0.908 . . . . 0.0 109.186 179.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.481 ' N ' ' O ' ' A' ' 78' ' ' GLY . . . -68.01 -34.4 81.64 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.477 ' CG ' ' H ' ' A' ' 84' ' ' ALA . 37.0 t0 -64.97 -141.3 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.303 -1.116 . . . . 0.0 109.442 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.477 ' H ' ' CG ' ' A' ' 83' ' ' ASP . . . -172.61 82.71 0.05 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.184 -0.947 . . . . 0.0 109.471 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.424 ' O ' ' OD2' ' A' ' 85' ' ' ASP . 6.4 p-10 40.7 84.03 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.74 -0.6 . . . . 0.0 110.217 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -165.17 95.45 0.67 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.26 -0.9 . . . . 0.0 109.486 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -168.33 95.76 0.39 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.18 -0.95 . . . . 0.0 109.476 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 56.9 t90 -169.2 91.17 0.23 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.297 -0.877 . . . . 0.0 109.474 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.475 ' N ' ' CD2' ' A' ' 89' ' ' HIS . 0.3 OUTLIER -59.9 -170.4 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.215 -0.928 . . . . 0.0 109.439 -179.905 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 69.0 m-70 -72.76 149.03 44.03 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.268 -0.895 . . . . 0.0 109.35 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.508 ' OG1' ' N ' ' A' ' 92' ' ' PHE . 1.2 t -64.07 -169.8 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.191 -0.943 . . . . 0.0 109.441 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.508 ' N ' ' OG1' ' A' ' 91' ' ' THR . 0.1 OUTLIER -159.37 68.64 3.19 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.281 -0.887 . . . . 0.0 109.242 179.932 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -62.78 146.97 95.23 Favored 'Trans proline' 0 C--N 1.318 -1.062 0 C-N-CA 121.336 1.358 . . . . 0.0 109.71 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.451 ' C ' ' H ' ' A' ' 96' ' ' GLY . 38.0 m -78.95 163.76 24.97 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.223 -0.923 . . . . 0.0 109.43 -179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 28.8 mmt180 -67.78 6.08 0.74 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.231 -0.918 . . . . 0.0 109.383 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.451 ' H ' ' C ' ' A' ' 94' ' ' SER . . . 66.32 16.97 65.64 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 15.1 p-10 -64.08 142.64 58.34 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.234 -1.157 . . . . 0.0 109.447 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.404 ' C ' HD13 ' A' ' 98' ' ' LEU . 0.3 OUTLIER 59.57 101.19 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.212 -0.93 . . . . 0.0 109.071 179.937 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -55.66 141.09 39.2 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.34 -0.85 . . . . 0.0 109.529 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -161.37 -73.72 0.06 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.233 -0.917 . . . . 0.0 109.47 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -68.35 -56.8 7.27 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.195 -0.941 . . . . 0.0 109.399 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -97.12 97.86 9.55 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.4 -0.813 . . . . 0.0 109.302 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -54.37 -22.46 12.34 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.247 -0.908 . . . . 0.0 109.699 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 55.96 62.57 2.33 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.146 -0.971 . . . . 0.0 109.465 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -163.92 5.19 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.314 -0.866 . . . . 0.0 109.339 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 44.8 tttm 57.82 -127.09 1.64 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.276 -0.89 . . . . 0.0 109.258 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.48 ' CG ' ' H ' ' A' ' 108' ' ' ASP . 24.7 t0 -76.48 -173.45 2.52 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.07 -1.019 . . . . 0.0 109.446 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.48 ' H ' ' CG ' ' A' ' 107' ' ' ASP . 7.5 m-20 -157.46 -24.17 0.09 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.271 -0.893 . . . . 0.0 109.275 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.551 ' O ' ' CG ' ' A' ' 110' ' ' PHE . 91.4 m-85 -79.61 -5.39 54.91 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.366 -0.834 . . . . 0.0 109.528 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . 0.551 ' CG ' ' O ' ' A' ' 109' ' ' PHE . 51.6 p90 42.09 -167.33 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.857 0 CA-C-O 121.455 0.645 . . . . 0.0 110.439 -179.777 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 39.8 p -154.03 -61.79 0.13 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.381 -0.825 . . . . 0.0 109.045 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 30.7 ptt180 -67.16 167.59 11.83 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.339 -0.851 . . . . 0.0 109.412 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 46.0 m -154.84 -69.43 0.13 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.229 -0.919 . . . . 0.0 109.472 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 47.4 t -66.3 96.27 0.34 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.216 -0.928 . . . . 0.0 109.525 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 77.7 m-70 -67.08 -27.75 67.62 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.24 -0.913 . . . . 0.0 109.461 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -67.84 85.45 0.22 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.319 -0.863 . . . . 0.0 109.551 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -67.18 -69.95 0.28 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.243 -0.911 . . . . 0.0 109.476 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -62.54 115.68 4.47 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.211 -0.93 . . . . 0.0 109.441 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.545 ' O ' ' N ' ' A' ' 121' ' ' THR . . . -171.29 -65.19 0.04 OUTLIER Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 58.0 mtt180 64.43 -42.38 0.28 Allowed 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.834 -0.804 . . . . 0.0 110.059 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.545 ' N ' ' O ' ' A' ' 119' ' ' GLY . 6.7 t -67.11 -155.8 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.993 -1.067 . . . . 0.0 109.489 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . 0.465 ' N ' ' OG1' ' A' ' 121' ' ' THR . . . -172.0 -165.43 29.14 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 14.3 mt -68.85 135.17 50.7 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.157 -1.202 . . . . 0.0 109.37 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.536 ' HB1' ' HD2' ' A' ' 125' ' ' PRO . . . -73.8 162.51 73.8 Favored Pre-proline 0 N--CA 1.49 1.56 0 O-C-N 121.236 -0.915 . . . . 0.0 108.838 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.536 ' HD2' ' HB1' ' A' ' 124' ' ' ALA . 2.1 Cg_endo -56.53 131.27 44.65 Favored 'Trans proline' 0 C--N 1.319 -0.989 0 C-N-CA 121.293 1.329 . . . . 0.0 109.709 179.677 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -75.4 8.12 3.03 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.205 -0.934 . . . . 0.0 109.324 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -151.49 70.69 0.97 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.294 -0.878 . . . . 0.0 109.37 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -78.72 -10.55 59.8 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.279 -0.888 . . . . 0.0 109.516 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 54.05 76.93 0.21 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.305 -0.872 . . . . 0.0 109.423 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 15.7 mt -74.79 111.24 9.79 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.311 -0.868 . . . . 0.0 109.458 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . -146.63 -49.67 0.03 OUTLIER Glycine 0 N--CA 1.494 2.54 0 N-CA-C 109.464 -1.454 . . . . 0.0 109.464 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -68.08 -76.22 0.09 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.272 -1.134 . . . . 0.0 109.465 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 80.7 p -80.37 108.9 14.36 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.22 -0.925 . . . . 0.0 109.499 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -173.11 -161.39 23.37 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 94.5 p -67.55 118.65 11.14 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.229 -1.159 . . . . 0.0 109.53 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 40.5 t -70.28 -12.79 61.83 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.173 -0.954 . . . . 0.0 109.497 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 69.6 m 51.24 -100.73 0.09 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.283 -0.886 . . . . 0.0 109.462 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 40.3 t 50.82 -99.16 0.07 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.204 -0.935 . . . . 0.0 109.436 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -169.7 158.5 7.61 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.175 -0.953 . . . . 0.0 109.395 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' THR . . . . . . . . . . . . . 37.6 m -162.99 118.06 1.74 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.258 -0.901 . . . . 0.0 109.366 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 28.7 t -173.06 -39.67 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.259 -0.901 . . . . 0.0 109.384 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 5.1 m 52.04 47.46 24.71 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.26 -0.9 . . . . 0.0 109.416 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 29.3 p-80 -79.1 -177.21 5.5 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.275 -0.89 . . . . 0.0 109.444 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 30.3 t -169.91 -97.09 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.204 -0.935 . . . . 0.0 109.472 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 38.0 mmtm 55.28 40.91 31.69 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.261 -0.899 . . . . 0.0 109.439 -179.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . 0.405 ' HG3' ' H ' ' A' ' 149' ' ' SER . 17.2 pt20 -58.79 140.09 55.48 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.294 -0.879 . . . . 0.0 109.478 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -77.86 -20.68 52.6 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.188 -0.945 . . . . 0.0 109.458 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 37.7 t -67.84 -41.08 84.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 O-C-N 121.292 -0.88 . . . . 0.0 109.466 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . 0.433 ' O ' ' O ' ' A' ' 150' ' ' SER . 12.8 t 52.49 55.04 9.67 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.284 -0.885 . . . . 0.0 109.501 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . 0.433 ' O ' ' O ' ' A' ' 149' ' ' SER . 2.0 m 61.04 144.08 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.327 -0.858 . . . . 0.0 109.557 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . 0.423 ' O ' ' O ' ' A' ' 152' ' ' THR . 14.1 t -175.21 -65.35 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.224 -0.923 . . . . 0.0 109.509 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' THR . . . . . 0.423 ' O ' ' O ' ' A' ' 151' ' ' SER . 7.5 p 52.01 178.22 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.264 -0.897 . . . . 0.0 109.437 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 66.7 p -73.5 170.81 14.37 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.234 -0.916 . . . . 0.0 109.441 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 5.6 m -150.86 64.08 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 121.27 -0.894 . . . . 0.0 109.311 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 5.7 p-10 -157.06 123.31 4.89 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.293 -0.879 . . . . 0.0 109.388 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 86.2 mtm180 -99.61 -174.61 2.76 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.343 -0.848 . . . . 0.0 109.318 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -49.6 -75.29 0.21 Allowed Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -75.83 143.93 30.65 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 66.1 m -164.66 15.8 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.319 -1.106 . . . . 0.0 109.472 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -171.66 -167.6 0.52 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.3 -0.875 . . . . 0.0 109.449 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 161' ' ' ILE . . . . . 0.5 HG23 ' O ' ' A' ' 161' ' ' ILE . 9.7 tt -167.14 92.89 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.212 -0.93 . . . . 0.0 109.486 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 49.1 -146.21 0.36 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.105 -0.997 . . . . 0.0 109.504 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 68.2 m -165.17 42.55 0.08 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.206 -0.934 . . . . 0.0 109.475 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -169.07 67.76 0.06 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.219 -0.926 . . . . 0.0 109.418 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 165' ' ' HIS . . . . . 0.417 ' CD2' ' H ' ' A' ' 165' ' ' HIS . 13.1 p80 -63.42 -46.17 87.58 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.289 -0.882 . . . . 0.0 109.495 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 166' ' ' PHE . . . . . 0.4 ' N ' ' CG ' ' A' ' 165' ' ' HIS . 59.9 t80 . . . . . 0 N--CA 1.49 1.55 0 CA-C-O 118.022 -0.99 . . . . 0.0 109.453 -179.969 . . . . . . . . 1 1 . 1 stop_ save_